data_25768 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25768 _Entry.PDB_ID 2N6L save_ save_delta_chem_shifts _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts _Entity_delta_chem_shifts.Model_type single _Entity_delta_chem_shifts.Entry_ID 25768 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 HIS C C 2 175.310 175.310 173.548 1.762 25768 2 1 1 . 1 1 3 3 LYS N N 3 122.080 122.080 123.318 -1.238 25768 3 1 1 . 1 1 3 3 LYS C C 3 173.490 173.490 174.539 -1.049 25768 4 1 1 . 1 1 3 3 LYS CA C 3 55.050 55.050 54.867 0.183 25768 5 1 1 . 1 1 3 3 LYS CB C 3 35.380 35.380 36.714 -1.334 25768 6 1 1 . 1 1 3 3 LYS H H 3 8.620 8.620 8.284 0.336 25768 7 1 1 . 1 1 4 4 ALA N N 4 120.860 120.860 122.662 -1.802 25768 8 1 1 . 1 1 4 4 ALA C C 4 178.190 178.190 178.026 0.164 25768 9 1 1 . 1 1 4 4 ALA CA C 4 53.480 53.480 52.243 1.237 25768 10 1 1 . 1 1 4 4 ALA CB C 4 18.140 18.140 18.087 0.053 25768 11 1 1 . 1 1 4 4 ALA H H 4 8.580 8.580 8.201 0.379 25768 12 1 1 . 1 1 5 5 GLY N N 5 112.890 112.890 113.361 -0.471 25768 13 1 1 . 1 1 5 5 GLY C C 5 173.830 173.830 174.264 -0.434 25768 14 1 1 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.439 0.441 25768 15 1 1 . 1 1 5 5 GLY H H 5 9.210 9.210 8.177 1.033 25768 16 1 1 . 1 1 6 6 ASP N N 6 121.590 121.590 120.771 0.819 25768 17 1 1 . 1 1 6 6 ASP C C 6 174.380 174.380 175.613 -1.233 25768 18 1 1 . 1 1 6 6 ASP CA C 6 55.790 55.790 54.812 0.979 25768 19 1 1 . 1 1 6 6 ASP CB C 6 41.760 41.760 41.501 0.259 25768 20 1 1 . 1 1 6 6 ASP H H 6 7.620 7.620 7.514 0.106 25768 21 1 1 . 1 1 7 7 PHE N N 7 120.860 120.860 120.145 0.715 25768 22 1 1 . 1 1 7 7 PHE C C 7 174.050 174.050 174.869 -0.819 25768 23 1 1 . 1 1 7 7 PHE CA C 7 56.110 56.110 57.794 -1.684 25768 24 1 1 . 1 1 7 7 PHE CB C 7 42.550 42.550 42.562 -0.012 25768 25 1 1 . 1 1 7 7 PHE H H 7 8.250 8.250 7.779 0.471 25768 26 1 1 . 1 1 8 8 ILE N N 8 127.950 127.950 118.612 9.338 25768 27 1 1 . 1 1 8 8 ILE C C 8 174.000 174.000 174.070 -0.070 25768 28 1 1 . 1 1 8 8 ILE CA C 8 61.160 61.160 60.203 0.957 25768 29 1 1 . 1 1 8 8 ILE CB C 8 42.660 42.660 41.579 1.081 25768 30 1 1 . 1 1 8 8 ILE H H 8 9.230 9.230 7.783 1.447 25768 31 1 1 . 1 1 9 9 ILE N N 9 125.380 125.380 124.910 0.470 25768 32 1 1 . 1 1 9 9 ILE C C 9 173.630 173.630 174.509 -0.879 25768 33 1 1 . 1 1 9 9 ILE CA C 9 59.600 59.600 60.389 -0.789 25768 34 1 1 . 1 1 9 9 ILE CB C 9 41.180 41.180 40.707 0.473 25768 35 1 1 . 1 1 9 9 ILE H H 9 8.580 8.580 8.009 0.571 25768 36 1 1 . 1 1 10 10 ARG N N 10 124.950 124.950 125.564 -0.614 25768 37 1 1 . 1 1 10 10 ARG C C 10 175.030 175.030 174.645 0.385 25768 38 1 1 . 1 1 10 10 ARG CA C 10 53.920 53.920 54.682 -0.762 25768 39 1 1 . 1 1 10 10 ARG CB C 10 31.880 31.880 34.573 -2.693 25768 40 1 1 . 1 1 10 10 ARG H H 10 9.230 9.230 8.167 1.063 25768 41 1 1 . 1 1 11 11 GLY N N 11 105.650 105.650 108.486 -2.836 25768 42 1 1 . 1 1 11 11 GLY C C 11 172.090 172.090 171.927 0.163 25768 43 1 1 . 1 1 11 11 GLY CA C 11 44.460 44.460 44.901 -0.441 25768 44 1 1 . 1 1 11 11 GLY H H 11 8.780 8.780 8.309 0.471 25768 45 1 1 . 1 1 12 12 GLY N N 12 107.800 107.800 110.274 -2.474 25768 46 1 1 . 1 1 12 12 GLY C C 12 171.460 171.460 172.035 -0.575 25768 47 1 1 . 1 1 12 12 GLY CA C 12 46.630 46.630 45.399 1.231 25768 48 1 1 . 1 1 12 12 GLY H H 12 8.510 8.510 7.960 0.550 25768 49 1 1 . 1 1 13 13 PHE N N 13 119.900 119.900 118.457 1.443 25768 50 1 1 . 1 1 13 13 PHE C C 13 174.190 174.190 173.461 0.729 25768 51 1 1 . 1 1 13 13 PHE CA C 13 56.340 56.340 57.821 -1.481 25768 52 1 1 . 1 1 13 13 PHE CB C 13 41.090 41.090 44.525 -3.435 25768 53 1 1 . 1 1 13 13 PHE H H 13 8.610 8.610 8.766 -0.156 25768 54 1 1 . 1 1 14 14 ALA N N 14 128.030 128.030 123.112 4.918 25768 55 1 1 . 1 1 14 14 ALA C C 14 176.560 176.560 176.653 -0.093 25768 56 1 1 . 1 1 14 14 ALA CA C 14 49.940 49.940 51.277 -1.337 25768 57 1 1 . 1 1 14 14 ALA CB C 14 20.360 20.360 21.458 -1.098 25768 58 1 1 . 1 1 14 14 ALA H H 14 9.220 9.220 9.137 0.083 25768 59 1 1 . 1 1 15 15 THR N N 15 118.620 118.620 121.391 -2.771 25768 60 1 1 . 1 1 15 15 THR CA C 15 61.440 61.440 62.184 -0.744 25768 61 1 1 . 1 1 15 15 THR CB C 15 71.370 71.370 69.754 1.616 25768 62 1 1 . 1 1 15 15 THR H H 15 9.220 9.220 8.171 1.049 25768 63 1 1 . 1 1 18 18 PRO C C 18 176.690 176.690 176.246 0.444 25768 64 1 1 . 1 1 18 18 PRO CA C 18 63.610 63.610 64.225 -0.615 25768 65 1 1 . 1 1 18 18 PRO CB C 18 32.440 32.440 32.163 0.277 25768 66 1 1 . 1 1 19 19 ASP N N 19 120.320 120.320 118.547 1.773 25768 67 1 1 . 1 1 19 19 ASP C C 19 175.950 175.950 175.810 0.140 25768 68 1 1 . 1 1 19 19 ASP CA C 19 54.710 54.710 52.777 1.933 25768 69 1 1 . 1 1 19 19 ASP CB C 19 41.450 41.450 42.803 -1.353 25768 70 1 1 . 1 1 19 19 ASP H H 19 8.330 8.330 7.931 0.399 25768 71 1 1 . 1 1 20 20 ASP N N 20 121.990 121.990 119.690 2.300 25768 72 1 1 . 1 1 20 20 ASP C C 20 176.760 176.760 176.184 0.576 25768 73 1 1 . 1 1 20 20 ASP CA C 20 54.470 54.470 54.985 -0.515 25768 74 1 1 . 1 1 20 20 ASP CB C 20 41.310 41.310 41.437 -0.127 25768 75 1 1 . 1 1 20 20 ASP H H 20 8.240 8.240 8.201 0.039 25768 76 1 1 . 1 1 21 21 SER N N 21 117.050 117.050 114.233 2.817 25768 77 1 1 . 1 1 21 21 SER C C 21 175.170 175.170 173.262 1.908 25768 78 1 1 . 1 1 21 21 SER CA C 21 59.490 59.490 58.540 0.950 25768 79 1 1 . 1 1 21 21 SER CB C 21 64.080 64.080 62.538 1.542 25768 80 1 1 . 1 1 21 21 SER H H 21 8.360 8.360 8.501 -0.141 25768 81 1 1 . 1 1 22 22 SER N N 22 117.820 117.820 114.215 3.605 25768 82 1 1 . 1 1 22 22 SER C C 22 174.940 174.940 174.176 0.764 25768 83 1 1 . 1 1 22 22 SER CA C 22 59.160 59.160 57.288 1.872 25768 84 1 1 . 1 1 22 22 SER CB C 22 64.110 64.110 64.627 -0.517 25768 85 1 1 . 1 1 22 22 SER H H 22 8.310 8.310 7.684 0.626 25768 86 1 1 . 1 1 23 23 SER N N 23 117.660 117.660 114.481 3.179 25768 87 1 1 . 1 1 23 23 SER C C 23 174.340 174.340 172.742 1.598 25768 88 1 1 . 1 1 23 23 SER CA C 23 59.050 59.050 58.066 0.984 25768 89 1 1 . 1 1 23 23 SER CB C 23 64.210 64.210 64.049 0.161 25768 90 1 1 . 1 1 23 23 SER H H 23 8.120 8.120 8.083 0.037 25768 91 1 1 . 1 1 24 24 ASP N N 24 122.590 122.590 119.739 2.851 25768 92 1 1 . 1 1 24 24 ASP C C 24 176.250 176.250 175.417 0.833 25768 93 1 1 . 1 1 24 24 ASP CA C 24 54.910 54.910 55.139 -0.229 25768 94 1 1 . 1 1 24 24 ASP CB C 24 41.270 41.270 40.237 1.032 25768 95 1 1 . 1 1 24 24 ASP H H 24 8.230 8.230 8.592 -0.362 25768 96 1 1 . 1 1 25 25 ILE N N 25 120.650 120.650 117.982 2.668 25768 97 1 1 . 1 1 25 25 ILE C C 25 176.190 176.190 176.536 -0.346 25768 98 1 1 . 1 1 25 25 ILE CA C 25 61.880 61.880 61.897 -0.017 25768 99 1 1 . 1 1 25 25 ILE CB C 25 38.730 38.730 38.348 0.382 25768 100 1 1 . 1 1 25 25 ILE H H 25 7.860 7.860 8.295 -0.435 25768 101 1 1 . 1 1 26 26 LYS N N 26 124.420 124.420 120.561 3.859 25768 102 1 1 . 1 1 26 26 LYS C C 26 176.640 176.640 175.352 1.288 25768 103 1 1 . 1 1 26 26 LYS CA C 26 56.520 56.520 55.622 0.898 25768 104 1 1 . 1 1 26 26 LYS CB C 26 32.890 32.890 34.133 -1.244 25768 105 1 1 . 1 1 26 26 LYS H H 26 8.140 8.140 7.669 0.471 25768 106 1 1 . 1 1 27 27 LEU N N 27 123.120 123.120 120.828 2.292 25768 107 1 1 . 1 1 27 27 LEU C C 27 177.110 177.110 175.958 1.152 25768 108 1 1 . 1 1 27 27 LEU CA C 27 55.590 55.590 55.755 -0.165 25768 109 1 1 . 1 1 27 27 LEU CB C 27 42.500 42.500 42.597 -0.097 25768 110 1 1 . 1 1 27 27 LEU H H 27 8.080 8.080 8.453 -0.373 25768 111 1 1 . 1 1 28 28 ASP N N 28 120.850 120.850 119.114 1.736 25768 112 1 1 . 1 1 28 28 ASP C C 28 176.960 176.960 176.937 0.023 25768 113 1 1 . 1 1 28 28 ASP CA C 28 54.800 54.800 55.478 -0.678 25768 114 1 1 . 1 1 28 28 ASP CB C 28 41.380 41.380 41.777 -0.397 25768 115 1 1 . 1 1 28 28 ASP H H 28 8.180 8.180 8.577 -0.397 25768 116 1 1 . 1 1 29 29 GLY N N 29 109.800 109.800 107.859 1.941 25768 117 1 1 . 1 1 29 29 GLY C C 29 174.370 174.370 173.979 0.391 25768 118 1 1 . 1 1 29 29 GLY CA C 29 46.150 46.150 44.641 1.509 25768 119 1 1 . 1 1 29 29 GLY H H 29 8.230 8.230 7.661 0.569 25768 120 1 1 . 1 1 30 30 ALA N N 30 123.880 123.880 121.320 2.560 25768 121 1 1 . 1 1 30 30 ALA C C 30 178.040 178.040 178.157 -0.117 25768 122 1 1 . 1 1 30 30 ALA CA C 30 53.140 53.140 52.570 0.570 25768 123 1 1 . 1 1 30 30 ALA CB C 30 19.350 19.350 19.807 -0.457 25768 124 1 1 . 1 1 30 30 ALA H H 30 8.040 8.040 8.150 -0.110 25768 125 1 1 . 1 1 31 31 LYS N N 31 119.800 119.800 121.150 -1.350 25768 126 1 1 . 1 1 31 31 LYS C C 31 176.770 176.770 175.422 1.348 25768 127 1 1 . 1 1 31 31 LYS CA C 31 56.870 56.870 56.163 0.708 25768 128 1 1 . 1 1 31 31 LYS CB C 31 32.980 32.980 33.094 -0.114 25768 129 1 1 . 1 1 31 31 LYS H H 31 8.060 8.060 8.021 0.039 25768 130 1 1 . 1 1 32 32 GLN N N 32 120.930 120.930 121.904 -0.974 25768 131 1 1 . 1 1 32 32 GLN C C 32 176.000 176.000 175.257 0.743 25768 132 1 1 . 1 1 32 32 GLN CA C 32 56.280 56.280 55.935 0.345 25768 133 1 1 . 1 1 32 32 GLN CB C 32 29.580 29.580 30.721 -1.141 25768 134 1 1 . 1 1 32 32 GLN H H 32 8.170 8.170 8.533 -0.363 25768 135 1 1 . 1 1 33 33 ARG N N 33 122.370 122.370 120.811 1.559 25768 136 1 1 . 1 1 33 33 ARG C C 33 176.820 176.820 174.767 2.053 25768 137 1 1 . 1 1 33 33 ARG CA C 33 56.680 56.680 55.242 1.438 25768 138 1 1 . 1 1 33 33 ARG CB C 33 31.040 31.040 32.638 -1.598 25768 139 1 1 . 1 1 33 33 ARG H H 33 8.270 8.270 8.619 -0.349 25768 140 1 1 . 1 1 34 34 GLY N N 34 110.210 110.210 107.977 2.233 25768 141 1 1 . 1 1 34 34 GLY C C 34 174.280 174.280 174.541 -0.261 25768 142 1 1 . 1 1 34 34 GLY CA C 34 45.770 45.770 45.063 0.707 25768 143 1 1 . 1 1 34 34 GLY H H 34 8.360 8.360 8.101 0.259 25768 144 1 1 . 1 1 35 35 THR N N 35 114.100 114.100 113.348 0.752 25768 145 1 1 . 1 1 35 35 THR C C 35 174.550 174.550 174.789 -0.239 25768 146 1 1 . 1 1 35 35 THR CA C 35 62.140 62.140 63.670 -1.530 25768 147 1 1 . 1 1 35 35 THR CB C 35 70.330 70.330 69.278 1.052 25768 148 1 1 . 1 1 35 35 THR H H 35 7.970 7.970 7.943 0.027 25768 149 1 1 . 1 1 36 36 LYS N N 36 123.850 123.850 120.566 3.284 25768 150 1 1 . 1 1 36 36 LYS C C 36 176.040 176.040 174.885 1.155 25768 151 1 1 . 1 1 36 36 LYS CA C 36 56.600 56.600 55.921 0.679 25768 152 1 1 . 1 1 36 36 LYS CB C 36 33.280 33.280 32.645 0.635 25768 153 1 1 . 1 1 36 36 LYS H H 36 8.230 8.230 7.756 0.474 25768 154 1 1 . 1 1 37 37 ALA N N 37 125.650 125.650 126.133 -0.483 25768 155 1 1 . 1 1 37 37 ALA C C 37 177.570 177.570 176.030 1.540 25768 156 1 1 . 1 1 37 37 ALA CA C 37 52.860 52.860 52.397 0.463 25768 157 1 1 . 1 1 37 37 ALA CB C 37 19.610 19.610 20.594 -0.984 25768 158 1 1 . 1 1 37 37 ALA H H 37 8.290 8.290 8.205 0.085 25768 159 1 1 . 1 1 38 38 THR N N 38 113.350 113.350 115.435 -2.085 25768 160 1 1 . 1 1 38 38 THR C C 38 174.540 174.540 174.068 0.472 25768 161 1 1 . 1 1 38 38 THR CA C 38 62.010 62.010 62.593 -0.583 25768 162 1 1 . 1 1 38 38 THR CB C 38 70.350 70.350 68.243 2.107 25768 163 1 1 . 1 1 38 38 THR H H 38 7.970 7.970 7.894 0.076 25768 164 1 1 . 1 1 39 39 VAL N N 39 120.790 120.790 124.771 -3.981 25768 165 1 1 . 1 1 39 39 VAL C C 39 175.620 175.620 176.222 -0.602 25768 166 1 1 . 1 1 39 39 VAL CA C 39 62.470 62.470 63.126 -0.656 25768 167 1 1 . 1 1 39 39 VAL CB C 39 32.940 32.940 32.766 0.174 25768 168 1 1 . 1 1 39 39 VAL H H 39 8.020 8.020 8.217 -0.197 25768 169 1 1 . 1 1 40 40 ASP N N 40 123.690 123.690 121.056 2.634 25768 170 1 1 . 1 1 40 40 ASP C C 40 176.190 176.190 176.221 -0.031 25768 171 1 1 . 1 1 40 40 ASP CA C 40 54.780 54.780 53.268 1.512 25768 172 1 1 . 1 1 40 40 ASP CB C 40 41.590 41.590 40.430 1.160 25768 173 1 1 . 1 1 40 40 ASP H H 40 8.310 8.310 7.881 0.429 25768 174 1 1 . 1 1 41 41 SER N N 41 115.470 115.470 116.978 -1.508 25768 175 1 1 . 1 1 41 41 SER C C 41 174.170 174.170 174.601 -0.431 25768 176 1 1 . 1 1 41 41 SER CA C 41 59.000 59.000 59.275 -0.275 25768 177 1 1 . 1 1 41 41 SER CB C 41 64.420 64.420 64.158 0.262 25768 178 1 1 . 1 1 41 41 SER H H 41 8.130 8.130 8.367 -0.237 25768 179 1 1 . 1 1 42 42 ASP N N 42 122.430 122.430 120.728 1.702 25768 180 1 1 . 1 1 42 42 ASP C C 42 175.740 175.740 175.484 0.256 25768 181 1 1 . 1 1 42 42 ASP CA C 42 54.780 54.780 53.767 1.013 25768 182 1 1 . 1 1 42 42 ASP CB C 42 41.620 41.620 41.825 -0.206 25768 183 1 1 . 1 1 42 42 ASP H H 42 8.410 8.410 8.237 0.173 25768 184 1 1 . 1 1 43 43 THR N N 43 117.580 117.580 109.056 8.524 25768 185 1 1 . 1 1 43 43 THR C C 43 173.630 173.630 173.684 -0.054 25768 186 1 1 . 1 1 43 43 THR CA C 43 63.120 63.120 60.646 2.474 25768 187 1 1 . 1 1 43 43 THR CB C 43 70.650 70.650 72.005 -1.355 25768 188 1 1 . 1 1 43 43 THR H H 43 8.010 8.010 8.050 -0.040 25768 189 1 1 . 1 1 44 44 GLN N N 44 125.420 125.420 119.378 6.042 25768 190 1 1 . 1 1 44 44 GLN C C 44 174.080 174.080 173.977 0.103 25768 191 1 1 . 1 1 44 44 GLN CA C 44 55.110 55.110 54.109 1.000 25768 192 1 1 . 1 1 44 44 GLN CB C 44 31.570 31.570 31.454 0.116 25768 193 1 1 . 1 1 44 44 GLN H H 44 9.260 9.260 8.429 0.831 25768 194 1 1 . 1 1 45 45 LEU N N 45 124.190 124.190 123.424 0.766 25768 195 1 1 . 1 1 45 45 LEU C C 45 175.970 175.970 176.757 -0.787 25768 196 1 1 . 1 1 45 45 LEU CA C 45 54.690 54.690 54.806 -0.116 25768 197 1 1 . 1 1 45 45 LEU CB C 45 42.270 42.270 42.208 0.062 25768 198 1 1 . 1 1 45 45 LEU H H 45 8.550 8.550 8.372 0.178 25768 199 1 1 . 1 1 46 46 GLY N N 46 113.310 113.310 110.868 2.442 25768 200 1 1 . 1 1 46 46 GLY C C 46 171.180 171.180 172.298 -1.118 25768 201 1 1 . 1 1 46 46 GLY CA C 46 44.400 44.400 44.261 0.139 25768 202 1 1 . 1 1 46 46 GLY H H 46 8.810 8.810 7.737 1.073 25768 203 1 1 . 1 1 47 47 LEU N N 47 123.890 123.890 127.851 -3.961 25768 204 1 1 . 1 1 47 47 LEU C C 47 175.400 175.400 174.863 0.537 25768 205 1 1 . 1 1 47 47 LEU CA C 47 53.750 53.750 53.991 -0.241 25768 206 1 1 . 1 1 47 47 LEU CB C 47 46.800 46.800 46.148 0.652 25768 207 1 1 . 1 1 47 47 LEU H H 47 8.590 8.590 8.290 0.300 25768 208 1 1 . 1 1 48 48 THR N N 48 111.210 111.210 115.720 -4.510 25768 209 1 1 . 1 1 48 48 THR C C 48 172.520 172.520 173.255 -0.735 25768 210 1 1 . 1 1 48 48 THR CA C 48 58.950 58.950 60.807 -1.857 25768 211 1 1 . 1 1 48 48 THR CB C 48 72.360 72.360 71.624 0.736 25768 212 1 1 . 1 1 48 48 THR H H 48 8.620 8.620 8.355 0.265 25768 213 1 1 . 1 1 49 49 PHE N N 49 118.810 118.810 125.588 -6.778 25768 214 1 1 . 1 1 49 49 PHE C C 49 174.700 174.700 175.201 -0.501 25768 215 1 1 . 1 1 49 49 PHE CA C 49 55.080 55.080 56.343 -1.263 25768 216 1 1 . 1 1 49 49 PHE CB C 49 42.360 42.360 41.519 0.841 25768 217 1 1 . 1 1 49 49 PHE H H 49 8.410 8.410 8.394 0.016 25768 218 1 1 . 1 1 50 50 THR N N 50 121.230 121.230 122.819 -1.589 25768 219 1 1 . 1 1 50 50 THR C C 50 173.250 173.250 172.923 0.327 25768 220 1 1 . 1 1 50 50 THR CA C 50 62.740 62.740 60.733 2.007 25768 221 1 1 . 1 1 50 50 THR CB C 50 73.740 73.740 70.052 3.688 25768 222 1 1 . 1 1 50 50 THR H H 50 9.330 9.330 7.992 1.338 25768 223 1 1 . 1 1 51 51 TYR N N 51 126.010 126.010 123.734 2.276 25768 224 1 1 . 1 1 51 51 TYR C C 51 174.850 174.850 175.096 -0.246 25768 225 1 1 . 1 1 51 51 TYR CA C 51 56.240 56.240 56.385 -0.145 25768 226 1 1 . 1 1 51 51 TYR CB C 51 41.630 41.630 40.485 1.145 25768 227 1 1 . 1 1 51 51 TYR H H 51 9.150 9.150 9.572 -0.422 25768 228 1 1 . 1 1 52 52 MET N N 52 127.390 127.390 124.192 3.198 25768 229 1 1 . 1 1 52 52 MET C C 52 174.490 174.490 174.153 0.337 25768 230 1 1 . 1 1 52 52 MET CA C 52 52.450 52.450 55.393 -2.943 25768 231 1 1 . 1 1 52 52 MET CB C 52 28.590 28.590 34.760 -6.170 25768 232 1 1 . 1 1 52 52 MET H H 52 7.950 7.950 8.267 -0.317 25768 233 1 1 . 1 1 53 53 PHE N N 53 123.830 123.830 128.121 -4.291 25768 234 1 1 . 1 1 53 53 PHE C C 53 173.720 173.720 173.847 -0.127 25768 235 1 1 . 1 1 53 53 PHE CA C 53 57.110 57.110 56.954 0.156 25768 236 1 1 . 1 1 53 53 PHE CB C 53 39.420 39.420 41.990 -2.571 25768 237 1 1 . 1 1 53 53 PHE H H 53 7.720 7.720 8.542 -0.822 25768 238 1 1 . 1 1 54 54 ALA N N 54 125.650 125.650 127.717 -2.067 25768 239 1 1 . 1 1 54 54 ALA C C 54 175.020 175.020 175.632 -0.612 25768 240 1 1 . 1 1 54 54 ALA CA C 54 50.740 50.740 52.871 -2.131 25768 241 1 1 . 1 1 54 54 ALA CB C 54 22.700 22.700 18.657 4.043 25768 242 1 1 . 1 1 54 54 ALA H H 54 8.360 8.360 8.191 0.169 25768 243 1 1 . 1 1 55 55 ASP N N 55 118.790 118.790 121.474 -2.684 25768 244 1 1 . 1 1 55 55 ASP C C 55 174.780 174.780 175.882 -1.102 25768 245 1 1 . 1 1 55 55 ASP CA C 55 58.590 58.590 54.931 3.659 25768 246 1 1 . 1 1 55 55 ASP CB C 55 40.430 40.430 40.656 -0.226 25768 247 1 1 . 1 1 55 55 ASP H H 55 8.590 8.590 8.638 -0.048 25768 248 1 1 . 1 1 56 56 LYS N N 56 106.200 106.200 117.826 -11.626 25768 249 1 1 . 1 1 56 56 LYS C C 56 174.940 174.940 175.498 -0.558 25768 250 1 1 . 1 1 56 56 LYS CA C 56 55.260 55.260 57.043 -1.783 25768 251 1 1 . 1 1 56 56 LYS CB C 56 34.510 34.510 35.624 -1.114 25768 252 1 1 . 1 1 56 56 LYS H H 56 7.260 7.260 7.557 -0.297 25768 253 1 1 . 1 1 57 57 TRP N N 57 115.680 115.680 121.496 -5.816 25768 254 1 1 . 1 1 57 57 TRP C C 57 173.940 173.940 175.221 -1.281 25768 255 1 1 . 1 1 57 57 TRP CA C 57 55.410 55.410 57.766 -2.356 25768 256 1 1 . 1 1 57 57 TRP CB C 57 34.470 34.470 32.167 2.303 25768 257 1 1 . 1 1 57 57 TRP H H 57 6.570 6.570 8.294 -1.724 25768 258 1 1 . 1 1 58 58 GLY N N 58 107.610 107.610 109.521 -1.911 25768 259 1 1 . 1 1 58 58 GLY C C 58 172.730 172.730 171.983 0.747 25768 260 1 1 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.451 -0.401 25768 261 1 1 . 1 1 58 58 GLY H H 58 9.260 9.260 8.155 1.105 25768 262 1 1 . 1 1 59 59 VAL N N 59 118.130 118.130 123.205 -5.075 25768 263 1 1 . 1 1 59 59 VAL C C 59 173.000 173.000 174.668 -1.668 25768 264 1 1 . 1 1 59 59 VAL CA C 59 59.950 59.950 60.305 -0.355 25768 265 1 1 . 1 1 59 59 VAL CB C 59 35.170 35.170 34.636 0.534 25768 266 1 1 . 1 1 59 59 VAL H H 59 9.030 9.030 9.090 -0.060 25768 267 1 1 . 1 1 60 60 GLU N N 60 127.900 127.900 122.891 5.009 25768 268 1 1 . 1 1 60 60 GLU C C 60 174.470 174.470 174.536 -0.066 25768 269 1 1 . 1 1 60 60 GLU CA C 60 52.940 52.940 54.966 -2.026 25768 270 1 1 . 1 1 60 60 GLU CB C 60 35.100 35.100 33.798 1.302 25768 271 1 1 . 1 1 60 60 GLU H H 60 9.440 9.440 8.420 1.020 25768 272 1 1 . 1 1 61 61 LEU N N 61 127.410 127.410 122.219 5.191 25768 273 1 1 . 1 1 61 61 LEU C C 61 174.950 174.950 174.703 0.247 25768 274 1 1 . 1 1 61 61 LEU CA C 61 53.390 53.390 54.292 -0.902 25768 275 1 1 . 1 1 61 61 LEU CB C 61 45.980 45.980 47.245 -1.265 25768 276 1 1 . 1 1 61 61 LEU H H 61 8.740 8.740 8.610 0.130 25768 277 1 1 . 1 1 62 62 VAL N N 62 125.750 125.750 121.003 4.747 25768 278 1 1 . 1 1 62 62 VAL C C 62 173.960 173.960 174.490 -0.530 25768 279 1 1 . 1 1 62 62 VAL CA C 62 61.350 61.350 59.952 1.398 25768 280 1 1 . 1 1 62 62 VAL CB C 62 34.740 34.740 33.600 1.140 25768 281 1 1 . 1 1 62 62 VAL H H 62 8.790 8.790 7.971 0.819 25768 282 1 1 . 1 1 63 63 ALA N N 63 127.230 127.230 127.646 -0.416 25768 283 1 1 . 1 1 63 63 ALA C C 63 173.930 173.930 175.113 -1.183 25768 284 1 1 . 1 1 63 63 ALA CA C 63 51.140 51.140 51.641 -0.501 25768 285 1 1 . 1 1 63 63 ALA CB C 63 22.500 22.500 21.683 0.817 25768 286 1 1 . 1 1 63 63 ALA H H 63 8.740 8.740 8.809 -0.069 25768 287 1 1 . 1 1 64 64 ALA N N 64 120.410 120.410 124.520 -4.110 25768 288 1 1 . 1 1 64 64 ALA C C 64 176.770 176.770 176.753 0.017 25768 289 1 1 . 1 1 64 64 ALA CA C 64 51.420 51.420 50.397 1.023 25768 290 1 1 . 1 1 64 64 ALA CB C 64 22.590 22.590 21.986 0.604 25768 291 1 1 . 1 1 64 64 ALA H H 64 8.290 8.290 8.122 0.168 25768 292 1 1 . 1 1 65 65 THR N N 65 116.130 116.130 114.980 1.150 25768 293 1 1 . 1 1 65 65 THR C C 65 171.220 171.220 173.071 -1.851 25768 294 1 1 . 1 1 65 65 THR CA C 65 58.860 58.860 58.142 0.718 25768 295 1 1 . 1 1 65 65 THR CB C 65 72.020 72.020 69.479 2.541 25768 296 1 1 . 1 1 65 65 THR H H 65 8.760 8.760 8.070 0.690 25768 297 1 1 . 1 1 66 66 PRO C C 66 176.720 176.720 176.201 0.519 25768 298 1 1 . 1 1 66 66 PRO CA C 66 63.610 63.610 63.824 -0.214 25768 299 1 1 . 1 1 66 66 PRO CB C 66 32.550 32.550 32.149 0.401 25768 300 1 1 . 1 1 67 67 PHE N N 67 120.360 120.360 117.453 2.907 25768 301 1 1 . 1 1 67 67 PHE C C 67 175.480 175.480 174.400 1.080 25768 302 1 1 . 1 1 67 67 PHE CA C 67 58.840 58.840 57.217 1.623 25768 303 1 1 . 1 1 67 67 PHE CB C 67 40.170 40.170 39.775 0.395 25768 304 1 1 . 1 1 67 67 PHE H H 67 8.590 8.590 7.112 1.478 25768 305 1 1 . 1 1 68 68 ASN N N 68 119.030 119.030 122.013 -2.983 25768 306 1 1 . 1 1 68 68 ASN C C 68 174.740 174.740 175.730 -0.990 25768 307 1 1 . 1 1 68 68 ASN CA C 68 53.430 53.430 54.516 -1.086 25768 308 1 1 . 1 1 68 68 ASN CB C 68 39.420 39.420 40.251 -0.831 25768 309 1 1 . 1 1 68 68 ASN H H 68 8.340 8.340 8.962 -0.622 25768 310 1 1 . 1 1 69 69 HIS N N 69 119.590 119.590 118.447 1.143 25768 311 1 1 . 1 1 69 69 HIS C C 69 174.370 174.370 174.338 0.032 25768 312 1 1 . 1 1 69 69 HIS CA C 69 55.950 55.950 55.890 0.060 25768 313 1 1 . 1 1 69 69 HIS CB C 69 29.960 29.960 30.708 -0.748 25768 314 1 1 . 1 1 69 69 HIS H H 69 8.350 8.350 8.270 0.080 25768 315 1 1 . 1 1 70 70 GLN N N 70 121.980 121.980 118.597 3.383 25768 316 1 1 . 1 1 70 70 GLN C C 70 175.740 175.740 175.277 0.463 25768 317 1 1 . 1 1 70 70 GLN CA C 70 56.340 56.340 56.447 -0.107 25768 318 1 1 . 1 1 70 70 GLN CB C 70 29.660 29.660 27.959 1.702 25768 319 1 1 . 1 1 70 70 GLN H H 70 8.350 8.350 8.376 -0.026 25768 320 1 1 . 1 1 71 71 VAL N N 71 120.530 120.530 118.748 1.782 25768 321 1 1 . 1 1 71 71 VAL C C 71 175.500 175.500 175.374 0.126 25768 322 1 1 . 1 1 71 71 VAL CA C 71 62.540 62.540 62.371 0.169 25768 323 1 1 . 1 1 71 71 VAL CB C 71 33.090 33.090 32.521 0.569 25768 324 1 1 . 1 1 71 71 VAL H H 71 8.020 8.020 7.946 0.074 25768 325 1 1 . 1 1 72 72 ASP N N 72 123.910 123.910 123.022 0.888 25768 326 1 1 . 1 1 72 72 ASP C C 72 176.300 176.300 176.204 0.096 25768 327 1 1 . 1 1 72 72 ASP CA C 72 54.340 54.340 55.386 -1.046 25768 328 1 1 . 1 1 72 72 ASP CB C 72 41.480 41.480 41.206 0.274 25768 329 1 1 . 1 1 72 72 ASP H H 72 8.280 8.280 8.151 0.129 25768 330 1 1 . 1 1 73 73 VAL N N 73 120.580 120.580 121.141 -0.561 25768 331 1 1 . 1 1 73 73 VAL C C 73 176.350 176.350 175.171 1.179 25768 332 1 1 . 1 1 73 73 VAL CA C 73 62.970 62.970 62.662 0.308 25768 333 1 1 . 1 1 73 73 VAL CB C 73 32.550 32.550 30.733 1.817 25768 334 1 1 . 1 1 73 73 VAL H H 73 7.960 7.960 8.391 -0.431 25768 335 1 1 . 1 1 74 74 LYS N N 74 123.620 123.620 120.125 3.495 25768 336 1 1 . 1 1 74 74 LYS C C 74 177.130 177.130 176.795 0.335 25768 337 1 1 . 1 1 74 74 LYS CA C 74 57.060 57.060 55.055 2.005 25768 338 1 1 . 1 1 74 74 LYS CB C 74 32.860 32.860 34.080 -1.220 25768 339 1 1 . 1 1 74 74 LYS H H 74 8.230 8.230 7.608 0.622 25768 340 1 1 . 1 1 75 75 GLY N N 75 109.370 109.370 106.852 2.518 25768 341 1 1 . 1 1 75 75 GLY C C 75 174.030 174.030 173.657 0.373 25768 342 1 1 . 1 1 75 75 GLY CA C 75 45.800 45.800 44.919 0.881 25768 343 1 1 . 1 1 75 75 GLY H H 75 8.160 8.160 8.249 -0.089 25768 344 1 1 . 1 1 76 76 LEU N N 76 121.660 121.660 122.846 -1.186 25768 345 1 1 . 1 1 76 76 LEU C C 76 177.410 177.410 177.115 0.295 25768 346 1 1 . 1 1 76 76 LEU CA C 76 55.410 55.410 54.368 1.042 25768 347 1 1 . 1 1 76 76 LEU CB C 76 42.790 42.790 42.464 0.326 25768 348 1 1 . 1 1 76 76 LEU H H 76 8.030 8.030 7.713 0.317 25768 349 1 1 . 1 1 77 77 GLY N N 77 109.330 109.330 110.900 -1.570 25768 350 1 1 . 1 1 77 77 GLY C C 77 171.800 171.800 174.216 -2.416 25768 351 1 1 . 1 1 77 77 GLY CA C 77 44.990 44.990 45.350 -0.360 25768 352 1 1 . 1 1 77 77 GLY H H 77 8.100 8.100 8.650 -0.550 25768 353 1 1 . 1 1 78 78 PRO C C 78 177.740 177.740 177.409 0.331 25768 354 1 1 . 1 1 78 78 PRO CA C 78 63.890 63.890 63.306 0.584 25768 355 1 1 . 1 1 78 78 PRO CB C 78 32.170 32.170 32.011 0.159 25768 356 1 1 . 1 1 79 79 GLY N N 79 109.530 109.530 107.158 2.372 25768 357 1 1 . 1 1 79 79 GLY C C 79 174.460 174.460 174.727 -0.267 25768 358 1 1 . 1 1 79 79 GLY CA C 79 45.780 45.780 44.618 1.162 25768 359 1 1 . 1 1 79 79 GLY H H 79 8.410 8.410 8.305 0.105 25768 360 1 1 . 1 1 80 80 LEU N N 80 121.880 121.880 122.050 -0.170 25768 361 1 1 . 1 1 80 80 LEU C C 80 177.100 177.100 176.423 0.677 25768 362 1 1 . 1 1 80 80 LEU CA C 80 55.720 55.720 55.048 0.672 25768 363 1 1 . 1 1 80 80 LEU CB C 80 42.580 42.580 42.885 -0.304 25768 364 1 1 . 1 1 80 80 LEU H H 80 8.010 8.010 8.189 -0.179 25768 365 1 1 . 1 1 81 81 ASP N N 81 119.990 119.990 120.880 -0.890 25768 366 1 1 . 1 1 81 81 ASP C C 81 176.880 176.880 176.393 0.487 25768 367 1 1 . 1 1 81 81 ASP CA C 81 54.770 54.770 54.974 -0.204 25768 368 1 1 . 1 1 81 81 ASP CB C 81 41.390 41.390 41.151 0.239 25768 369 1 1 . 1 1 81 81 ASP H H 81 8.220 8.220 8.103 0.117 25768 370 1 1 . 1 1 82 82 GLY N N 82 109.270 109.270 108.016 1.254 25768 371 1 1 . 1 1 82 82 GLY C C 82 174.190 174.190 172.959 1.231 25768 372 1 1 . 1 1 82 82 GLY CA C 82 45.990 45.990 44.423 1.567 25768 373 1 1 . 1 1 82 82 GLY H H 82 8.170 8.170 7.910 0.260 25768 374 1 1 . 1 1 83 83 LYS N N 83 121.000 121.000 119.583 1.417 25768 375 1 1 . 1 1 83 83 LYS C C 83 176.610 176.610 175.499 1.111 25768 376 1 1 . 1 1 83 83 LYS CA C 83 56.620 56.620 56.274 0.346 25768 377 1 1 . 1 1 83 83 LYS CB C 83 33.020 33.020 32.683 0.337 25768 378 1 1 . 1 1 83 83 LYS H H 83 7.970 7.970 8.158 -0.188 25768 379 1 1 . 1 1 84 84 LEU N N 84 123.120 123.120 123.552 -0.432 25768 380 1 1 . 1 1 84 84 LEU C C 84 176.920 176.920 176.790 0.130 25768 381 1 1 . 1 1 84 84 LEU CA C 84 55.550 55.550 55.842 -0.292 25768 382 1 1 . 1 1 84 84 LEU CB C 84 42.430 42.430 42.054 0.376 25768 383 1 1 . 1 1 84 84 LEU H H 84 8.130 8.130 8.238 -0.108 25768 384 1 1 . 1 1 85 85 ALA N N 85 123.930 123.930 127.875 -3.945 25768 385 1 1 . 1 1 85 85 ALA C C 85 177.060 177.060 176.970 0.090 25768 386 1 1 . 1 1 85 85 ALA CA C 85 52.790 52.790 52.157 0.633 25768 387 1 1 . 1 1 85 85 ALA CB C 85 19.670 19.670 18.125 1.545 25768 388 1 1 . 1 1 85 85 ALA H H 85 8.040 8.040 8.223 -0.183 25768 389 1 1 . 1 1 86 86 ASP N N 86 119.760 119.760 124.301 -4.541 25768 390 1 1 . 1 1 86 86 ASP C C 86 175.820 175.820 177.604 -1.784 25768 391 1 1 . 1 1 86 86 ASP CA C 86 54.520 54.520 54.902 -0.382 25768 392 1 1 . 1 1 86 86 ASP CB C 86 41.390 41.390 41.044 0.346 25768 393 1 1 . 1 1 86 86 ASP H H 86 8.110 8.110 8.461 -0.351 25768 394 1 1 . 1 1 87 87 ILE N N 87 120.620 120.620 117.275 3.345 25768 395 1 1 . 1 1 87 87 ILE C C 87 175.740 175.740 175.481 0.259 25768 396 1 1 . 1 1 87 87 ILE CA C 87 61.160 61.160 61.721 -0.561 25768 397 1 1 . 1 1 87 87 ILE CB C 87 39.260 39.260 36.975 2.285 25768 398 1 1 . 1 1 87 87 ILE H H 87 7.800 7.800 8.018 -0.218 25768 399 1 1 . 1 1 88 88 LYS N N 88 125.820 125.820 119.416 6.404 25768 400 1 1 . 1 1 88 88 LYS C C 88 175.340 175.340 176.804 -1.464 25768 401 1 1 . 1 1 88 88 LYS CA C 88 56.300 56.300 56.940 -0.640 25768 402 1 1 . 1 1 88 88 LYS CB C 88 32.900 32.900 32.949 -0.049 25768 403 1 1 . 1 1 88 88 LYS H H 88 8.250 8.250 7.958 0.292 25768 404 1 1 . 1 1 89 89 GLN N N 89 121.750 121.750 119.661 2.089 25768 405 1 1 . 1 1 89 89 GLN C C 89 175.000 175.000 175.040 -0.040 25768 406 1 1 . 1 1 89 89 GLN CA C 89 55.210 55.210 55.939 -0.729 25768 407 1 1 . 1 1 89 89 GLN CB C 89 30.570 30.570 29.521 1.049 25768 408 1 1 . 1 1 89 89 GLN H H 89 8.000 8.000 7.824 0.176 25768 409 1 1 . 1 1 90 90 LEU N N 90 126.660 126.660 126.465 0.195 25768 410 1 1 . 1 1 90 90 LEU C C 90 174.240 174.240 174.890 -0.650 25768 411 1 1 . 1 1 90 90 LEU CA C 90 52.720 52.720 52.490 0.230 25768 412 1 1 . 1 1 90 90 LEU CB C 90 42.350 42.350 42.115 0.235 25768 413 1 1 . 1 1 90 90 LEU H H 90 8.630 8.630 8.326 0.304 25768 414 1 1 . 1 1 92 92 PRO C C 92 173.900 173.900 176.403 -2.503 25768 415 1 1 . 1 1 92 92 PRO CA C 92 63.320 63.320 62.971 0.349 25768 416 1 1 . 1 1 92 92 PRO CB C 92 31.920 31.920 32.202 -0.282 25768 417 1 1 . 1 1 93 93 THR N N 93 119.770 119.770 116.828 2.942 25768 418 1 1 . 1 1 93 93 THR C C 93 171.360 171.360 174.102 -2.742 25768 419 1 1 . 1 1 93 93 THR CA C 93 62.610 62.610 61.972 0.638 25768 420 1 1 . 1 1 93 93 THR CB C 93 72.680 72.680 69.484 3.196 25768 421 1 1 . 1 1 93 93 THR H H 93 8.290 8.290 8.329 -0.039 25768 422 1 1 . 1 1 94 94 LEU N N 94 128.880 128.880 127.689 1.191 25768 423 1 1 . 1 1 94 94 LEU C C 94 175.130 175.130 174.742 0.388 25768 424 1 1 . 1 1 94 94 LEU CA C 94 53.520 53.520 54.583 -1.063 25768 425 1 1 . 1 1 94 94 LEU CB C 94 46.140 46.140 44.728 1.412 25768 426 1 1 . 1 1 94 94 LEU H H 94 8.680 8.680 8.596 0.084 25768 427 1 1 . 1 1 95 95 LEU N N 95 123.630 123.630 122.873 0.757 25768 428 1 1 . 1 1 95 95 LEU C C 95 175.540 175.540 175.076 0.464 25768 429 1 1 . 1 1 95 95 LEU CA C 95 55.190 55.190 54.020 1.169 25768 430 1 1 . 1 1 95 95 LEU CB C 95 45.300 45.300 46.477 -1.177 25768 431 1 1 . 1 1 95 95 LEU H H 95 9.580 9.580 8.142 1.438 25768 432 1 1 . 1 1 96 96 LEU N N 96 123.150 123.150 120.800 2.350 25768 433 1 1 . 1 1 96 96 LEU C C 96 174.960 174.960 175.196 -0.236 25768 434 1 1 . 1 1 96 96 LEU CA C 96 54.420 54.420 54.450 -0.030 25768 435 1 1 . 1 1 96 96 LEU CB C 96 44.560 44.560 45.213 -0.653 25768 436 1 1 . 1 1 96 96 LEU H H 96 8.770 8.770 8.872 -0.102 25768 437 1 1 . 1 1 97 97 GLN N N 97 121.290 121.290 121.719 -0.429 25768 438 1 1 . 1 1 97 97 GLN C C 97 174.380 174.380 174.113 0.267 25768 439 1 1 . 1 1 97 97 GLN CA C 97 54.740 54.740 54.001 0.739 25768 440 1 1 . 1 1 97 97 GLN CB C 97 36.600 36.600 31.907 4.692 25768 441 1 1 . 1 1 97 97 GLN H H 97 9.480 9.480 8.766 0.714 25768 442 1 1 . 1 1 98 98 TYR N N 98 122.250 122.250 122.713 -0.463 25768 443 1 1 . 1 1 98 98 TYR C C 98 173.460 173.460 174.704 -1.244 25768 444 1 1 . 1 1 98 98 TYR CA C 98 55.160 55.160 56.347 -1.187 25768 445 1 1 . 1 1 98 98 TYR CB C 98 42.420 42.420 42.947 -0.527 25768 446 1 1 . 1 1 98 98 TYR H H 98 9.010 9.010 8.311 0.699 25768 447 1 1 . 1 1 99 99 TYR N N 99 126.860 126.860 122.468 4.392 25768 448 1 1 . 1 1 99 99 TYR C C 99 175.380 175.380 175.651 -0.271 25768 449 1 1 . 1 1 99 99 TYR CA C 99 54.220 54.220 55.912 -1.692 25768 450 1 1 . 1 1 99 99 TYR CB C 99 38.890 38.890 38.209 0.681 25768 451 1 1 . 1 1 99 99 TYR H H 99 8.300 8.300 8.240 0.060 25768 452 1 1 . 1 1 100 100 PRO C C 100 178.330 178.330 176.950 1.380 25768 453 1 1 . 1 1 100 100 PRO CA C 100 64.750 64.750 64.944 -0.194 25768 454 1 1 . 1 1 100 100 PRO CB C 100 32.130 32.130 32.120 0.010 25768 455 1 1 . 1 1 101 101 MET N N 101 114.520 114.520 117.678 -3.158 25768 456 1 1 . 1 1 101 101 MET C C 101 178.240 178.240 175.650 2.590 25768 457 1 1 . 1 1 101 101 MET CA C 101 53.500 53.500 54.717 -1.216 25768 458 1 1 . 1 1 101 101 MET CB C 101 30.160 30.160 33.365 -3.205 25768 459 1 1 . 1 1 101 101 MET H H 101 9.390 9.390 7.968 1.422 25768 460 1 1 . 1 1 102 102 GLY N N 102 117.500 117.500 107.967 9.533 25768 461 1 1 . 1 1 102 102 GLY C C 102 175.690 175.690 174.882 0.808 25768 462 1 1 . 1 1 102 102 GLY CA C 102 46.760 46.760 45.251 1.509 25768 463 1 1 . 1 1 102 102 GLY H H 102 8.640 8.640 7.575 1.065 25768 464 1 1 . 1 1 103 103 GLY N N 103 111.030 111.030 110.208 0.822 25768 465 1 1 . 1 1 103 103 GLY C C 103 174.070 174.070 174.166 -0.096 25768 466 1 1 . 1 1 103 103 GLY CA C 103 46.140 46.140 44.871 1.269 25768 467 1 1 . 1 1 103 103 GLY H H 103 9.390 9.390 8.490 0.900 25768 468 1 1 . 1 1 104 104 THR N N 104 109.290 109.290 112.526 -3.236 25768 469 1 1 . 1 1 104 104 THR C C 104 174.290 174.290 174.095 0.195 25768 470 1 1 . 1 1 104 104 THR CA C 104 60.900 60.900 60.233 0.667 25768 471 1 1 . 1 1 104 104 THR CB C 104 72.070 72.070 71.157 0.913 25768 472 1 1 . 1 1 104 104 THR H H 104 7.290 7.290 7.819 -0.529 25768 473 1 1 . 1 1 105 105 ASN C C 105 175.050 175.050 174.828 0.222 25768 474 1 1 . 1 1 105 105 ASN CA C 105 52.880 52.880 52.873 0.007 25768 475 1 1 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.871 -0.611 25768 476 1 1 . 1 1 106 106 SER N N 106 113.000 113.000 117.573 -4.573 25768 477 1 1 . 1 1 106 106 SER C C 106 176.000 176.000 174.619 1.381 25768 478 1 1 . 1 1 106 106 SER CA C 106 58.700 58.700 58.655 0.045 25768 479 1 1 . 1 1 106 106 SER CB C 106 64.540 64.540 64.048 0.492 25768 480 1 1 . 1 1 106 106 SER H H 106 7.450 7.450 7.520 -0.070 25768 481 1 1 . 1 1 107 107 ALA N N 107 132.220 132.220 125.705 6.515 25768 482 1 1 . 1 1 107 107 ALA C C 107 176.610 176.610 177.277 -0.667 25768 483 1 1 . 1 1 107 107 ALA CA C 107 54.380 54.380 53.495 0.885 25768 484 1 1 . 1 1 107 107 ALA CB C 107 18.690 18.690 18.997 -0.307 25768 485 1 1 . 1 1 107 107 ALA H H 107 8.870 8.870 8.596 0.274 25768 486 1 1 . 1 1 108 108 PHE N N 108 116.050 116.050 116.654 -0.604 25768 487 1 1 . 1 1 108 108 PHE C C 108 174.270 174.270 175.846 -1.576 25768 488 1 1 . 1 1 108 108 PHE CA C 108 56.140 56.140 57.923 -1.783 25768 489 1 1 . 1 1 108 108 PHE CB C 108 40.520 40.520 40.237 0.283 25768 490 1 1 . 1 1 108 108 PHE H H 108 7.550 7.550 7.838 -0.288 25768 491 1 1 . 1 1 109 109 GLN N N 109 128.260 128.260 122.217 6.043 25768 492 1 1 . 1 1 109 109 GLN C C 109 172.300 172.300 174.186 -1.886 25768 493 1 1 . 1 1 109 109 GLN CA C 109 52.310 52.310 52.525 -0.214 25768 494 1 1 . 1 1 109 109 GLN CB C 109 29.050 29.050 30.150 -1.100 25768 495 1 1 . 1 1 109 109 GLN H H 109 9.060 9.060 8.758 0.302 25768 496 1 1 . 1 1 110 110 PRO C C 110 175.020 175.020 175.926 -0.906 25768 497 1 1 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.506 -0.956 25768 498 1 1 . 1 1 110 110 PRO CB C 110 33.280 33.280 32.149 1.131 25768 499 1 1 . 1 1 111 111 TYR N N 111 115.730 115.730 118.781 -3.051 25768 500 1 1 . 1 1 111 111 TYR C C 111 173.850 173.850 173.767 0.083 25768 501 1 1 . 1 1 111 111 TYR CA C 111 56.470 56.470 55.961 0.509 25768 502 1 1 . 1 1 111 111 TYR CB C 111 38.650 38.650 39.753 -1.103 25768 503 1 1 . 1 1 111 111 TYR H H 111 8.500 8.500 7.712 0.788 25768 504 1 1 . 1 1 112 112 GLY N N 112 103.570 103.570 107.691 -4.121 25768 505 1 1 . 1 1 112 112 GLY C C 112 172.020 172.020 173.228 -1.208 25768 506 1 1 . 1 1 112 112 GLY CA C 112 43.950 43.950 43.621 0.329 25768 507 1 1 . 1 1 112 112 GLY H H 112 8.110 8.110 8.694 -0.584 25768 508 1 1 . 1 1 113 113 GLY N N 113 108.510 108.510 107.771 0.739 25768 509 1 1 . 1 1 113 113 GLY C C 113 171.540 171.540 171.990 -0.450 25768 510 1 1 . 1 1 113 113 GLY CA C 113 46.120 46.120 45.023 1.097 25768 511 1 1 . 1 1 113 113 GLY H H 113 9.080 9.080 7.977 1.103 25768 512 1 1 . 1 1 114 114 LEU N N 114 120.270 120.270 124.627 -4.357 25768 513 1 1 . 1 1 114 114 LEU C C 114 175.810 175.810 175.541 0.269 25768 514 1 1 . 1 1 114 114 LEU CA C 114 53.920 53.920 52.712 1.208 25768 515 1 1 . 1 1 114 114 LEU CB C 114 47.940 47.940 46.499 1.441 25768 516 1 1 . 1 1 114 114 LEU H H 114 8.620 8.620 8.957 -0.337 25768 517 1 1 . 1 1 115 115 GLY N N 115 110.620 110.620 110.432 0.188 25768 518 1 1 . 1 1 115 115 GLY C C 115 171.560 171.560 172.911 -1.351 25768 519 1 1 . 1 1 115 115 GLY CA C 115 46.940 46.940 43.834 3.106 25768 520 1 1 . 1 1 115 115 GLY H H 115 9.000 9.000 8.445 0.555 25768 521 1 1 . 1 1 116 116 VAL N N 116 113.600 113.600 117.066 -3.466 25768 522 1 1 . 1 1 116 116 VAL C C 116 174.120 174.120 174.970 -0.850 25768 523 1 1 . 1 1 116 116 VAL CA C 116 58.970 58.970 59.487 -0.517 25768 524 1 1 . 1 1 116 116 VAL CB C 116 36.600 36.600 33.187 3.413 25768 525 1 1 . 1 1 116 116 VAL H H 116 8.680 8.680 7.687 0.993 25768 526 1 1 . 1 1 117 117 ASN N N 117 120.020 120.020 121.747 -1.727 25768 527 1 1 . 1 1 117 117 ASN CA C 117 52.190 52.190 52.566 -0.376 25768 528 1 1 . 1 1 117 117 ASN CB C 117 42.450 42.450 40.763 1.687 25768 529 1 1 . 1 1 117 117 ASN H H 117 8.840 8.840 8.272 0.568 25768 530 1 1 . 1 1 119 119 THR C C 119 174.350 174.350 175.440 -1.090 25768 531 1 1 . 1 1 119 119 THR CA C 119 63.140 63.140 62.950 0.190 25768 532 1 1 . 1 1 119 119 THR CB C 119 70.170 70.170 69.475 0.695 25768 533 1 1 . 1 1 120 120 THR N N 120 114.120 114.120 115.332 -1.212 25768 534 1 1 . 1 1 120 120 THR C C 120 174.220 174.220 172.564 1.656 25768 535 1 1 . 1 1 120 120 THR CA C 120 61.900 61.900 61.489 0.411 25768 536 1 1 . 1 1 120 120 THR CB C 120 70.140 70.140 70.950 -0.810 25768 537 1 1 . 1 1 120 120 THR H H 120 7.570 7.570 7.828 -0.258 25768 538 1 1 . 1 1 121 121 PHE N N 121 121.230 121.230 120.443 0.787 25768 539 1 1 . 1 1 121 121 PHE C C 121 174.910 174.910 175.096 -0.186 25768 540 1 1 . 1 1 121 121 PHE CA C 121 58.720 58.720 57.501 1.220 25768 541 1 1 . 1 1 121 121 PHE CB C 121 40.470 40.470 39.956 0.514 25768 542 1 1 . 1 1 121 121 PHE H H 121 7.830 7.830 8.259 -0.429 25768 543 1 1 . 1 1 122 122 PHE C C 122 175.070 175.070 176.557 -1.487 25768 544 1 1 . 1 1 122 122 PHE CA C 122 57.890 57.890 57.169 0.721 25768 545 1 1 . 1 1 122 122 PHE CB C 122 39.870 39.870 40.658 -0.788 25768 546 1 1 . 1 1 123 123 ASP N N 123 122.170 122.170 122.933 -0.763 25768 547 1 1 . 1 1 123 123 ASP C C 123 176.150 176.150 178.276 -2.126 25768 548 1 1 . 1 1 123 123 ASP CA C 123 54.530 54.530 57.510 -2.980 25768 549 1 1 . 1 1 123 123 ASP CB C 123 41.830 41.830 40.994 0.836 25768 550 1 1 . 1 1 123 123 ASP H H 123 7.950 7.950 9.027 -1.077 25768 551 1 1 . 1 1 124 124 GLU N N 124 122.690 122.690 119.836 2.854 25768 552 1 1 . 1 1 124 124 GLU C C 124 176.630 176.630 178.444 -1.814 25768 553 1 1 . 1 1 124 124 GLU CA C 124 57.620 57.620 59.583 -1.963 25768 554 1 1 . 1 1 124 124 GLU CB C 124 30.450 30.450 29.440 1.010 25768 555 1 1 . 1 1 124 124 GLU H H 124 8.340 8.340 8.714 -0.374 25768 556 1 1 . 1 1 125 125 ASP N N 125 121.280 121.280 118.596 2.684 25768 557 1 1 . 1 1 125 125 ASP C C 125 176.940 176.940 177.834 -0.894 25768 558 1 1 . 1 1 125 125 ASP CA C 125 55.180 55.180 56.780 -1.600 25768 559 1 1 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.723 0.497 25768 560 1 1 . 1 1 125 125 ASP H H 125 8.310 8.310 8.591 -0.281 25768 561 1 1 . 1 1 126 126 LEU N N 126 122.830 122.830 120.719 2.111 25768 562 1 1 . 1 1 126 126 LEU C C 126 178.020 178.020 178.103 -0.083 25768 563 1 1 . 1 1 126 126 LEU CA C 126 56.450 56.450 56.890 -0.440 25768 564 1 1 . 1 1 126 126 LEU CB C 126 42.150 42.150 42.701 -0.551 25768 565 1 1 . 1 1 126 126 LEU H H 126 8.010 8.010 7.600 0.410 25768 566 1 1 . 1 1 127 127 ALA N N 127 122.660 122.660 119.694 2.966 25768 567 1 1 . 1 1 127 127 ALA C C 127 178.600 178.600 177.397 1.203 25768 568 1 1 . 1 1 127 127 ALA CA C 127 53.780 53.780 52.523 1.257 25768 569 1 1 . 1 1 127 127 ALA CB C 127 19.000 19.000 19.645 -0.645 25768 570 1 1 . 1 1 127 127 ALA H H 127 8.100 8.100 7.876 0.224 25768 571 1 1 . 1 1 128 128 SER N N 128 113.740 113.740 113.334 0.406 25768 572 1 1 . 1 1 128 128 SER C C 128 175.010 175.010 172.959 2.051 25768 573 1 1 . 1 1 128 128 SER CA C 128 59.580 59.580 58.434 1.146 25768 574 1 1 . 1 1 128 128 SER CB C 128 63.800 63.800 63.147 0.653 25768 575 1 1 . 1 1 128 128 SER H H 128 7.920 7.920 8.274 -0.354 25768 576 1 1 . 1 1 129 129 ASN N N 129 120.300 120.300 119.225 1.075 25768 577 1 1 . 1 1 129 129 ASN C C 129 175.590 175.590 174.376 1.214 25768 578 1 1 . 1 1 129 129 ASN CA C 129 54.180 54.180 52.816 1.364 25768 579 1 1 . 1 1 129 129 ASN CB C 129 38.900 38.900 39.283 -0.383 25768 580 1 1 . 1 1 129 129 ASN H H 129 8.120 8.120 8.398 -0.278 25768 581 1 1 . 1 1 130 130 ARG N N 130 120.630 120.630 121.284 -0.654 25768 582 1 1 . 1 1 130 130 ARG C C 130 176.720 176.720 176.142 0.578 25768 583 1 1 . 1 1 130 130 ARG CA C 130 57.240 57.240 55.941 1.299 25768 584 1 1 . 1 1 130 130 ARG CB C 130 30.500 30.500 31.306 -0.806 25768 585 1 1 . 1 1 130 130 ARG H H 130 8.050 8.050 8.591 -0.541 25768 586 1 1 . 1 1 131 131 LYS N N 131 121.150 121.150 124.383 -3.233 25768 587 1 1 . 1 1 131 131 LYS C C 131 176.750 176.750 176.013 0.737 25768 588 1 1 . 1 1 131 131 LYS CA C 131 57.050 57.050 57.085 -0.035 25768 589 1 1 . 1 1 131 131 LYS CB C 131 32.870 32.870 31.873 0.997 25768 590 1 1 . 1 1 131 131 LYS H H 131 8.020 8.020 8.732 -0.712 25768 591 1 1 . 1 1 132 132 ALA N N 132 124.110 124.110 127.139 -3.029 25768 592 1 1 . 1 1 132 132 ALA C C 132 177.680 177.680 176.571 1.109 25768 593 1 1 . 1 1 132 132 ALA CA C 132 53.070 53.070 52.571 0.499 25768 594 1 1 . 1 1 132 132 ALA CB C 132 19.250 19.250 20.476 -1.226 25768 595 1 1 . 1 1 132 132 ALA H H 132 8.010 8.010 8.792 -0.782 25768 596 1 1 . 1 1 133 133 GLN N N 133 118.830 118.830 117.705 1.125 25768 597 1 1 . 1 1 133 133 GLN C C 133 176.380 176.380 174.349 2.031 25768 598 1 1 . 1 1 133 133 GLN CA C 133 56.400 56.400 56.222 0.178 25768 599 1 1 . 1 1 133 133 GLN CB C 133 29.670 29.670 31.058 -1.388 25768 600 1 1 . 1 1 133 133 GLN H H 133 8.070 8.070 8.489 -0.419 25768 601 1 1 . 1 1 134 134 GLY N N 134 109.400 109.400 109.793 -0.393 25768 602 1 1 . 1 1 134 134 GLY C C 134 174.060 174.060 172.789 1.271 25768 603 1 1 . 1 1 134 134 GLY CA C 134 45.690 45.690 44.752 0.938 25768 604 1 1 . 1 1 134 134 GLY H H 134 8.150 8.150 8.431 -0.281 25768 605 1 1 . 1 1 135 135 PHE N N 135 120.480 120.480 121.303 -0.823 25768 606 1 1 . 1 1 135 135 PHE C C 135 176.000 176.000 174.310 1.690 25768 607 1 1 . 1 1 135 135 PHE CA C 135 58.370 58.370 58.241 0.129 25768 608 1 1 . 1 1 135 135 PHE CB C 135 39.710 39.710 41.176 -1.466 25768 609 1 1 . 1 1 135 135 PHE H H 135 8.060 8.060 8.256 -0.196 25768 610 1 1 . 1 1 136 136 SER N N 136 116.740 116.740 119.061 -2.321 25768 611 1 1 . 1 1 136 136 SER C C 136 174.620 174.620 173.935 0.685 25768 612 1 1 . 1 1 136 136 SER CA C 136 58.870 58.870 58.187 0.683 25768 613 1 1 . 1 1 136 136 SER CB C 136 64.200 64.200 63.206 0.993 25768 614 1 1 . 1 1 136 136 SER H H 136 8.160 8.160 7.882 0.278 25768 615 1 1 . 1 1 137 137 SER N N 137 117.650 117.650 119.835 -2.185 25768 616 1 1 . 1 1 137 137 SER C C 137 174.410 174.410 173.331 1.079 25768 617 1 1 . 1 1 137 137 SER CA C 137 58.880 58.880 57.689 1.191 25768 618 1 1 . 1 1 137 137 SER CB C 137 64.140 64.140 64.114 0.026 25768 619 1 1 . 1 1 137 137 SER H H 137 8.140 8.140 7.948 0.192 25768 620 1 1 . 1 1 138 138 MET N N 138 121.980 121.980 116.922 5.058 25768 621 1 1 . 1 1 138 138 MET C C 138 175.680 175.680 174.988 0.692 25768 622 1 1 . 1 1 138 138 MET CA C 138 56.180 56.180 55.265 0.915 25768 623 1 1 . 1 1 138 138 MET CB C 138 33.240 33.240 32.686 0.554 25768 624 1 1 . 1 1 138 138 MET H H 138 8.110 8.110 8.106 0.004 25768 625 1 1 . 1 1 139 139 LYS N N 139 122.110 122.110 123.932 -1.822 25768 626 1 1 . 1 1 139 139 LYS C C 139 176.220 176.220 175.641 0.579 25768 627 1 1 . 1 1 139 139 LYS CA C 139 56.370 56.370 56.080 0.290 25768 628 1 1 . 1 1 139 139 LYS CB C 139 33.220 33.220 33.144 0.076 25768 629 1 1 . 1 1 139 139 LYS H H 139 8.140 8.140 8.221 -0.081 25768 630 1 1 . 1 1 140 140 LEU N N 140 123.860 123.860 123.523 0.337 25768 631 1 1 . 1 1 140 140 LEU C C 140 177.100 177.100 176.614 0.486 25768 632 1 1 . 1 1 140 140 LEU CA C 140 55.710 55.710 55.324 0.386 25768 633 1 1 . 1 1 140 140 LEU CB C 140 42.460 42.460 43.890 -1.430 25768 634 1 1 . 1 1 140 140 LEU H H 140 8.140 8.140 8.463 -0.323 25768 635 1 1 . 1 1 141 141 GLN N N 141 120.350 120.350 120.488 -0.138 25768 636 1 1 . 1 1 141 141 GLN C C 141 175.170 175.170 175.819 -0.649 25768 637 1 1 . 1 1 141 141 GLN CA C 141 56.200 56.200 56.077 0.123 25768 638 1 1 . 1 1 141 141 GLN CB C 141 29.950 29.950 28.821 1.129 25768 639 1 1 . 1 1 141 141 GLN H H 141 8.210 8.210 8.190 0.020 25768 640 1 1 . 1 1 142 142 ASP N N 142 120.950 120.950 123.847 -2.897 25768 641 1 1 . 1 1 142 142 ASP C C 142 175.840 175.840 176.234 -0.394 25768 642 1 1 . 1 1 142 142 ASP CA C 142 54.700 54.700 54.537 0.163 25768 643 1 1 . 1 1 142 142 ASP CB C 142 41.760 41.760 41.906 -0.146 25768 644 1 1 . 1 1 142 142 ASP H H 142 8.120 8.120 8.856 -0.736 25768 645 1 1 . 1 1 143 143 SER N N 143 114.880 114.880 116.227 -1.347 25768 646 1 1 . 1 1 143 143 SER C C 143 173.290 173.290 173.575 -0.285 25768 647 1 1 . 1 1 143 143 SER CA C 143 58.450 58.450 59.386 -0.936 25768 648 1 1 . 1 1 143 143 SER CB C 143 64.760 64.760 63.763 0.997 25768 649 1 1 . 1 1 143 143 SER H H 143 7.960 7.960 8.169 -0.209 25768 650 1 1 . 1 1 144 144 TRP N N 144 123.110 123.110 125.125 -2.015 25768 651 1 1 . 1 1 144 144 TRP C C 144 175.880 175.880 175.516 0.364 25768 652 1 1 . 1 1 144 144 TRP CA C 144 56.420 56.420 57.140 -0.720 25768 653 1 1 . 1 1 144 144 TRP CB C 144 31.160 31.160 32.178 -1.018 25768 654 1 1 . 1 1 144 144 TRP H H 144 8.080 8.080 8.237 -0.157 25768 655 1 1 . 1 1 145 145 GLY N N 145 110.410 110.410 113.058 -2.648 25768 656 1 1 . 1 1 145 145 GLY C C 145 172.870 172.870 173.319 -0.449 25768 657 1 1 . 1 1 145 145 GLY CA C 145 45.130 45.130 44.593 0.537 25768 658 1 1 . 1 1 145 145 GLY H H 145 8.660 8.660 8.348 0.312 25768 659 1 1 . 1 1 148 148 GLY C C 148 171.800 171.800 173.168 -1.368 25768 660 1 1 . 1 1 148 148 GLY CA C 148 44.140 44.140 44.484 -0.344 25768 661 1 1 . 1 1 149 149 GLU N N 149 123.070 123.070 121.337 1.733 25768 662 1 1 . 1 1 149 149 GLU C C 149 174.210 174.210 174.655 -0.445 25768 663 1 1 . 1 1 149 149 GLU CA C 149 55.120 55.120 54.831 0.289 25768 664 1 1 . 1 1 149 149 GLU CB C 149 37.410 37.410 33.470 3.940 25768 665 1 1 . 1 1 149 149 GLU H H 149 8.550 8.550 8.534 0.016 25768 666 1 1 . 1 1 150 150 LEU N N 150 126.130 126.130 121.193 4.937 25768 667 1 1 . 1 1 150 150 LEU C C 150 174.410 174.410 175.915 -1.505 25768 668 1 1 . 1 1 150 150 LEU CA C 150 54.260 54.260 54.057 0.203 25768 669 1 1 . 1 1 150 150 LEU CB C 150 47.510 47.510 43.581 3.929 25768 670 1 1 . 1 1 150 150 LEU H H 150 8.550 8.550 8.224 0.326 25768 671 1 1 . 1 1 151 151 GLY N N 151 109.500 109.500 108.267 1.233 25768 672 1 1 . 1 1 151 151 GLY C C 151 170.610 170.610 171.594 -0.984 25768 673 1 1 . 1 1 151 151 GLY CA C 151 45.980 45.980 43.343 2.637 25768 674 1 1 . 1 1 151 151 GLY H H 151 8.090 8.090 7.445 0.645 25768 675 1 1 . 1 1 152 152 PHE N N 152 110.960 110.960 120.785 -9.825 25768 676 1 1 . 1 1 152 152 PHE C C 152 171.510 171.510 174.334 -2.824 25768 677 1 1 . 1 1 152 152 PHE CA C 152 58.170 58.170 56.893 1.277 25768 678 1 1 . 1 1 152 152 PHE CB C 152 41.690 41.690 41.748 -0.058 25768 679 1 1 . 1 1 152 152 PHE H H 152 8.380 8.380 8.472 -0.092 25768 680 1 1 . 1 1 153 153 ASP N N 153 118.880 118.880 123.314 -4.434 25768 681 1 1 . 1 1 153 153 ASP C C 153 176.520 176.520 174.815 1.705 25768 682 1 1 . 1 1 153 153 ASP CA C 153 52.940 52.940 53.163 -0.223 25768 683 1 1 . 1 1 153 153 ASP CB C 153 44.540 44.540 44.737 -0.197 25768 684 1 1 . 1 1 153 153 ASP H H 153 7.970 7.970 8.674 -0.704 25768 685 1 1 . 1 1 154 154 TYR N N 154 123.630 123.630 123.719 -0.089 25768 686 1 1 . 1 1 154 154 TYR C C 154 175.610 175.610 173.696 1.914 25768 687 1 1 . 1 1 154 154 TYR CA C 154 57.310 57.310 57.155 0.155 25768 688 1 1 . 1 1 154 154 TYR CB C 154 42.040 42.040 42.635 -0.595 25768 689 1 1 . 1 1 154 154 TYR H H 154 9.730 9.730 9.435 0.295 25768 690 1 1 . 1 1 155 155 MET N N 155 126.190 126.190 127.152 -0.962 25768 691 1 1 . 1 1 155 155 MET C C 155 174.970 174.970 174.676 0.294 25768 692 1 1 . 1 1 155 155 MET CA C 155 54.720 54.720 54.878 -0.158 25768 693 1 1 . 1 1 155 155 MET CB C 155 28.300 28.300 32.956 -4.656 25768 694 1 1 . 1 1 155 155 MET H H 155 8.600 8.600 8.479 0.121 25768 695 1 1 . 1 1 156 156 LEU N N 156 125.290 125.290 127.013 -1.723 25768 696 1 1 . 1 1 156 156 LEU C C 156 177.680 177.680 176.661 1.019 25768 697 1 1 . 1 1 156 156 LEU CA C 156 56.040 56.040 54.531 1.509 25768 698 1 1 . 1 1 156 156 LEU CB C 156 43.040 43.040 42.019 1.021 25768 699 1 1 . 1 1 156 156 LEU H H 156 9.190 9.190 8.774 0.416 25768 700 1 1 . 1 1 157 157 ASN N N 157 114.690 114.690 115.961 -1.271 25768 701 1 1 . 1 1 157 157 ASN C C 157 173.640 173.640 177.133 -3.493 25768 702 1 1 . 1 1 157 157 ASN CA C 157 52.650 52.650 56.558 -3.908 25768 703 1 1 . 1 1 157 157 ASN CB C 157 37.270 37.270 36.564 0.706 25768 704 1 1 . 1 1 157 157 ASN H H 157 8.060 8.060 8.176 -0.116 25768 705 1 1 . 1 1 158 158 GLU N N 158 114.530 114.530 120.492 -5.962 25768 706 1 1 . 1 1 158 158 GLU C C 158 176.090 176.090 177.130 -1.040 25768 707 1 1 . 1 1 158 158 GLU CA C 158 60.010 60.010 58.020 1.990 25768 708 1 1 . 1 1 158 158 GLU CB C 158 29.730 29.730 29.888 -0.158 25768 709 1 1 . 1 1 158 158 GLU H H 158 8.560 8.560 8.263 0.297 25768 710 1 1 . 1 1 159 159 HIS N N 159 110.480 110.480 118.125 -7.645 25768 711 1 1 . 1 1 159 159 HIS C C 159 173.130 173.130 174.010 -0.880 25768 712 1 1 . 1 1 159 159 HIS CA C 159 56.770 56.770 55.135 1.635 25768 713 1 1 . 1 1 159 159 HIS CB C 159 32.630 32.630 29.214 3.416 25768 714 1 1 . 1 1 159 159 HIS H H 159 8.190 8.190 7.361 0.829 25768 715 1 1 . 1 1 160 160 ALA N N 160 122.890 122.890 119.518 3.372 25768 716 1 1 . 1 1 160 160 ALA C C 160 176.200 176.200 175.220 0.980 25768 717 1 1 . 1 1 160 160 ALA CA C 160 51.730 51.730 53.188 -1.458 25768 718 1 1 . 1 1 160 160 ALA CB C 160 21.560 21.560 18.803 2.757 25768 719 1 1 . 1 1 160 160 ALA H H 160 8.400 8.400 7.477 0.923 25768 720 1 1 . 1 1 161 161 LEU N N 161 116.540 116.540 117.204 -0.664 25768 721 1 1 . 1 1 161 161 LEU C C 161 174.930 174.930 176.325 -1.395 25768 722 1 1 . 1 1 161 161 LEU CA C 161 54.280 54.280 54.126 0.154 25768 723 1 1 . 1 1 161 161 LEU CB C 161 45.640 45.640 43.024 2.616 25768 724 1 1 . 1 1 161 161 LEU H H 161 8.590 8.590 8.185 0.405 25768 725 1 1 . 1 1 162 162 PHE N N 162 121.780 121.780 124.524 -2.744 25768 726 1 1 . 1 1 162 162 PHE C C 162 171.960 171.960 174.724 -2.764 25768 727 1 1 . 1 1 162 162 PHE CA C 162 56.420 56.420 57.481 -1.061 25768 728 1 1 . 1 1 162 162 PHE CB C 162 43.340 43.340 42.719 0.621 25768 729 1 1 . 1 1 162 162 PHE H H 162 9.180 9.180 9.496 -0.316 25768 730 1 1 . 1 1 163 163 ASN N N 163 127.850 127.850 119.061 8.789 25768 731 1 1 . 1 1 163 163 ASN C C 163 171.320 171.320 173.634 -2.314 25768 732 1 1 . 1 1 163 163 ASN CA C 163 52.340 52.340 52.226 0.114 25768 733 1 1 . 1 1 163 163 ASN CB C 163 46.410 46.410 42.663 3.748 25768 734 1 1 . 1 1 163 163 ASN H H 163 7.700 7.700 9.653 -1.953 25768 735 1 1 . 1 1 164 164 MET N N 164 119.950 119.950 120.209 -0.259 25768 736 1 1 . 1 1 164 164 MET C C 164 172.830 172.830 173.843 -1.013 25768 737 1 1 . 1 1 164 164 MET CA C 164 55.180 55.180 54.840 0.340 25768 738 1 1 . 1 1 164 164 MET CB C 164 37.770 37.770 37.874 -0.104 25768 739 1 1 . 1 1 164 164 MET H H 164 7.070 7.070 8.992 -1.922 25768 740 1 1 . 1 1 165 165 ALA N N 165 120.600 120.600 126.528 -5.928 25768 741 1 1 . 1 1 165 165 ALA C C 165 174.240 174.240 174.999 -0.759 25768 742 1 1 . 1 1 165 165 ALA CA C 165 51.630 51.630 50.561 1.069 25768 743 1 1 . 1 1 165 165 ALA CB C 165 22.330 22.330 21.914 0.416 25768 744 1 1 . 1 1 165 165 ALA H H 165 8.290 8.290 8.985 -0.695 25768 745 1 1 . 1 1 166 166 VAL N N 166 117.900 117.900 116.843 1.057 25768 746 1 1 . 1 1 166 166 VAL C C 166 172.950 172.950 174.803 -1.853 25768 747 1 1 . 1 1 166 166 VAL CA C 166 59.710 59.710 60.697 -0.987 25768 748 1 1 . 1 1 166 166 VAL CB C 166 35.290 35.290 35.589 -0.299 25768 749 1 1 . 1 1 166 166 VAL H H 166 8.720 8.720 8.068 0.652 25768 750 1 1 . 1 1 171 171 ILE C C 171 175.750 175.750 173.985 1.765 25768 751 1 1 . 1 1 171 171 ILE CA C 171 61.720 61.720 61.681 0.039 25768 752 1 1 . 1 1 171 171 ILE CB C 171 39.300 39.300 37.698 1.602 25768 753 1 1 . 1 1 172 172 ASP N N 172 124.070 124.070 126.730 -2.660 25768 754 1 1 . 1 1 172 172 ASP C C 172 176.590 176.590 175.885 0.705 25768 755 1 1 . 1 1 172 172 ASP CA C 172 54.460 54.460 53.813 0.647 25768 756 1 1 . 1 1 172 172 ASP CB C 172 41.410 41.410 41.150 0.260 25768 757 1 1 . 1 1 172 172 ASP H H 172 8.460 8.460 8.417 0.043 25768 758 1 1 . 1 1 173 173 THR N N 173 115.570 115.570 117.240 -1.670 25768 759 1 1 . 1 1 173 173 THR C C 173 175.030 175.030 174.506 0.524 25768 760 1 1 . 1 1 173 173 THR CA C 173 62.680 62.680 63.540 -0.860 25768 761 1 1 . 1 1 173 173 THR CB C 173 69.840 69.840 68.540 1.300 25768 762 1 1 . 1 1 173 173 THR H H 173 8.080 8.080 8.436 -0.356 25768 763 1 1 . 1 1 174 174 LYS N N 174 122.680 122.680 123.492 -0.812 25768 764 1 1 . 1 1 174 174 LYS C C 174 176.340 176.340 175.892 0.448 25768 765 1 1 . 1 1 174 174 LYS CA C 174 56.820 56.820 56.723 0.097 25768 766 1 1 . 1 1 174 174 LYS CB C 174 32.790 32.790 33.543 -0.753 25768 767 1 1 . 1 1 174 174 LYS H H 174 8.180 8.180 8.230 -0.050 25768 768 1 1 . 1 1 175 175 ALA N N 175 124.050 124.050 123.718 0.332 25768 769 1 1 . 1 1 175 175 ALA C C 175 177.550 177.550 176.965 0.585 25768 770 1 1 . 1 1 175 175 ALA CA C 175 52.840 52.840 52.041 0.799 25768 771 1 1 . 1 1 175 175 ALA CB C 175 19.580 19.580 19.436 0.144 25768 772 1 1 . 1 1 175 175 ALA H H 175 8.050 8.050 8.046 0.004 25768 773 1 1 . 1 1 176 176 SER N N 176 114.920 114.920 115.563 -0.643 25768 774 1 1 . 1 1 176 176 SER C C 176 174.240 174.240 173.433 0.807 25768 775 1 1 . 1 1 176 176 SER CA C 176 58.390 58.390 58.242 0.148 25768 776 1 1 . 1 1 176 176 SER CB C 176 64.370 64.370 63.143 1.227 25768 777 1 1 . 1 1 176 176 SER H H 176 8.070 8.070 8.351 -0.281 25768 778 1 1 . 1 1 177 177 ILE N N 177 121.650 121.650 121.688 -0.038 25768 779 1 1 . 1 1 177 177 ILE C C 177 174.990 174.990 175.344 -0.354 25768 780 1 1 . 1 1 177 177 ILE CA C 177 61.570 61.570 60.587 0.982 25768 781 1 1 . 1 1 177 177 ILE CB C 177 39.100 39.100 38.039 1.061 25768 782 1 1 . 1 1 177 177 ILE H H 177 7.960 7.960 7.944 0.016 25768 783 1 1 . 1 1 178 178 ASN N N 178 127.040 127.040 126.125 0.915 25768 784 1 1 . 1 1 178 178 ASN C C 178 179.160 179.160 175.220 3.940 25768 785 1 1 . 1 1 178 178 ASN CA C 178 55.100 55.100 53.342 1.758 25768 786 1 1 . 1 1 178 178 ASN CB C 178 41.300 41.300 38.809 2.491 25768 787 1 1 . 1 1 178 178 ASN H H 178 7.850 7.850 8.728 -0.878 25768 788 1 1 . 1 1 180 180 PRO C C 180 177.520 177.520 177.162 0.358 25768 789 1 1 . 1 1 180 180 PRO CA C 180 63.980 63.980 63.691 0.289 25768 790 1 1 . 1 1 180 180 PRO CB C 180 32.190 32.190 32.181 0.009 25768 791 1 1 . 1 1 181 181 SER N N 181 115.600 115.600 112.468 3.132 25768 792 1 1 . 1 1 181 181 SER C C 181 174.710 174.710 172.979 1.731 25768 793 1 1 . 1 1 181 181 SER CA C 181 58.900 58.900 57.755 1.145 25768 794 1 1 . 1 1 181 181 SER CB C 181 64.070 64.070 63.428 0.642 25768 795 1 1 . 1 1 181 181 SER H H 181 8.260 8.260 7.930 0.330 25768 796 1 1 . 1 1 182 182 ALA N N 182 125.880 125.880 124.110 1.770 25768 797 1 1 . 1 1 182 182 ALA C C 182 177.560 177.560 175.833 1.727 25768 798 1 1 . 1 1 182 182 ALA CA C 182 53.090 53.090 52.095 0.995 25768 799 1 1 . 1 1 182 182 ALA CB C 182 19.310 19.310 19.767 -0.457 25768 800 1 1 . 1 1 182 182 ALA H H 182 8.130 8.130 7.798 0.332 25768 801 1 1 . 1 1 183 183 LEU N N 183 119.980 119.980 119.977 0.003 25768 802 1 1 . 1 1 183 183 LEU C C 183 177.850 177.850 177.153 0.697 25768 803 1 1 . 1 1 183 183 LEU CA C 183 55.650 55.650 55.501 0.149 25768 804 1 1 . 1 1 183 183 LEU CB C 183 42.530 42.530 45.749 -3.219 25768 805 1 1 . 1 1 183 183 LEU H H 183 7.940 7.940 8.040 -0.100 25768 806 1 1 . 1 1 184 184 GLY N N 184 109.250 109.250 110.006 -0.756 25768 807 1 1 . 1 1 184 184 GLY C C 184 174.250 174.250 173.609 0.641 25768 808 1 1 . 1 1 184 184 GLY CA C 184 45.830 45.830 45.197 0.633 25768 809 1 1 . 1 1 184 184 GLY H H 184 8.150 8.150 8.582 -0.432 25768 810 1 1 . 1 1 185 185 VAL N N 185 118.830 118.830 121.380 -2.550 25768 811 1 1 . 1 1 185 185 VAL C C 185 175.890 175.890 174.359 1.531 25768 812 1 1 . 1 1 185 185 VAL CA C 185 62.740 62.740 62.723 0.017 25768 813 1 1 . 1 1 185 185 VAL CB C 185 32.770 32.770 31.153 1.617 25768 814 1 1 . 1 1 185 185 VAL H H 185 7.760 7.760 8.132 -0.372 25768 815 1 1 . 1 1 186 186 ASN N N 186 121.850 121.850 118.708 3.142 25768 816 1 1 . 1 1 186 186 ASN C C 186 174.970 174.970 174.340 0.630 25768 817 1 1 . 1 1 186 186 ASN CA C 186 53.590 53.590 52.705 0.885 25768 818 1 1 . 1 1 186 186 ASN CB C 186 39.160 39.160 39.732 -0.572 25768 819 1 1 . 1 1 186 186 ASN H H 186 8.380 8.380 7.754 0.626 25768 820 1 1 . 1 1 187 187 LYS N N 187 122.120 122.120 120.877 1.243 25768 821 1 1 . 1 1 187 187 LYS C C 187 176.490 176.490 176.842 -0.352 25768 822 1 1 . 1 1 187 187 LYS CA C 187 56.750 56.750 56.738 0.012 25768 823 1 1 . 1 1 187 187 LYS CB C 187 33.250 33.250 32.915 0.335 25768 824 1 1 . 1 1 187 187 LYS H H 187 8.140 8.140 8.561 -0.421 25768 825 1 1 . 1 1 188 188 THR N N 188 115.250 115.250 114.960 0.290 25768 826 1 1 . 1 1 188 188 THR C C 188 174.250 174.250 173.958 0.292 25768 827 1 1 . 1 1 188 188 THR CA C 188 62.360 62.360 61.542 0.818 25768 828 1 1 . 1 1 188 188 THR CB C 188 70.280 70.280 69.312 0.968 25768 829 1 1 . 1 1 188 188 THR H H 188 8.100 8.100 7.707 0.393 25768 830 1 1 . 1 1 189 189 LYS N N 189 123.780 123.780 125.626 -1.846 25768 831 1 1 . 1 1 189 189 LYS C C 189 176.090 176.090 175.754 0.336 25768 832 1 1 . 1 1 189 189 LYS CA C 189 56.590 56.590 55.728 0.862 25768 833 1 1 . 1 1 189 189 LYS CB C 189 33.350 33.350 33.485 -0.135 25768 834 1 1 . 1 1 189 189 LYS H H 189 8.110 8.110 8.488 -0.378 25768 835 1 1 . 1 1 190 190 VAL N N 190 120.920 120.920 126.694 -5.774 25768 836 1 1 . 1 1 190 190 VAL C C 190 175.590 175.590 175.219 0.371 25768 837 1 1 . 1 1 190 190 VAL CA C 190 62.400 62.400 63.583 -1.183 25768 838 1 1 . 1 1 190 190 VAL CB C 190 32.990 32.990 31.349 1.641 25768 839 1 1 . 1 1 190 190 VAL H H 190 8.040 8.040 8.679 -0.639 25768 840 1 1 . 1 1 191 191 ASP N N 191 123.790 123.790 126.767 -2.977 25768 841 1 1 . 1 1 191 191 ASP C C 191 175.750 175.750 175.764 -0.014 25768 842 1 1 . 1 1 191 191 ASP CA C 191 54.650 54.650 54.258 0.392 25768 843 1 1 . 1 1 191 191 ASP CB C 191 41.450 41.450 42.895 -1.445 25768 844 1 1 . 1 1 191 191 ASP H H 191 8.240 8.240 8.504 -0.264 25768 845 1 1 . 1 1 192 192 VAL N N 192 118.850 118.850 120.735 -1.885 25768 846 1 1 . 1 1 192 192 VAL C C 192 175.380 175.380 174.041 1.339 25768 847 1 1 . 1 1 192 192 VAL CA C 192 62.110 62.110 63.548 -1.438 25768 848 1 1 . 1 1 192 192 VAL CB C 192 33.290 33.290 30.189 3.102 25768 849 1 1 . 1 1 192 192 VAL H H 192 7.860 7.860 8.386 -0.526 25768 850 1 1 . 1 1 193 193 ASP N N 193 124.190 124.190 122.872 1.318 25768 851 1 1 . 1 1 193 193 ASP C C 193 175.630 175.630 175.770 -0.140 25768 852 1 1 . 1 1 193 193 ASP CA C 193 54.540 54.540 53.312 1.228 25768 853 1 1 . 1 1 193 193 ASP CB C 193 41.410 41.410 41.294 0.116 25768 854 1 1 . 1 1 193 193 ASP H H 193 8.310 8.310 7.982 0.328 25768 855 1 1 . 1 1 194 194 VAL N N 194 119.580 119.580 120.895 -1.315 25768 856 1 1 . 1 1 194 194 VAL C C 194 174.950 174.950 175.971 -1.021 25768 857 1 1 . 1 1 194 194 VAL CA C 194 61.770 61.770 63.424 -1.654 25768 858 1 1 . 1 1 194 194 VAL CB C 194 33.680 33.680 32.605 1.075 25768 859 1 1 . 1 1 194 194 VAL H H 194 7.890 7.890 8.085 -0.195 25768 860 1 1 . 1 1 195 195 ASP N N 195 125.660 125.660 127.418 -1.758 25768 861 1 1 . 1 1 195 195 ASP C C 195 174.290 174.290 175.187 -0.897 25768 862 1 1 . 1 1 195 195 ASP CA C 195 51.940 51.940 52.819 -0.879 25768 863 1 1 . 1 1 195 195 ASP CB C 195 40.950 40.950 41.046 -0.096 25768 864 1 1 . 1 1 195 195 ASP H H 195 8.410 8.410 8.379 0.031 25768 865 1 1 . 1 1 198 198 VAL C C 198 173.940 173.940 174.294 -0.354 25768 866 1 1 . 1 1 198 198 VAL CA C 198 61.270 61.270 61.202 0.068 25768 867 1 1 . 1 1 198 198 VAL CB C 198 35.910 35.910 33.239 2.671 25768 868 1 1 . 1 1 199 199 TYR N N 199 123.780 123.780 126.684 -2.904 25768 869 1 1 . 1 1 199 199 TYR C C 199 174.150 174.150 174.436 -0.286 25768 870 1 1 . 1 1 199 199 TYR CA C 199 56.220 56.220 57.562 -1.342 25768 871 1 1 . 1 1 199 199 TYR CB C 199 41.660 41.660 42.693 -1.033 25768 872 1 1 . 1 1 199 199 TYR H H 199 8.540 8.540 8.180 0.360 25768 873 1 1 . 1 1 200 200 MET N N 200 123.920 123.920 123.078 0.842 25768 874 1 1 . 1 1 200 200 MET C C 200 173.810 173.810 174.804 -0.994 25768 875 1 1 . 1 1 200 200 MET CA C 200 54.710 54.710 55.174 -0.464 25768 876 1 1 . 1 1 200 200 MET CB C 200 37.110 37.110 34.830 2.280 25768 877 1 1 . 1 1 200 200 MET H H 200 9.130 9.130 8.491 0.639 25768 878 1 1 . 1 1 201 201 ILE N N 201 123.670 123.670 124.238 -0.568 25768 879 1 1 . 1 1 201 201 ILE C C 201 174.030 174.030 173.707 0.323 25768 880 1 1 . 1 1 201 201 ILE CA C 201 59.820 59.820 59.799 0.021 25768 881 1 1 . 1 1 201 201 ILE CB C 201 41.720 41.720 42.664 -0.944 25768 882 1 1 . 1 1 201 201 ILE H H 201 8.030 8.030 8.247 -0.217 25768 883 1 1 . 1 1 202 202 GLY N N 202 112.910 112.910 113.812 -0.902 25768 884 1 1 . 1 1 202 202 GLY C C 202 170.280 170.280 171.866 -1.586 25768 885 1 1 . 1 1 202 202 GLY CA C 202 46.800 46.800 45.401 1.399 25768 886 1 1 . 1 1 202 202 GLY H H 202 8.580 8.580 8.896 -0.316 25768 887 1 1 . 1 1 203 203 PHE N N 203 116.240 116.240 116.114 0.126 25768 888 1 1 . 1 1 203 203 PHE C C 203 173.940 173.940 174.084 -0.144 25768 889 1 1 . 1 1 203 203 PHE CA C 203 55.890 55.890 53.822 2.067 25768 890 1 1 . 1 1 203 203 PHE CB C 203 45.060 45.060 41.339 3.721 25768 891 1 1 . 1 1 203 203 PHE H H 203 8.620 8.620 8.897 -0.277 25768 892 1 1 . 1 1 204 204 GLY N N 204 105.610 105.610 107.020 -1.410 25768 893 1 1 . 1 1 204 204 GLY C C 204 171.190 171.190 171.177 0.013 25768 894 1 1 . 1 1 204 204 GLY CA C 204 46.720 46.720 45.560 1.160 25768 895 1 1 . 1 1 204 204 GLY H H 204 8.960 8.960 8.858 0.102 25768 896 1 1 . 1 1 205 205 TYR N N 205 121.160 121.160 119.390 1.770 25768 897 1 1 . 1 1 205 205 TYR C C 205 173.030 173.030 174.203 -1.173 25768 898 1 1 . 1 1 205 205 TYR CA C 205 57.190 57.190 56.432 0.758 25768 899 1 1 . 1 1 205 205 TYR CB C 205 44.400 44.400 42.842 1.558 25768 900 1 1 . 1 1 205 205 TYR H H 205 9.380 9.380 8.010 1.370 25768 901 1 1 . 1 1 206 206 LYS N N 206 126.970 126.970 128.140 -1.170 25768 902 1 1 . 1 1 206 206 LYS C C 206 174.210 174.210 175.078 -0.868 25768 903 1 1 . 1 1 206 206 LYS CA C 206 54.770 54.770 55.319 -0.549 25768 904 1 1 . 1 1 206 206 LYS CB C 206 34.440 34.440 32.252 2.188 25768 905 1 1 . 1 1 206 206 LYS H H 206 8.380 8.380 8.367 0.013 25768 906 1 1 . 1 1 207 207 PHE N N 207 126.330 126.330 126.759 -0.429 25768 907 1 1 . 1 1 207 207 PHE C C 207 175.020 175.020 173.956 1.064 25768 908 1 1 . 1 1 207 207 PHE CA C 207 58.170 58.170 58.150 0.020 25768 909 1 1 . 1 1 207 207 PHE CB C 207 40.920 40.920 40.735 0.185 25768 910 1 1 . 1 1 207 207 PHE H H 207 9.290 9.290 8.393 0.897 25768 911 1 1 . 1 1 208 208 LEU N N 208 122.740 122.740 120.961 1.779 25768 912 1 1 . 1 1 208 208 LEU C C 208 176.510 176.510 174.179 2.331 25768 913 1 1 . 1 1 208 208 LEU CA C 208 54.910 54.910 53.914 0.996 25768 914 1 1 . 1 1 208 208 LEU CB C 208 43.830 43.830 44.709 -0.879 25768 915 1 1 . 1 1 208 208 LEU H H 208 8.310 8.310 7.575 0.735 25768 916 1 2 . 1 1 2 2 HIS C C 2 175.310 175.310 174.151 1.159 25768 917 1 2 . 1 1 3 3 LYS N N 3 122.080 122.080 119.879 2.201 25768 918 1 2 . 1 1 3 3 LYS C C 3 173.490 173.490 175.192 -1.702 25768 919 1 2 . 1 1 3 3 LYS CA C 3 55.050 55.050 55.475 -0.425 25768 920 1 2 . 1 1 3 3 LYS CB C 3 35.380 35.380 33.868 1.512 25768 921 1 2 . 1 1 3 3 LYS H H 3 8.620 8.620 8.644 -0.024 25768 922 1 2 . 1 1 4 4 ALA N N 4 120.860 120.860 124.083 -3.223 25768 923 1 2 . 1 1 4 4 ALA C C 4 178.190 178.190 178.194 -0.004 25768 924 1 2 . 1 1 4 4 ALA CA C 4 53.480 53.480 52.786 0.694 25768 925 1 2 . 1 1 4 4 ALA CB C 4 18.140 18.140 18.326 -0.186 25768 926 1 2 . 1 1 4 4 ALA H H 4 8.580 8.580 8.378 0.202 25768 927 1 2 . 1 1 5 5 GLY N N 5 112.890 112.890 111.761 1.129 25768 928 1 2 . 1 1 5 5 GLY C C 5 173.830 173.830 174.231 -0.401 25768 929 1 2 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.450 0.430 25768 930 1 2 . 1 1 5 5 GLY H H 5 9.210 9.210 8.511 0.699 25768 931 1 2 . 1 1 6 6 ASP N N 6 121.590 121.590 120.556 1.034 25768 932 1 2 . 1 1 6 6 ASP C C 6 174.380 174.380 174.446 -0.066 25768 933 1 2 . 1 1 6 6 ASP CA C 6 55.790 55.790 54.829 0.961 25768 934 1 2 . 1 1 6 6 ASP CB C 6 41.760 41.760 42.216 -0.456 25768 935 1 2 . 1 1 6 6 ASP H H 6 7.620 7.620 7.472 0.148 25768 936 1 2 . 1 1 7 7 PHE N N 7 120.860 120.860 124.082 -3.222 25768 937 1 2 . 1 1 7 7 PHE C C 7 174.050 174.050 173.641 0.409 25768 938 1 2 . 1 1 7 7 PHE CA C 7 56.110 56.110 57.337 -1.227 25768 939 1 2 . 1 1 7 7 PHE CB C 7 42.550 42.550 41.069 1.481 25768 940 1 2 . 1 1 7 7 PHE H H 7 8.250 8.250 8.247 0.003 25768 941 1 2 . 1 1 8 8 ILE N N 8 127.950 127.950 127.281 0.669 25768 942 1 2 . 1 1 8 8 ILE C C 8 174.000 174.000 174.269 -0.269 25768 943 1 2 . 1 1 8 8 ILE CA C 8 61.160 61.160 59.727 1.433 25768 944 1 2 . 1 1 8 8 ILE CB C 8 42.660 42.660 41.373 1.287 25768 945 1 2 . 1 1 8 8 ILE H H 8 9.230 9.230 8.113 1.117 25768 946 1 2 . 1 1 9 9 ILE N N 9 125.380 125.380 120.123 5.257 25768 947 1 2 . 1 1 9 9 ILE C C 9 173.630 173.630 174.728 -1.098 25768 948 1 2 . 1 1 9 9 ILE CA C 9 59.600 59.600 59.504 0.096 25768 949 1 2 . 1 1 9 9 ILE CB C 9 41.180 41.180 41.008 0.172 25768 950 1 2 . 1 1 9 9 ILE H H 9 8.580 8.580 8.959 -0.379 25768 951 1 2 . 1 1 10 10 ARG N N 10 124.950 124.950 122.213 2.737 25768 952 1 2 . 1 1 10 10 ARG C C 10 175.030 175.030 173.921 1.109 25768 953 1 2 . 1 1 10 10 ARG CA C 10 53.920 53.920 55.554 -1.634 25768 954 1 2 . 1 1 10 10 ARG CB C 10 31.880 31.880 34.989 -3.109 25768 955 1 2 . 1 1 10 10 ARG H H 10 9.230 9.230 8.829 0.401 25768 956 1 2 . 1 1 11 11 GLY N N 11 105.650 105.650 110.698 -5.048 25768 957 1 2 . 1 1 11 11 GLY C C 11 172.090 172.090 171.429 0.661 25768 958 1 2 . 1 1 11 11 GLY CA C 11 44.460 44.460 44.551 -0.091 25768 959 1 2 . 1 1 11 11 GLY H H 11 8.780 8.780 8.639 0.141 25768 960 1 2 . 1 1 12 12 GLY N N 12 107.800 107.800 106.370 1.430 25768 961 1 2 . 1 1 12 12 GLY C C 12 171.460 171.460 171.210 0.250 25768 962 1 2 . 1 1 12 12 GLY CA C 12 46.630 46.630 44.852 1.778 25768 963 1 2 . 1 1 12 12 GLY H H 12 8.510 8.510 8.098 0.412 25768 964 1 2 . 1 1 13 13 PHE N N 13 119.900 119.900 117.664 2.236 25768 965 1 2 . 1 1 13 13 PHE C C 13 174.190 174.190 174.891 -0.701 25768 966 1 2 . 1 1 13 13 PHE CA C 13 56.340 56.340 55.704 0.636 25768 967 1 2 . 1 1 13 13 PHE CB C 13 41.090 41.090 43.227 -2.137 25768 968 1 2 . 1 1 13 13 PHE H H 13 8.610 8.610 8.089 0.521 25768 969 1 2 . 1 1 14 14 ALA N N 14 128.030 128.030 126.083 1.947 25768 970 1 2 . 1 1 14 14 ALA C C 14 176.560 176.560 177.197 -0.637 25768 971 1 2 . 1 1 14 14 ALA CA C 14 49.940 49.940 51.394 -1.454 25768 972 1 2 . 1 1 14 14 ALA CB C 14 20.360 20.360 19.750 0.610 25768 973 1 2 . 1 1 14 14 ALA H H 14 9.220 9.220 8.771 0.449 25768 974 1 2 . 1 1 15 15 THR N N 15 118.620 118.620 119.636 -1.016 25768 975 1 2 . 1 1 15 15 THR CA C 15 61.440 61.440 62.876 -1.436 25768 976 1 2 . 1 1 15 15 THR CB C 15 71.370 71.370 70.143 1.227 25768 977 1 2 . 1 1 15 15 THR H H 15 9.220 9.220 8.873 0.347 25768 978 1 2 . 1 1 18 18 PRO C C 18 176.690 176.690 175.977 0.713 25768 979 1 2 . 1 1 18 18 PRO CA C 18 63.610 63.610 63.630 -0.020 25768 980 1 2 . 1 1 18 18 PRO CB C 18 32.440 32.440 31.857 0.583 25768 981 1 2 . 1 1 19 19 ASP N N 19 120.320 120.320 121.714 -1.394 25768 982 1 2 . 1 1 19 19 ASP C C 19 175.950 175.950 175.046 0.904 25768 983 1 2 . 1 1 19 19 ASP CA C 19 54.710 54.710 53.721 0.989 25768 984 1 2 . 1 1 19 19 ASP CB C 19 41.450 41.450 43.750 -2.300 25768 985 1 2 . 1 1 19 19 ASP H H 19 8.330 8.330 7.987 0.343 25768 986 1 2 . 1 1 20 20 ASP N N 20 121.990 121.990 122.146 -0.156 25768 987 1 2 . 1 1 20 20 ASP C C 20 176.760 176.760 176.849 -0.089 25768 988 1 2 . 1 1 20 20 ASP CA C 20 54.470 54.470 54.640 -0.170 25768 989 1 2 . 1 1 20 20 ASP CB C 20 41.310 41.310 41.688 -0.378 25768 990 1 2 . 1 1 20 20 ASP H H 20 8.240 8.240 8.429 -0.189 25768 991 1 2 . 1 1 21 21 SER N N 21 117.050 117.050 115.234 1.816 25768 992 1 2 . 1 1 21 21 SER C C 21 175.170 175.170 173.803 1.367 25768 993 1 2 . 1 1 21 21 SER CA C 21 59.490 59.490 58.009 1.481 25768 994 1 2 . 1 1 21 21 SER CB C 21 64.080 64.080 64.124 -0.044 25768 995 1 2 . 1 1 21 21 SER H H 21 8.360 8.360 7.947 0.413 25768 996 1 2 . 1 1 22 22 SER N N 22 117.820 117.820 117.356 0.464 25768 997 1 2 . 1 1 22 22 SER C C 22 174.940 174.940 174.172 0.768 25768 998 1 2 . 1 1 22 22 SER CA C 22 59.160 59.160 57.800 1.360 25768 999 1 2 . 1 1 22 22 SER CB C 22 64.110 64.110 65.112 -1.002 25768 1000 1 2 . 1 1 22 22 SER H H 22 8.310 8.310 8.438 -0.128 25768 1001 1 2 . 1 1 23 23 SER N N 23 117.660 117.660 121.000 -3.340 25768 1002 1 2 . 1 1 23 23 SER C C 23 174.340 174.340 174.331 0.009 25768 1003 1 2 . 1 1 23 23 SER CA C 23 59.050 59.050 59.151 -0.101 25768 1004 1 2 . 1 1 23 23 SER CB C 23 64.210 64.210 63.347 0.863 25768 1005 1 2 . 1 1 23 23 SER H H 23 8.120 8.120 8.766 -0.646 25768 1006 1 2 . 1 1 24 24 ASP N N 24 122.590 122.590 125.402 -2.812 25768 1007 1 2 . 1 1 24 24 ASP C C 24 176.250 176.250 175.598 0.652 25768 1008 1 2 . 1 1 24 24 ASP CA C 24 54.910 54.910 54.760 0.150 25768 1009 1 2 . 1 1 24 24 ASP CB C 24 41.270 41.270 41.603 -0.333 25768 1010 1 2 . 1 1 24 24 ASP H H 24 8.230 8.230 8.338 -0.108 25768 1011 1 2 . 1 1 25 25 ILE N N 25 120.650 120.650 121.489 -0.839 25768 1012 1 2 . 1 1 25 25 ILE C C 25 176.190 176.190 175.867 0.323 25768 1013 1 2 . 1 1 25 25 ILE CA C 25 61.880 61.880 61.263 0.617 25768 1014 1 2 . 1 1 25 25 ILE CB C 25 38.730 38.730 38.853 -0.123 25768 1015 1 2 . 1 1 25 25 ILE H H 25 7.860 7.860 7.862 -0.002 25768 1016 1 2 . 1 1 26 26 LYS N N 26 124.420 124.420 123.518 0.902 25768 1017 1 2 . 1 1 26 26 LYS C C 26 176.640 176.640 175.813 0.827 25768 1018 1 2 . 1 1 26 26 LYS CA C 26 56.520 56.520 55.837 0.682 25768 1019 1 2 . 1 1 26 26 LYS CB C 26 32.890 32.890 32.811 0.079 25768 1020 1 2 . 1 1 26 26 LYS H H 26 8.140 8.140 8.093 0.047 25768 1021 1 2 . 1 1 27 27 LEU N N 27 123.120 123.120 121.835 1.285 25768 1022 1 2 . 1 1 27 27 LEU C C 27 177.110 177.110 175.777 1.333 25768 1023 1 2 . 1 1 27 27 LEU CA C 27 55.590 55.590 55.217 0.373 25768 1024 1 2 . 1 1 27 27 LEU CB C 27 42.500 42.500 42.368 0.132 25768 1025 1 2 . 1 1 27 27 LEU H H 27 8.080 8.080 8.320 -0.240 25768 1026 1 2 . 1 1 28 28 ASP N N 28 120.850 120.850 119.592 1.258 25768 1027 1 2 . 1 1 28 28 ASP C C 28 176.960 176.960 176.568 0.392 25768 1028 1 2 . 1 1 28 28 ASP CA C 28 54.800 54.800 53.068 1.732 25768 1029 1 2 . 1 1 28 28 ASP CB C 28 41.380 41.380 41.321 0.059 25768 1030 1 2 . 1 1 28 28 ASP H H 28 8.180 8.180 8.676 -0.496 25768 1031 1 2 . 1 1 29 29 GLY N N 29 109.800 109.800 108.207 1.593 25768 1032 1 2 . 1 1 29 29 GLY C C 29 174.370 174.370 173.719 0.651 25768 1033 1 2 . 1 1 29 29 GLY CA C 29 46.150 46.150 44.641 1.509 25768 1034 1 2 . 1 1 29 29 GLY H H 29 8.230 8.230 7.897 0.333 25768 1035 1 2 . 1 1 30 30 ALA N N 30 123.880 123.880 126.754 -2.874 25768 1036 1 2 . 1 1 30 30 ALA C C 30 178.040 178.040 176.442 1.598 25768 1037 1 2 . 1 1 30 30 ALA CA C 30 53.140 53.140 51.644 1.496 25768 1038 1 2 . 1 1 30 30 ALA CB C 30 19.350 19.350 19.440 -0.090 25768 1039 1 2 . 1 1 30 30 ALA H H 30 8.040 8.040 8.264 -0.224 25768 1040 1 2 . 1 1 31 31 LYS N N 31 119.800 119.800 121.382 -1.582 25768 1041 1 2 . 1 1 31 31 LYS C C 31 176.770 176.770 175.168 1.602 25768 1042 1 2 . 1 1 31 31 LYS CA C 31 56.870 56.870 56.418 0.452 25768 1043 1 2 . 1 1 31 31 LYS CB C 31 32.980 32.980 32.501 0.479 25768 1044 1 2 . 1 1 31 31 LYS H H 31 8.060 8.060 8.559 -0.499 25768 1045 1 2 . 1 1 32 32 GLN N N 32 120.930 120.930 122.457 -1.527 25768 1046 1 2 . 1 1 32 32 GLN C C 32 176.000 176.000 176.437 -0.437 25768 1047 1 2 . 1 1 32 32 GLN CA C 32 56.280 56.280 56.865 -0.585 25768 1048 1 2 . 1 1 32 32 GLN CB C 32 29.580 29.580 28.688 0.892 25768 1049 1 2 . 1 1 32 32 GLN H H 32 8.170 8.170 8.683 -0.513 25768 1050 1 2 . 1 1 33 33 ARG N N 33 122.370 122.370 125.899 -3.529 25768 1051 1 2 . 1 1 33 33 ARG C C 33 176.820 176.820 176.712 0.108 25768 1052 1 2 . 1 1 33 33 ARG CA C 33 56.680 56.680 55.970 0.710 25768 1053 1 2 . 1 1 33 33 ARG CB C 33 31.040 31.040 30.745 0.295 25768 1054 1 2 . 1 1 33 33 ARG H H 33 8.270 8.270 8.876 -0.606 25768 1055 1 2 . 1 1 34 34 GLY N N 34 110.210 110.210 106.422 3.788 25768 1056 1 2 . 1 1 34 34 GLY C C 34 174.280 174.280 173.730 0.550 25768 1057 1 2 . 1 1 34 34 GLY CA C 34 45.770 45.770 44.387 1.383 25768 1058 1 2 . 1 1 34 34 GLY H H 34 8.360 8.360 8.244 0.116 25768 1059 1 2 . 1 1 35 35 THR N N 35 114.100 114.100 115.784 -1.684 25768 1060 1 2 . 1 1 35 35 THR C C 35 174.550 174.550 174.710 -0.160 25768 1061 1 2 . 1 1 35 35 THR CA C 35 62.140 62.140 61.464 0.676 25768 1062 1 2 . 1 1 35 35 THR CB C 35 70.330 70.330 69.310 1.020 25768 1063 1 2 . 1 1 35 35 THR H H 35 7.970 7.970 8.251 -0.281 25768 1064 1 2 . 1 1 36 36 LYS N N 36 123.850 123.850 127.614 -3.764 25768 1065 1 2 . 1 1 36 36 LYS C C 36 176.040 176.040 176.232 -0.192 25768 1066 1 2 . 1 1 36 36 LYS CA C 36 56.600 56.600 57.250 -0.650 25768 1067 1 2 . 1 1 36 36 LYS CB C 36 33.280 33.280 32.843 0.437 25768 1068 1 2 . 1 1 36 36 LYS H H 36 8.230 8.230 8.911 -0.681 25768 1069 1 2 . 1 1 37 37 ALA N N 37 125.650 125.650 120.896 4.754 25768 1070 1 2 . 1 1 37 37 ALA C C 37 177.570 177.570 176.669 0.901 25768 1071 1 2 . 1 1 37 37 ALA CA C 37 52.860 52.860 52.255 0.605 25768 1072 1 2 . 1 1 37 37 ALA CB C 37 19.610 19.610 19.462 0.148 25768 1073 1 2 . 1 1 37 37 ALA H H 37 8.290 8.290 8.363 -0.073 25768 1074 1 2 . 1 1 38 38 THR N N 38 113.350 113.350 113.966 -0.616 25768 1075 1 2 . 1 1 38 38 THR C C 38 174.540 174.540 174.612 -0.072 25768 1076 1 2 . 1 1 38 38 THR CA C 38 62.010 62.010 61.769 0.241 25768 1077 1 2 . 1 1 38 38 THR CB C 38 70.350 70.350 70.951 -0.601 25768 1078 1 2 . 1 1 38 38 THR H H 38 7.970 7.970 7.707 0.263 25768 1079 1 2 . 1 1 39 39 VAL N N 39 120.790 120.790 117.582 3.208 25768 1080 1 2 . 1 1 39 39 VAL C C 39 175.620 175.620 175.045 0.575 25768 1081 1 2 . 1 1 39 39 VAL CA C 39 62.470 62.470 62.614 -0.144 25768 1082 1 2 . 1 1 39 39 VAL CB C 39 32.940 32.940 32.032 0.908 25768 1083 1 2 . 1 1 39 39 VAL H H 39 8.020 8.020 8.233 -0.213 25768 1084 1 2 . 1 1 40 40 ASP N N 40 123.690 123.690 122.914 0.776 25768 1085 1 2 . 1 1 40 40 ASP C C 40 176.190 176.190 175.933 0.257 25768 1086 1 2 . 1 1 40 40 ASP CA C 40 54.780 54.780 54.383 0.397 25768 1087 1 2 . 1 1 40 40 ASP CB C 40 41.590 41.590 41.265 0.325 25768 1088 1 2 . 1 1 40 40 ASP H H 40 8.310 8.310 8.111 0.199 25768 1089 1 2 . 1 1 41 41 SER N N 41 115.470 115.470 120.129 -4.659 25768 1090 1 2 . 1 1 41 41 SER C C 41 174.170 174.170 174.341 -0.171 25768 1091 1 2 . 1 1 41 41 SER CA C 41 59.000 59.000 59.809 -0.809 25768 1092 1 2 . 1 1 41 41 SER CB C 41 64.420 64.420 63.931 0.489 25768 1093 1 2 . 1 1 41 41 SER H H 41 8.130 8.130 8.849 -0.719 25768 1094 1 2 . 1 1 42 42 ASP N N 42 122.430 122.430 116.330 6.100 25768 1095 1 2 . 1 1 42 42 ASP C C 42 175.740 175.740 174.814 0.926 25768 1096 1 2 . 1 1 42 42 ASP CA C 42 54.780 54.780 53.091 1.689 25768 1097 1 2 . 1 1 42 42 ASP CB C 42 41.620 41.620 41.324 0.296 25768 1098 1 2 . 1 1 42 42 ASP H H 42 8.410 8.410 8.250 0.160 25768 1099 1 2 . 1 1 43 43 THR N N 43 117.580 117.580 111.471 6.109 25768 1100 1 2 . 1 1 43 43 THR C C 43 173.630 173.630 174.562 -0.932 25768 1101 1 2 . 1 1 43 43 THR CA C 43 63.120 63.120 60.901 2.219 25768 1102 1 2 . 1 1 43 43 THR CB C 43 70.650 70.650 69.959 0.691 25768 1103 1 2 . 1 1 43 43 THR H H 43 8.010 8.010 7.422 0.588 25768 1104 1 2 . 1 1 44 44 GLN N N 44 125.420 125.420 119.174 6.246 25768 1105 1 2 . 1 1 44 44 GLN C C 44 174.080 174.080 175.397 -1.317 25768 1106 1 2 . 1 1 44 44 GLN CA C 44 55.110 55.110 55.314 -0.204 25768 1107 1 2 . 1 1 44 44 GLN CB C 44 31.570 31.570 32.146 -0.576 25768 1108 1 2 . 1 1 44 44 GLN H H 44 9.260 9.260 8.585 0.675 25768 1109 1 2 . 1 1 45 45 LEU N N 45 124.190 124.190 126.043 -1.853 25768 1110 1 2 . 1 1 45 45 LEU C C 45 175.970 175.970 176.853 -0.883 25768 1111 1 2 . 1 1 45 45 LEU CA C 45 54.690 54.690 55.923 -1.233 25768 1112 1 2 . 1 1 45 45 LEU CB C 45 42.270 42.270 42.248 0.022 25768 1113 1 2 . 1 1 45 45 LEU H H 45 8.550 8.550 9.246 -0.696 25768 1114 1 2 . 1 1 46 46 GLY N N 46 113.310 113.310 113.001 0.309 25768 1115 1 2 . 1 1 46 46 GLY C C 46 171.180 171.180 172.757 -1.577 25768 1116 1 2 . 1 1 46 46 GLY CA C 46 44.400 44.400 44.205 0.195 25768 1117 1 2 . 1 1 46 46 GLY H H 46 8.810 8.810 8.994 -0.184 25768 1118 1 2 . 1 1 47 47 LEU N N 47 123.890 123.890 128.610 -4.720 25768 1119 1 2 . 1 1 47 47 LEU C C 47 175.400 175.400 175.754 -0.354 25768 1120 1 2 . 1 1 47 47 LEU CA C 47 53.750 53.750 54.305 -0.555 25768 1121 1 2 . 1 1 47 47 LEU CB C 47 46.800 46.800 44.234 2.566 25768 1122 1 2 . 1 1 47 47 LEU H H 47 8.590 8.590 8.404 0.186 25768 1123 1 2 . 1 1 48 48 THR N N 48 111.210 111.210 113.492 -2.282 25768 1124 1 2 . 1 1 48 48 THR C C 48 172.520 172.520 172.918 -0.398 25768 1125 1 2 . 1 1 48 48 THR CA C 48 58.950 58.950 59.827 -0.877 25768 1126 1 2 . 1 1 48 48 THR CB C 48 72.360 72.360 72.014 0.346 25768 1127 1 2 . 1 1 48 48 THR H H 48 8.620 8.620 9.070 -0.450 25768 1128 1 2 . 1 1 49 49 PHE N N 49 118.810 118.810 118.608 0.202 25768 1129 1 2 . 1 1 49 49 PHE C C 49 174.700 174.700 174.345 0.355 25768 1130 1 2 . 1 1 49 49 PHE CA C 49 55.080 55.080 55.547 -0.467 25768 1131 1 2 . 1 1 49 49 PHE CB C 49 42.360 42.360 40.624 1.736 25768 1132 1 2 . 1 1 49 49 PHE H H 49 8.410 8.410 7.673 0.737 25768 1133 1 2 . 1 1 50 50 THR N N 50 121.230 121.230 120.087 1.143 25768 1134 1 2 . 1 1 50 50 THR C C 50 173.250 173.250 172.838 0.412 25768 1135 1 2 . 1 1 50 50 THR CA C 50 62.740 62.740 62.126 0.614 25768 1136 1 2 . 1 1 50 50 THR CB C 50 73.740 73.740 70.144 3.596 25768 1137 1 2 . 1 1 50 50 THR H H 50 9.330 9.330 8.597 0.733 25768 1138 1 2 . 1 1 51 51 TYR N N 51 126.010 126.010 126.996 -0.986 25768 1139 1 2 . 1 1 51 51 TYR C C 51 174.850 174.850 174.861 -0.011 25768 1140 1 2 . 1 1 51 51 TYR CA C 51 56.240 56.240 57.050 -0.810 25768 1141 1 2 . 1 1 51 51 TYR CB C 51 41.630 41.630 40.303 1.327 25768 1142 1 2 . 1 1 51 51 TYR H H 51 9.150 9.150 9.313 -0.163 25768 1143 1 2 . 1 1 52 52 MET N N 52 127.390 127.390 126.233 1.157 25768 1144 1 2 . 1 1 52 52 MET C C 52 174.490 174.490 174.373 0.117 25768 1145 1 2 . 1 1 52 52 MET CA C 52 52.450 52.450 56.604 -4.154 25768 1146 1 2 . 1 1 52 52 MET CB C 52 28.590 28.590 33.058 -4.468 25768 1147 1 2 . 1 1 52 52 MET H H 52 7.950 7.950 8.296 -0.346 25768 1148 1 2 . 1 1 53 53 PHE N N 53 123.830 123.830 127.313 -3.483 25768 1149 1 2 . 1 1 53 53 PHE C C 53 173.720 173.720 173.987 -0.267 25768 1150 1 2 . 1 1 53 53 PHE CA C 53 57.110 57.110 57.177 -0.067 25768 1151 1 2 . 1 1 53 53 PHE CB C 53 39.420 39.420 40.976 -1.556 25768 1152 1 2 . 1 1 53 53 PHE H H 53 7.720 7.720 8.107 -0.387 25768 1153 1 2 . 1 1 54 54 ALA N N 54 125.650 125.650 126.369 -0.719 25768 1154 1 2 . 1 1 54 54 ALA C C 54 175.020 175.020 175.727 -0.707 25768 1155 1 2 . 1 1 54 54 ALA CA C 54 50.740 50.740 52.864 -2.124 25768 1156 1 2 . 1 1 54 54 ALA CB C 54 22.700 22.700 18.731 3.969 25768 1157 1 2 . 1 1 54 54 ALA H H 54 8.360 8.360 8.164 0.196 25768 1158 1 2 . 1 1 55 55 ASP N N 55 118.790 118.790 121.825 -3.035 25768 1159 1 2 . 1 1 55 55 ASP C C 55 174.780 174.780 175.947 -1.167 25768 1160 1 2 . 1 1 55 55 ASP CA C 55 58.590 58.590 54.656 3.934 25768 1161 1 2 . 1 1 55 55 ASP CB C 55 40.430 40.430 40.418 0.012 25768 1162 1 2 . 1 1 55 55 ASP H H 55 8.590 8.590 8.612 -0.022 25768 1163 1 2 . 1 1 56 56 LYS N N 56 106.200 106.200 116.850 -10.650 25768 1164 1 2 . 1 1 56 56 LYS C C 56 174.940 174.940 175.598 -0.658 25768 1165 1 2 . 1 1 56 56 LYS CA C 56 55.260 55.260 56.695 -1.435 25768 1166 1 2 . 1 1 56 56 LYS CB C 56 34.510 34.510 35.278 -0.768 25768 1167 1 2 . 1 1 56 56 LYS H H 56 7.260 7.260 7.555 -0.295 25768 1168 1 2 . 1 1 57 57 TRP N N 57 115.680 115.680 122.125 -6.445 25768 1169 1 2 . 1 1 57 57 TRP C C 57 173.940 173.940 175.478 -1.538 25768 1170 1 2 . 1 1 57 57 TRP CA C 57 55.410 55.410 58.408 -2.998 25768 1171 1 2 . 1 1 57 57 TRP CB C 57 34.470 34.470 31.678 2.792 25768 1172 1 2 . 1 1 57 57 TRP H H 57 6.570 6.570 8.341 -1.772 25768 1173 1 2 . 1 1 58 58 GLY N N 58 107.610 107.610 110.292 -2.682 25768 1174 1 2 . 1 1 58 58 GLY C C 58 172.730 172.730 171.995 0.735 25768 1175 1 2 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.490 -0.440 25768 1176 1 2 . 1 1 58 58 GLY H H 58 9.260 9.260 8.009 1.251 25768 1177 1 2 . 1 1 59 59 VAL N N 59 118.130 118.130 125.925 -7.795 25768 1178 1 2 . 1 1 59 59 VAL C C 59 173.000 173.000 174.659 -1.659 25768 1179 1 2 . 1 1 59 59 VAL CA C 59 59.950 59.950 60.789 -0.840 25768 1180 1 2 . 1 1 59 59 VAL CB C 59 35.170 35.170 32.787 2.383 25768 1181 1 2 . 1 1 59 59 VAL H H 59 9.030 9.030 7.823 1.207 25768 1182 1 2 . 1 1 60 60 GLU N N 60 127.900 127.900 126.196 1.704 25768 1183 1 2 . 1 1 60 60 GLU C C 60 174.470 174.470 174.232 0.238 25768 1184 1 2 . 1 1 60 60 GLU CA C 60 52.940 52.940 53.592 -0.652 25768 1185 1 2 . 1 1 60 60 GLU CB C 60 35.100 35.100 33.743 1.357 25768 1186 1 2 . 1 1 60 60 GLU H H 60 9.440 9.440 8.350 1.090 25768 1187 1 2 . 1 1 61 61 LEU N N 61 127.410 127.410 122.971 4.439 25768 1188 1 2 . 1 1 61 61 LEU C C 61 174.950 174.950 174.845 0.105 25768 1189 1 2 . 1 1 61 61 LEU CA C 61 53.390 53.390 53.311 0.079 25768 1190 1 2 . 1 1 61 61 LEU CB C 61 45.980 45.980 45.011 0.969 25768 1191 1 2 . 1 1 61 61 LEU H H 61 8.740 8.740 7.404 1.336 25768 1192 1 2 . 1 1 62 62 VAL N N 62 125.750 125.750 118.298 7.452 25768 1193 1 2 . 1 1 62 62 VAL C C 62 173.960 173.960 173.969 -0.009 25768 1194 1 2 . 1 1 62 62 VAL CA C 62 61.350 61.350 60.055 1.295 25768 1195 1 2 . 1 1 62 62 VAL CB C 62 34.740 34.740 33.374 1.366 25768 1196 1 2 . 1 1 62 62 VAL H H 62 8.790 8.790 7.925 0.865 25768 1197 1 2 . 1 1 63 63 ALA N N 63 127.230 127.230 126.713 0.517 25768 1198 1 2 . 1 1 63 63 ALA C C 63 173.930 173.930 175.223 -1.293 25768 1199 1 2 . 1 1 63 63 ALA CA C 63 51.140 51.140 51.615 -0.475 25768 1200 1 2 . 1 1 63 63 ALA CB C 63 22.500 22.500 22.479 0.021 25768 1201 1 2 . 1 1 63 63 ALA H H 63 8.740 8.740 7.913 0.827 25768 1202 1 2 . 1 1 64 64 ALA N N 64 120.410 120.410 123.635 -3.225 25768 1203 1 2 . 1 1 64 64 ALA C C 64 176.770 176.770 176.409 0.361 25768 1204 1 2 . 1 1 64 64 ALA CA C 64 51.420 51.420 51.110 0.310 25768 1205 1 2 . 1 1 64 64 ALA CB C 64 22.590 22.590 22.888 -0.298 25768 1206 1 2 . 1 1 64 64 ALA H H 64 8.290 8.290 8.313 -0.023 25768 1207 1 2 . 1 1 65 65 THR N N 65 116.130 116.130 116.296 -0.166 25768 1208 1 2 . 1 1 65 65 THR C C 65 171.220 171.220 172.668 -1.448 25768 1209 1 2 . 1 1 65 65 THR CA C 65 58.860 58.860 59.706 -0.846 25768 1210 1 2 . 1 1 65 65 THR CB C 65 72.020 72.020 69.644 2.376 25768 1211 1 2 . 1 1 65 65 THR H H 65 8.760 8.760 8.497 0.263 25768 1212 1 2 . 1 1 66 66 PRO C C 66 176.720 176.720 176.122 0.598 25768 1213 1 2 . 1 1 66 66 PRO CA C 66 63.610 63.610 63.022 0.588 25768 1214 1 2 . 1 1 66 66 PRO CB C 66 32.550 32.550 32.276 0.274 25768 1215 1 2 . 1 1 67 67 PHE N N 67 120.360 120.360 120.400 -0.040 25768 1216 1 2 . 1 1 67 67 PHE C C 67 175.480 175.480 174.890 0.590 25768 1217 1 2 . 1 1 67 67 PHE CA C 67 58.840 58.840 57.834 1.006 25768 1218 1 2 . 1 1 67 67 PHE CB C 67 40.170 40.170 40.934 -0.764 25768 1219 1 2 . 1 1 67 67 PHE H H 67 8.590 8.590 8.294 0.296 25768 1220 1 2 . 1 1 68 68 ASN N N 68 119.030 119.030 123.706 -4.676 25768 1221 1 2 . 1 1 68 68 ASN C C 68 174.740 174.740 173.624 1.116 25768 1222 1 2 . 1 1 68 68 ASN CA C 68 53.430 53.430 53.699 -0.269 25768 1223 1 2 . 1 1 68 68 ASN CB C 68 39.420 39.420 39.598 -0.178 25768 1224 1 2 . 1 1 68 68 ASN H H 68 8.340 8.340 8.231 0.109 25768 1225 1 2 . 1 1 69 69 HIS N N 69 119.590 119.590 119.517 0.073 25768 1226 1 2 . 1 1 69 69 HIS C C 69 174.370 174.370 174.442 -0.072 25768 1227 1 2 . 1 1 69 69 HIS CA C 69 55.950 55.950 55.300 0.651 25768 1228 1 2 . 1 1 69 69 HIS CB C 69 29.960 29.960 32.223 -2.263 25768 1229 1 2 . 1 1 69 69 HIS H H 69 8.350 8.350 8.366 -0.016 25768 1230 1 2 . 1 1 70 70 GLN N N 70 121.980 121.980 121.014 0.966 25768 1231 1 2 . 1 1 70 70 GLN C C 70 175.740 175.740 175.661 0.079 25768 1232 1 2 . 1 1 70 70 GLN CA C 70 56.340 56.340 55.047 1.293 25768 1233 1 2 . 1 1 70 70 GLN CB C 70 29.660 29.660 31.717 -2.057 25768 1234 1 2 . 1 1 70 70 GLN H H 70 8.350 8.350 8.621 -0.271 25768 1235 1 2 . 1 1 71 71 VAL N N 71 120.530 120.530 119.832 0.698 25768 1236 1 2 . 1 1 71 71 VAL C C 71 175.500 175.500 176.111 -0.611 25768 1237 1 2 . 1 1 71 71 VAL CA C 71 62.540 62.540 63.452 -0.912 25768 1238 1 2 . 1 1 71 71 VAL CB C 71 33.090 33.090 32.176 0.914 25768 1239 1 2 . 1 1 71 71 VAL H H 71 8.020 8.020 8.451 -0.431 25768 1240 1 2 . 1 1 72 72 ASP N N 72 123.910 123.910 117.081 6.829 25768 1241 1 2 . 1 1 72 72 ASP C C 72 176.300 176.300 175.859 0.441 25768 1242 1 2 . 1 1 72 72 ASP CA C 72 54.340 54.340 55.330 -0.990 25768 1243 1 2 . 1 1 72 72 ASP CB C 72 41.480 41.480 41.261 0.219 25768 1244 1 2 . 1 1 72 72 ASP H H 72 8.280 8.280 7.838 0.442 25768 1245 1 2 . 1 1 73 73 VAL N N 73 120.580 120.580 114.756 5.824 25768 1246 1 2 . 1 1 73 73 VAL C C 73 176.350 176.350 174.644 1.706 25768 1247 1 2 . 1 1 73 73 VAL CA C 73 62.970 62.970 63.026 -0.056 25768 1248 1 2 . 1 1 73 73 VAL CB C 73 32.550 32.550 33.369 -0.819 25768 1249 1 2 . 1 1 73 73 VAL H H 73 7.960 7.960 8.333 -0.373 25768 1250 1 2 . 1 1 74 74 LYS N N 74 123.620 123.620 121.581 2.039 25768 1251 1 2 . 1 1 74 74 LYS C C 74 177.130 177.130 175.050 2.080 25768 1252 1 2 . 1 1 74 74 LYS CA C 74 57.060 57.060 56.398 0.662 25768 1253 1 2 . 1 1 74 74 LYS CB C 74 32.860 32.860 33.219 -0.359 25768 1254 1 2 . 1 1 74 74 LYS H H 74 8.230 8.230 7.540 0.690 25768 1255 1 2 . 1 1 75 75 GLY N N 75 109.370 109.370 111.504 -2.134 25768 1256 1 2 . 1 1 75 75 GLY C C 75 174.030 174.030 174.457 -0.427 25768 1257 1 2 . 1 1 75 75 GLY CA C 75 45.800 45.800 45.000 0.800 25768 1258 1 2 . 1 1 75 75 GLY H H 75 8.160 8.160 8.421 -0.261 25768 1259 1 2 . 1 1 76 76 LEU N N 76 121.660 121.660 120.856 0.804 25768 1260 1 2 . 1 1 76 76 LEU C C 76 177.410 177.410 177.127 0.283 25768 1261 1 2 . 1 1 76 76 LEU CA C 76 55.410 55.410 54.005 1.405 25768 1262 1 2 . 1 1 76 76 LEU CB C 76 42.790 42.790 43.733 -0.943 25768 1263 1 2 . 1 1 76 76 LEU H H 76 8.030 8.030 8.373 -0.343 25768 1264 1 2 . 1 1 77 77 GLY N N 77 109.330 109.330 107.788 1.542 25768 1265 1 2 . 1 1 77 77 GLY C C 77 171.800 171.800 172.797 -0.997 25768 1266 1 2 . 1 1 77 77 GLY CA C 77 44.990 44.990 44.187 0.803 25768 1267 1 2 . 1 1 77 77 GLY H H 77 8.100 8.100 8.570 -0.470 25768 1268 1 2 . 1 1 78 78 PRO C C 78 177.740 177.740 176.387 1.353 25768 1269 1 2 . 1 1 78 78 PRO CA C 78 63.890 63.890 62.800 1.090 25768 1270 1 2 . 1 1 78 78 PRO CB C 78 32.170 32.170 30.962 1.208 25768 1271 1 2 . 1 1 79 79 GLY N N 79 109.530 109.530 111.861 -2.331 25768 1272 1 2 . 1 1 79 79 GLY C C 79 174.460 174.460 173.365 1.095 25768 1273 1 2 . 1 1 79 79 GLY CA C 79 45.780 45.780 45.462 0.318 25768 1274 1 2 . 1 1 79 79 GLY H H 79 8.410 8.410 8.624 -0.214 25768 1275 1 2 . 1 1 80 80 LEU N N 80 121.880 121.880 120.495 1.385 25768 1276 1 2 . 1 1 80 80 LEU C C 80 177.100 177.100 174.886 2.214 25768 1277 1 2 . 1 1 80 80 LEU CA C 80 55.720 55.720 53.474 2.246 25768 1278 1 2 . 1 1 80 80 LEU CB C 80 42.580 42.580 44.564 -1.984 25768 1279 1 2 . 1 1 80 80 LEU H H 80 8.010 8.010 7.878 0.132 25768 1280 1 2 . 1 1 81 81 ASP N N 81 119.990 119.990 120.901 -0.911 25768 1281 1 2 . 1 1 81 81 ASP C C 81 176.880 176.880 175.680 1.200 25768 1282 1 2 . 1 1 81 81 ASP CA C 81 54.770 54.770 53.866 0.904 25768 1283 1 2 . 1 1 81 81 ASP CB C 81 41.390 41.390 40.837 0.553 25768 1284 1 2 . 1 1 81 81 ASP H H 81 8.220 8.220 8.501 -0.281 25768 1285 1 2 . 1 1 82 82 GLY N N 82 109.270 109.270 112.231 -2.961 25768 1286 1 2 . 1 1 82 82 GLY C C 82 174.190 174.190 173.541 0.649 25768 1287 1 2 . 1 1 82 82 GLY CA C 82 45.990 45.990 45.533 0.457 25768 1288 1 2 . 1 1 82 82 GLY H H 82 8.170 8.170 8.412 -0.242 25768 1289 1 2 . 1 1 83 83 LYS N N 83 121.000 121.000 122.178 -1.178 25768 1290 1 2 . 1 1 83 83 LYS C C 83 176.610 176.610 176.923 -0.313 25768 1291 1 2 . 1 1 83 83 LYS CA C 83 56.620 56.620 55.561 1.059 25768 1292 1 2 . 1 1 83 83 LYS CB C 83 33.020 33.020 33.542 -0.522 25768 1293 1 2 . 1 1 83 83 LYS H H 83 7.970 7.970 8.106 -0.136 25768 1294 1 2 . 1 1 84 84 LEU N N 84 123.120 123.120 122.400 0.720 25768 1295 1 2 . 1 1 84 84 LEU C C 84 176.920 176.920 176.442 0.478 25768 1296 1 2 . 1 1 84 84 LEU CA C 84 55.550 55.550 54.831 0.719 25768 1297 1 2 . 1 1 84 84 LEU CB C 84 42.430 42.430 42.035 0.395 25768 1298 1 2 . 1 1 84 84 LEU H H 84 8.130 8.130 8.286 -0.156 25768 1299 1 2 . 1 1 85 85 ALA N N 85 123.930 123.930 122.538 1.392 25768 1300 1 2 . 1 1 85 85 ALA C C 85 177.060 177.060 176.268 0.792 25768 1301 1 2 . 1 1 85 85 ALA CA C 85 52.790 52.790 52.145 0.645 25768 1302 1 2 . 1 1 85 85 ALA CB C 85 19.670 19.670 18.391 1.279 25768 1303 1 2 . 1 1 85 85 ALA H H 85 8.040 8.040 7.886 0.154 25768 1304 1 2 . 1 1 86 86 ASP N N 86 119.760 119.760 122.008 -2.248 25768 1305 1 2 . 1 1 86 86 ASP C C 86 175.820 175.820 175.343 0.477 25768 1306 1 2 . 1 1 86 86 ASP CA C 86 54.520 54.520 53.196 1.324 25768 1307 1 2 . 1 1 86 86 ASP CB C 86 41.390 41.390 42.276 -0.886 25768 1308 1 2 . 1 1 86 86 ASP H H 86 8.110 8.110 8.210 -0.100 25768 1309 1 2 . 1 1 87 87 ILE N N 87 120.620 120.620 118.786 1.834 25768 1310 1 2 . 1 1 87 87 ILE C C 87 175.740 175.740 175.979 -0.239 25768 1311 1 2 . 1 1 87 87 ILE CA C 87 61.160 61.160 61.580 -0.420 25768 1312 1 2 . 1 1 87 87 ILE CB C 87 39.260 39.260 38.230 1.030 25768 1313 1 2 . 1 1 87 87 ILE H H 87 7.800 7.800 8.366 -0.566 25768 1314 1 2 . 1 1 88 88 LYS N N 88 125.820 125.820 121.420 4.400 25768 1315 1 2 . 1 1 88 88 LYS C C 88 175.340 175.340 175.832 -0.492 25768 1316 1 2 . 1 1 88 88 LYS CA C 88 56.300 56.300 55.788 0.512 25768 1317 1 2 . 1 1 88 88 LYS CB C 88 32.900 32.900 32.537 0.363 25768 1318 1 2 . 1 1 88 88 LYS H H 88 8.250 8.250 8.057 0.193 25768 1319 1 2 . 1 1 89 89 GLN N N 89 121.750 121.750 120.143 1.607 25768 1320 1 2 . 1 1 89 89 GLN C C 89 175.000 175.000 175.972 -0.972 25768 1321 1 2 . 1 1 89 89 GLN CA C 89 55.210 55.210 56.459 -1.249 25768 1322 1 2 . 1 1 89 89 GLN CB C 89 30.570 30.570 29.340 1.230 25768 1323 1 2 . 1 1 89 89 GLN H H 89 8.000 8.000 8.014 -0.014 25768 1324 1 2 . 1 1 90 90 LEU N N 90 126.660 126.660 123.840 2.820 25768 1325 1 2 . 1 1 90 90 LEU C C 90 174.240 174.240 175.156 -0.916 25768 1326 1 2 . 1 1 90 90 LEU CA C 90 52.720 52.720 51.920 0.800 25768 1327 1 2 . 1 1 90 90 LEU CB C 90 42.350 42.350 42.396 -0.046 25768 1328 1 2 . 1 1 90 90 LEU H H 90 8.630 8.630 8.274 0.356 25768 1329 1 2 . 1 1 92 92 PRO C C 92 173.900 173.900 176.888 -2.988 25768 1330 1 2 . 1 1 92 92 PRO CA C 92 63.320 63.320 62.774 0.546 25768 1331 1 2 . 1 1 92 92 PRO CB C 92 31.920 31.920 32.496 -0.576 25768 1332 1 2 . 1 1 93 93 THR N N 93 119.770 119.770 116.039 3.731 25768 1333 1 2 . 1 1 93 93 THR C C 93 171.360 171.360 173.797 -2.437 25768 1334 1 2 . 1 1 93 93 THR CA C 93 62.610 62.610 61.464 1.146 25768 1335 1 2 . 1 1 93 93 THR CB C 93 72.680 72.680 70.632 2.047 25768 1336 1 2 . 1 1 93 93 THR H H 93 8.290 8.290 8.354 -0.064 25768 1337 1 2 . 1 1 94 94 LEU N N 94 128.880 128.880 127.322 1.558 25768 1338 1 2 . 1 1 94 94 LEU C C 94 175.130 175.130 175.034 0.096 25768 1339 1 2 . 1 1 94 94 LEU CA C 94 53.520 53.520 54.477 -0.957 25768 1340 1 2 . 1 1 94 94 LEU CB C 94 46.140 46.140 43.654 2.486 25768 1341 1 2 . 1 1 94 94 LEU H H 94 8.680 8.680 8.902 -0.222 25768 1342 1 2 . 1 1 95 95 LEU N N 95 123.630 123.630 123.975 -0.345 25768 1343 1 2 . 1 1 95 95 LEU C C 95 175.540 175.540 174.568 0.972 25768 1344 1 2 . 1 1 95 95 LEU CA C 95 55.190 55.190 53.960 1.230 25768 1345 1 2 . 1 1 95 95 LEU CB C 95 45.300 45.300 45.978 -0.678 25768 1346 1 2 . 1 1 95 95 LEU H H 95 9.580 9.580 7.908 1.672 25768 1347 1 2 . 1 1 96 96 LEU N N 96 123.150 123.150 124.048 -0.898 25768 1348 1 2 . 1 1 96 96 LEU C C 96 174.960 174.960 175.324 -0.364 25768 1349 1 2 . 1 1 96 96 LEU CA C 96 54.420 54.420 54.387 0.033 25768 1350 1 2 . 1 1 96 96 LEU CB C 96 44.560 44.560 41.579 2.981 25768 1351 1 2 . 1 1 96 96 LEU H H 96 8.770 8.770 8.930 -0.160 25768 1352 1 2 . 1 1 97 97 GLN N N 97 121.290 121.290 123.189 -1.899 25768 1353 1 2 . 1 1 97 97 GLN C C 97 174.380 174.380 174.346 0.034 25768 1354 1 2 . 1 1 97 97 GLN CA C 97 54.740 54.740 54.452 0.288 25768 1355 1 2 . 1 1 97 97 GLN CB C 97 36.600 36.600 32.885 3.715 25768 1356 1 2 . 1 1 97 97 GLN H H 97 9.480 9.480 8.532 0.948 25768 1357 1 2 . 1 1 98 98 TYR N N 98 122.250 122.250 119.696 2.554 25768 1358 1 2 . 1 1 98 98 TYR C C 98 173.460 173.460 175.436 -1.976 25768 1359 1 2 . 1 1 98 98 TYR CA C 98 55.160 55.160 56.252 -1.092 25768 1360 1 2 . 1 1 98 98 TYR CB C 98 42.420 42.420 42.892 -0.472 25768 1361 1 2 . 1 1 98 98 TYR H H 98 9.010 9.010 9.416 -0.406 25768 1362 1 2 . 1 1 99 99 TYR N N 99 126.860 126.860 121.755 5.105 25768 1363 1 2 . 1 1 99 99 TYR C C 99 175.380 175.380 174.960 0.420 25768 1364 1 2 . 1 1 99 99 TYR CA C 99 54.220 54.220 54.903 -0.683 25768 1365 1 2 . 1 1 99 99 TYR CB C 99 38.890 38.890 37.957 0.933 25768 1366 1 2 . 1 1 99 99 TYR H H 99 8.300 8.300 8.423 -0.123 25768 1367 1 2 . 1 1 100 100 PRO C C 100 178.330 178.330 177.432 0.898 25768 1368 1 2 . 1 1 100 100 PRO CA C 100 64.750 64.750 64.876 -0.126 25768 1369 1 2 . 1 1 100 100 PRO CB C 100 32.130 32.130 32.046 0.084 25768 1370 1 2 . 1 1 101 101 MET N N 101 114.520 114.520 116.303 -1.783 25768 1371 1 2 . 1 1 101 101 MET C C 101 178.240 178.240 175.913 2.327 25768 1372 1 2 . 1 1 101 101 MET CA C 101 53.500 53.500 54.424 -0.924 25768 1373 1 2 . 1 1 101 101 MET CB C 101 30.160 30.160 32.092 -1.931 25768 1374 1 2 . 1 1 101 101 MET H H 101 9.390 9.390 8.136 1.254 25768 1375 1 2 . 1 1 102 102 GLY N N 102 117.500 117.500 108.223 9.277 25768 1376 1 2 . 1 1 102 102 GLY C C 102 175.690 175.690 174.602 1.088 25768 1377 1 2 . 1 1 102 102 GLY CA C 102 46.760 46.760 45.283 1.476 25768 1378 1 2 . 1 1 102 102 GLY H H 102 8.640 8.640 7.481 1.159 25768 1379 1 2 . 1 1 103 103 GLY N N 103 111.030 111.030 111.378 -0.348 25768 1380 1 2 . 1 1 103 103 GLY C C 103 174.070 174.070 174.350 -0.280 25768 1381 1 2 . 1 1 103 103 GLY CA C 103 46.140 46.140 44.862 1.278 25768 1382 1 2 . 1 1 103 103 GLY H H 103 9.390 9.390 8.558 0.832 25768 1383 1 2 . 1 1 104 104 THR N N 104 109.290 109.290 113.747 -4.457 25768 1384 1 2 . 1 1 104 104 THR C C 104 174.290 174.290 174.527 -0.237 25768 1385 1 2 . 1 1 104 104 THR CA C 104 60.900 60.900 59.772 1.128 25768 1386 1 2 . 1 1 104 104 THR CB C 104 72.070 72.070 70.097 1.973 25768 1387 1 2 . 1 1 104 104 THR H H 104 7.290 7.290 7.883 -0.593 25768 1388 1 2 . 1 1 105 105 ASN C C 105 175.050 175.050 174.292 0.758 25768 1389 1 2 . 1 1 105 105 ASN CA C 105 52.880 52.880 52.674 0.206 25768 1390 1 2 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.561 -0.301 25768 1391 1 2 . 1 1 106 106 SER N N 106 113.000 113.000 116.419 -3.419 25768 1392 1 2 . 1 1 106 106 SER C C 106 176.000 176.000 174.628 1.372 25768 1393 1 2 . 1 1 106 106 SER CA C 106 58.700 58.700 57.926 0.774 25768 1394 1 2 . 1 1 106 106 SER CB C 106 64.540 64.540 64.004 0.536 25768 1395 1 2 . 1 1 106 106 SER H H 106 7.450 7.450 7.281 0.169 25768 1396 1 2 . 1 1 107 107 ALA N N 107 132.220 132.220 125.841 6.379 25768 1397 1 2 . 1 1 107 107 ALA C C 107 176.610 176.610 176.741 -0.131 25768 1398 1 2 . 1 1 107 107 ALA CA C 107 54.380 54.380 53.600 0.780 25768 1399 1 2 . 1 1 107 107 ALA CB C 107 18.690 18.690 19.038 -0.348 25768 1400 1 2 . 1 1 107 107 ALA H H 107 8.870 8.870 8.440 0.430 25768 1401 1 2 . 1 1 108 108 PHE N N 108 116.050 116.050 111.990 4.060 25768 1402 1 2 . 1 1 108 108 PHE C C 108 174.270 174.270 173.800 0.470 25768 1403 1 2 . 1 1 108 108 PHE CA C 108 56.140 56.140 54.408 1.732 25768 1404 1 2 . 1 1 108 108 PHE CB C 108 40.520 40.520 41.864 -1.344 25768 1405 1 2 . 1 1 108 108 PHE H H 108 7.550 7.550 6.733 0.817 25768 1406 1 2 . 1 1 109 109 GLN N N 109 128.260 128.260 118.866 9.394 25768 1407 1 2 . 1 1 109 109 GLN C C 109 172.300 172.300 173.360 -1.060 25768 1408 1 2 . 1 1 109 109 GLN CA C 109 52.310 52.310 52.937 -0.627 25768 1409 1 2 . 1 1 109 109 GLN CB C 109 29.050 29.050 29.631 -0.581 25768 1410 1 2 . 1 1 109 109 GLN H H 109 9.060 9.060 9.149 -0.089 25768 1411 1 2 . 1 1 110 110 PRO C C 110 175.020 175.020 175.854 -0.834 25768 1412 1 2 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.144 -0.594 25768 1413 1 2 . 1 1 110 110 PRO CB C 110 33.280 33.280 31.962 1.318 25768 1414 1 2 . 1 1 111 111 TYR N N 111 115.730 115.730 113.993 1.737 25768 1415 1 2 . 1 1 111 111 TYR C C 111 173.850 173.850 173.399 0.451 25768 1416 1 2 . 1 1 111 111 TYR CA C 111 56.470 56.470 56.369 0.101 25768 1417 1 2 . 1 1 111 111 TYR CB C 111 38.650 38.650 39.519 -0.869 25768 1418 1 2 . 1 1 111 111 TYR H H 111 8.500 8.500 7.406 1.094 25768 1419 1 2 . 1 1 112 112 GLY N N 112 103.570 103.570 107.893 -4.323 25768 1420 1 2 . 1 1 112 112 GLY C C 112 172.020 172.020 172.773 -0.753 25768 1421 1 2 . 1 1 112 112 GLY CA C 112 43.950 43.950 43.523 0.427 25768 1422 1 2 . 1 1 112 112 GLY H H 112 8.110 8.110 8.644 -0.534 25768 1423 1 2 . 1 1 113 113 GLY N N 113 108.510 108.510 110.687 -2.177 25768 1424 1 2 . 1 1 113 113 GLY C C 113 171.540 171.540 171.583 -0.043 25768 1425 1 2 . 1 1 113 113 GLY CA C 113 46.120 46.120 43.436 2.684 25768 1426 1 2 . 1 1 113 113 GLY H H 113 9.080 9.080 9.253 -0.173 25768 1427 1 2 . 1 1 114 114 LEU N N 114 120.270 120.270 121.976 -1.706 25768 1428 1 2 . 1 1 114 114 LEU C C 114 175.810 175.810 174.739 1.071 25768 1429 1 2 . 1 1 114 114 LEU CA C 114 53.920 53.920 54.568 -0.648 25768 1430 1 2 . 1 1 114 114 LEU CB C 114 47.940 47.940 46.427 1.513 25768 1431 1 2 . 1 1 114 114 LEU H H 114 8.620 8.620 8.567 0.053 25768 1432 1 2 . 1 1 115 115 GLY N N 115 110.620 110.620 112.010 -1.390 25768 1433 1 2 . 1 1 115 115 GLY C C 115 171.560 171.560 173.446 -1.886 25768 1434 1 2 . 1 1 115 115 GLY CA C 115 46.940 46.940 43.701 3.239 25768 1435 1 2 . 1 1 115 115 GLY H H 115 9.000 9.000 8.808 0.192 25768 1436 1 2 . 1 1 116 116 VAL N N 116 113.600 113.600 115.909 -2.309 25768 1437 1 2 . 1 1 116 116 VAL C C 116 174.120 174.120 174.560 -0.440 25768 1438 1 2 . 1 1 116 116 VAL CA C 116 58.970 58.970 60.058 -1.088 25768 1439 1 2 . 1 1 116 116 VAL CB C 116 36.600 36.600 33.000 3.600 25768 1440 1 2 . 1 1 116 116 VAL H H 116 8.680 8.680 7.663 1.017 25768 1441 1 2 . 1 1 117 117 ASN N N 117 120.020 120.020 124.697 -4.677 25768 1442 1 2 . 1 1 117 117 ASN CA C 117 52.190 52.190 52.386 -0.196 25768 1443 1 2 . 1 1 117 117 ASN CB C 117 42.450 42.450 40.027 2.423 25768 1444 1 2 . 1 1 117 117 ASN H H 117 8.840 8.840 8.208 0.632 25768 1445 1 2 . 1 1 119 119 THR C C 119 174.350 174.350 175.020 -0.670 25768 1446 1 2 . 1 1 119 119 THR CA C 119 63.140 63.140 61.737 1.403 25768 1447 1 2 . 1 1 119 119 THR CB C 119 70.170 70.170 69.817 0.353 25768 1448 1 2 . 1 1 120 120 THR N N 120 114.120 114.120 112.520 1.600 25768 1449 1 2 . 1 1 120 120 THR C C 120 174.220 174.220 174.089 0.131 25768 1450 1 2 . 1 1 120 120 THR CA C 120 61.900 61.900 62.555 -0.655 25768 1451 1 2 . 1 1 120 120 THR CB C 120 70.140 70.140 69.873 0.267 25768 1452 1 2 . 1 1 120 120 THR H H 120 7.570 7.570 8.626 -1.056 25768 1453 1 2 . 1 1 121 121 PHE N N 121 121.230 121.230 119.083 2.147 25768 1454 1 2 . 1 1 121 121 PHE C C 121 174.910 174.910 175.348 -0.438 25768 1455 1 2 . 1 1 121 121 PHE CA C 121 58.720 58.720 58.388 0.332 25768 1456 1 2 . 1 1 121 121 PHE CB C 121 40.470 40.470 38.887 1.583 25768 1457 1 2 . 1 1 121 121 PHE H H 121 7.830 7.830 8.078 -0.248 25768 1458 1 2 . 1 1 122 122 PHE C C 122 175.070 175.070 174.224 0.846 25768 1459 1 2 . 1 1 122 122 PHE CA C 122 57.890 57.890 58.507 -0.617 25768 1460 1 2 . 1 1 122 122 PHE CB C 122 39.870 39.870 38.997 0.873 25768 1461 1 2 . 1 1 123 123 ASP N N 123 122.170 122.170 119.369 2.801 25768 1462 1 2 . 1 1 123 123 ASP C C 123 176.150 176.150 175.812 0.338 25768 1463 1 2 . 1 1 123 123 ASP CA C 123 54.530 54.530 53.802 0.728 25768 1464 1 2 . 1 1 123 123 ASP CB C 123 41.830 41.830 43.482 -1.652 25768 1465 1 2 . 1 1 123 123 ASP H H 123 7.950 7.950 8.353 -0.403 25768 1466 1 2 . 1 1 124 124 GLU N N 124 122.690 122.690 121.580 1.110 25768 1467 1 2 . 1 1 124 124 GLU C C 124 176.630 176.630 177.708 -1.078 25768 1468 1 2 . 1 1 124 124 GLU CA C 124 57.620 57.620 58.249 -0.629 25768 1469 1 2 . 1 1 124 124 GLU CB C 124 30.450 30.450 30.044 0.406 25768 1470 1 2 . 1 1 124 124 GLU H H 124 8.340 8.340 8.763 -0.423 25768 1471 1 2 . 1 1 125 125 ASP N N 125 121.280 121.280 118.793 2.487 25768 1472 1 2 . 1 1 125 125 ASP C C 125 176.940 176.940 178.237 -1.297 25768 1473 1 2 . 1 1 125 125 ASP CA C 125 55.180 55.180 57.344 -2.164 25768 1474 1 2 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.306 0.914 25768 1475 1 2 . 1 1 125 125 ASP H H 125 8.310 8.310 8.689 -0.379 25768 1476 1 2 . 1 1 126 126 LEU N N 126 122.830 122.830 115.489 7.341 25768 1477 1 2 . 1 1 126 126 LEU C C 126 178.020 178.020 177.881 0.139 25768 1478 1 2 . 1 1 126 126 LEU CA C 126 56.450 56.450 56.773 -0.323 25768 1479 1 2 . 1 1 126 126 LEU CB C 126 42.150 42.150 41.441 0.709 25768 1480 1 2 . 1 1 126 126 LEU H H 126 8.010 8.010 7.558 0.452 25768 1481 1 2 . 1 1 127 127 ALA N N 127 122.660 122.660 120.434 2.226 25768 1482 1 2 . 1 1 127 127 ALA C C 127 178.600 178.600 178.579 0.021 25768 1483 1 2 . 1 1 127 127 ALA CA C 127 53.780 53.780 53.449 0.331 25768 1484 1 2 . 1 1 127 127 ALA CB C 127 19.000 19.000 19.303 -0.303 25768 1485 1 2 . 1 1 127 127 ALA H H 127 8.100 8.100 7.862 0.238 25768 1486 1 2 . 1 1 128 128 SER N N 128 113.740 113.740 116.041 -2.301 25768 1487 1 2 . 1 1 128 128 SER C C 128 175.010 175.010 174.037 0.973 25768 1488 1 2 . 1 1 128 128 SER CA C 128 59.580 59.580 58.862 0.718 25768 1489 1 2 . 1 1 128 128 SER CB C 128 63.800 63.800 62.250 1.550 25768 1490 1 2 . 1 1 128 128 SER H H 128 7.920 7.920 8.010 -0.090 25768 1491 1 2 . 1 1 129 129 ASN N N 129 120.300 120.300 123.178 -2.878 25768 1492 1 2 . 1 1 129 129 ASN C C 129 175.590 175.590 174.126 1.464 25768 1493 1 2 . 1 1 129 129 ASN CA C 129 54.180 54.180 53.926 0.254 25768 1494 1 2 . 1 1 129 129 ASN CB C 129 38.900 38.900 40.592 -1.692 25768 1495 1 2 . 1 1 129 129 ASN H H 129 8.120 8.120 8.265 -0.145 25768 1496 1 2 . 1 1 130 130 ARG N N 130 120.630 120.630 124.246 -3.616 25768 1497 1 2 . 1 1 130 130 ARG C C 130 176.720 176.720 176.251 0.469 25768 1498 1 2 . 1 1 130 130 ARG CA C 130 57.240 57.240 56.181 1.059 25768 1499 1 2 . 1 1 130 130 ARG CB C 130 30.500 30.500 29.749 0.751 25768 1500 1 2 . 1 1 130 130 ARG H H 130 8.050 8.050 8.528 -0.478 25768 1501 1 2 . 1 1 131 131 LYS N N 131 121.150 121.150 122.624 -1.474 25768 1502 1 2 . 1 1 131 131 LYS C C 131 176.750 176.750 176.213 0.537 25768 1503 1 2 . 1 1 131 131 LYS CA C 131 57.050 57.050 56.778 0.272 25768 1504 1 2 . 1 1 131 131 LYS CB C 131 32.870 32.870 33.107 -0.237 25768 1505 1 2 . 1 1 131 131 LYS H H 131 8.020 8.020 8.242 -0.222 25768 1506 1 2 . 1 1 132 132 ALA N N 132 124.110 124.110 123.897 0.213 25768 1507 1 2 . 1 1 132 132 ALA C C 132 177.680 177.680 175.971 1.709 25768 1508 1 2 . 1 1 132 132 ALA CA C 132 53.070 53.070 51.837 1.233 25768 1509 1 2 . 1 1 132 132 ALA CB C 132 19.250 19.250 19.464 -0.214 25768 1510 1 2 . 1 1 132 132 ALA H H 132 8.010 8.010 8.278 -0.268 25768 1511 1 2 . 1 1 133 133 GLN N N 133 118.830 118.830 119.667 -0.837 25768 1512 1 2 . 1 1 133 133 GLN C C 133 176.380 176.380 175.405 0.975 25768 1513 1 2 . 1 1 133 133 GLN CA C 133 56.400 56.400 55.833 0.567 25768 1514 1 2 . 1 1 133 133 GLN CB C 133 29.670 29.670 28.139 1.531 25768 1515 1 2 . 1 1 133 133 GLN H H 133 8.070 8.070 8.453 -0.383 25768 1516 1 2 . 1 1 134 134 GLY N N 134 109.400 109.400 109.491 -0.091 25768 1517 1 2 . 1 1 134 134 GLY C C 134 174.060 174.060 173.560 0.500 25768 1518 1 2 . 1 1 134 134 GLY CA C 134 45.690 45.690 44.527 1.163 25768 1519 1 2 . 1 1 134 134 GLY H H 134 8.150 8.150 8.310 -0.160 25768 1520 1 2 . 1 1 135 135 PHE N N 135 120.480 120.480 126.098 -5.618 25768 1521 1 2 . 1 1 135 135 PHE C C 135 176.000 176.000 175.412 0.588 25768 1522 1 2 . 1 1 135 135 PHE CA C 135 58.370 58.370 57.936 0.434 25768 1523 1 2 . 1 1 135 135 PHE CB C 135 39.710 39.710 38.353 1.357 25768 1524 1 2 . 1 1 135 135 PHE H H 135 8.060 8.060 7.937 0.123 25768 1525 1 2 . 1 1 136 136 SER N N 136 116.740 116.740 118.936 -2.196 25768 1526 1 2 . 1 1 136 136 SER C C 136 174.620 174.620 173.241 1.379 25768 1527 1 2 . 1 1 136 136 SER CA C 136 58.870 58.870 59.120 -0.250 25768 1528 1 2 . 1 1 136 136 SER CB C 136 64.200 64.200 63.376 0.824 25768 1529 1 2 . 1 1 136 136 SER H H 136 8.160 8.160 8.375 -0.215 25768 1530 1 2 . 1 1 137 137 SER N N 137 117.650 117.650 120.168 -2.518 25768 1531 1 2 . 1 1 137 137 SER C C 137 174.410 174.410 173.752 0.658 25768 1532 1 2 . 1 1 137 137 SER CA C 137 58.880 58.880 57.905 0.975 25768 1533 1 2 . 1 1 137 137 SER CB C 137 64.140 64.140 64.746 -0.606 25768 1534 1 2 . 1 1 137 137 SER H H 137 8.140 8.140 8.502 -0.362 25768 1535 1 2 . 1 1 138 138 MET N N 138 121.980 121.980 123.454 -1.474 25768 1536 1 2 . 1 1 138 138 MET C C 138 175.680 175.680 176.275 -0.595 25768 1537 1 2 . 1 1 138 138 MET CA C 138 56.180 56.180 56.024 0.156 25768 1538 1 2 . 1 1 138 138 MET CB C 138 33.240 33.240 32.998 0.242 25768 1539 1 2 . 1 1 138 138 MET H H 138 8.110 8.110 8.401 -0.291 25768 1540 1 2 . 1 1 139 139 LYS N N 139 122.110 122.110 121.587 0.523 25768 1541 1 2 . 1 1 139 139 LYS C C 139 176.220 176.220 176.842 -0.622 25768 1542 1 2 . 1 1 139 139 LYS CA C 139 56.370 56.370 56.427 -0.057 25768 1543 1 2 . 1 1 139 139 LYS CB C 139 33.220 33.220 32.351 0.869 25768 1544 1 2 . 1 1 139 139 LYS H H 139 8.140 8.140 7.923 0.217 25768 1545 1 2 . 1 1 140 140 LEU N N 140 123.860 123.860 123.480 0.380 25768 1546 1 2 . 1 1 140 140 LEU C C 140 177.100 177.100 176.746 0.354 25768 1547 1 2 . 1 1 140 140 LEU CA C 140 55.710 55.710 56.024 -0.314 25768 1548 1 2 . 1 1 140 140 LEU CB C 140 42.460 42.460 42.727 -0.267 25768 1549 1 2 . 1 1 140 140 LEU H H 140 8.140 8.140 8.513 -0.373 25768 1550 1 2 . 1 1 141 141 GLN N N 141 120.350 120.350 118.291 2.059 25768 1551 1 2 . 1 1 141 141 GLN C C 141 175.170 175.170 174.607 0.563 25768 1552 1 2 . 1 1 141 141 GLN CA C 141 56.200 56.200 55.388 0.812 25768 1553 1 2 . 1 1 141 141 GLN CB C 141 29.950 29.950 30.513 -0.563 25768 1554 1 2 . 1 1 141 141 GLN H H 141 8.210 8.210 7.812 0.398 25768 1555 1 2 . 1 1 142 142 ASP N N 142 120.950 120.950 122.195 -1.245 25768 1556 1 2 . 1 1 142 142 ASP C C 142 175.840 175.840 175.436 0.404 25768 1557 1 2 . 1 1 142 142 ASP CA C 142 54.700 54.700 53.979 0.721 25768 1558 1 2 . 1 1 142 142 ASP CB C 142 41.760 41.760 39.428 2.332 25768 1559 1 2 . 1 1 142 142 ASP H H 142 8.120 8.120 8.609 -0.489 25768 1560 1 2 . 1 1 143 143 SER N N 143 114.880 114.880 115.689 -0.809 25768 1561 1 2 . 1 1 143 143 SER C C 143 173.290 173.290 173.160 0.130 25768 1562 1 2 . 1 1 143 143 SER CA C 143 58.450 58.450 58.559 -0.109 25768 1563 1 2 . 1 1 143 143 SER CB C 143 64.760 64.760 63.744 1.016 25768 1564 1 2 . 1 1 143 143 SER H H 143 7.960 7.960 8.425 -0.465 25768 1565 1 2 . 1 1 144 144 TRP N N 144 123.110 123.110 121.957 1.153 25768 1566 1 2 . 1 1 144 144 TRP C C 144 175.880 175.880 176.648 -0.768 25768 1567 1 2 . 1 1 144 144 TRP CA C 144 56.420 56.420 57.621 -1.201 25768 1568 1 2 . 1 1 144 144 TRP CB C 144 31.160 31.160 30.858 0.302 25768 1569 1 2 . 1 1 144 144 TRP H H 144 8.080 8.080 7.897 0.183 25768 1570 1 2 . 1 1 145 145 GLY N N 145 110.410 110.410 113.318 -2.908 25768 1571 1 2 . 1 1 145 145 GLY C C 145 172.870 172.870 173.846 -0.976 25768 1572 1 2 . 1 1 145 145 GLY CA C 145 45.130 45.130 44.658 0.472 25768 1573 1 2 . 1 1 145 145 GLY H H 145 8.660 8.660 8.120 0.540 25768 1574 1 2 . 1 1 148 148 GLY C C 148 171.800 171.800 172.803 -1.003 25768 1575 1 2 . 1 1 148 148 GLY CA C 148 44.140 44.140 43.523 0.617 25768 1576 1 2 . 1 1 149 149 GLU N N 149 123.070 123.070 119.484 3.586 25768 1577 1 2 . 1 1 149 149 GLU C C 149 174.210 174.210 174.150 0.060 25768 1578 1 2 . 1 1 149 149 GLU CA C 149 55.120 55.120 55.654 -0.534 25768 1579 1 2 . 1 1 149 149 GLU CB C 149 37.410 37.410 34.030 3.380 25768 1580 1 2 . 1 1 149 149 GLU H H 149 8.550 8.550 8.649 -0.099 25768 1581 1 2 . 1 1 150 150 LEU N N 150 126.130 126.130 121.564 4.566 25768 1582 1 2 . 1 1 150 150 LEU C C 150 174.410 174.410 174.844 -0.434 25768 1583 1 2 . 1 1 150 150 LEU CA C 150 54.260 54.260 52.307 1.952 25768 1584 1 2 . 1 1 150 150 LEU CB C 150 47.510 47.510 44.779 2.731 25768 1585 1 2 . 1 1 150 150 LEU H H 150 8.550 8.550 8.169 0.381 25768 1586 1 2 . 1 1 151 151 GLY N N 151 109.500 109.500 106.004 3.496 25768 1587 1 2 . 1 1 151 151 GLY C C 151 170.610 170.610 171.279 -0.669 25768 1588 1 2 . 1 1 151 151 GLY CA C 151 45.980 45.980 43.747 2.233 25768 1589 1 2 . 1 1 151 151 GLY H H 151 8.090 8.090 7.399 0.691 25768 1590 1 2 . 1 1 152 152 PHE N N 152 110.960 110.960 119.085 -8.125 25768 1591 1 2 . 1 1 152 152 PHE C C 152 171.510 171.510 173.931 -2.421 25768 1592 1 2 . 1 1 152 152 PHE CA C 152 58.170 58.170 56.120 2.050 25768 1593 1 2 . 1 1 152 152 PHE CB C 152 41.690 41.690 42.497 -0.807 25768 1594 1 2 . 1 1 152 152 PHE H H 152 8.380 8.380 7.953 0.427 25768 1595 1 2 . 1 1 153 153 ASP N N 153 118.880 118.880 127.551 -8.671 25768 1596 1 2 . 1 1 153 153 ASP C C 153 176.520 176.520 174.675 1.845 25768 1597 1 2 . 1 1 153 153 ASP CA C 153 52.940 52.940 53.681 -0.741 25768 1598 1 2 . 1 1 153 153 ASP CB C 153 44.540 44.540 43.395 1.145 25768 1599 1 2 . 1 1 153 153 ASP H H 153 7.970 7.970 8.540 -0.570 25768 1600 1 2 . 1 1 154 154 TYR N N 154 123.630 123.630 127.589 -3.959 25768 1601 1 2 . 1 1 154 154 TYR C C 154 175.610 175.610 174.171 1.439 25768 1602 1 2 . 1 1 154 154 TYR CA C 154 57.310 57.310 56.810 0.500 25768 1603 1 2 . 1 1 154 154 TYR CB C 154 42.040 42.040 41.717 0.323 25768 1604 1 2 . 1 1 154 154 TYR H H 154 9.730 9.730 9.378 0.352 25768 1605 1 2 . 1 1 155 155 MET N N 155 126.190 126.190 126.496 -0.306 25768 1606 1 2 . 1 1 155 155 MET C C 155 174.970 174.970 174.802 0.168 25768 1607 1 2 . 1 1 155 155 MET CA C 155 54.720 54.720 56.145 -1.425 25768 1608 1 2 . 1 1 155 155 MET CB C 155 28.300 28.300 32.822 -4.522 25768 1609 1 2 . 1 1 155 155 MET H H 155 8.600 8.600 7.956 0.644 25768 1610 1 2 . 1 1 156 156 LEU N N 156 125.290 125.290 124.484 0.806 25768 1611 1 2 . 1 1 156 156 LEU C C 156 177.680 177.680 177.747 -0.067 25768 1612 1 2 . 1 1 156 156 LEU CA C 156 56.040 56.040 54.607 1.433 25768 1613 1 2 . 1 1 156 156 LEU CB C 156 43.040 43.040 43.389 -0.349 25768 1614 1 2 . 1 1 156 156 LEU H H 156 9.190 9.190 8.257 0.933 25768 1615 1 2 . 1 1 157 157 ASN N N 157 114.690 114.690 116.937 -2.247 25768 1616 1 2 . 1 1 157 157 ASN C C 157 173.640 173.640 177.050 -3.410 25768 1617 1 2 . 1 1 157 157 ASN CA C 157 52.650 52.650 56.254 -3.604 25768 1618 1 2 . 1 1 157 157 ASN CB C 157 37.270 37.270 37.067 0.203 25768 1619 1 2 . 1 1 157 157 ASN H H 157 8.060 8.060 8.456 -0.396 25768 1620 1 2 . 1 1 158 158 GLU N N 158 114.530 114.530 120.542 -6.012 25768 1621 1 2 . 1 1 158 158 GLU C C 158 176.090 176.090 176.993 -0.903 25768 1622 1 2 . 1 1 158 158 GLU CA C 158 60.010 60.010 58.340 1.670 25768 1623 1 2 . 1 1 158 158 GLU CB C 158 29.730 29.730 29.865 -0.135 25768 1624 1 2 . 1 1 158 158 GLU H H 158 8.560 8.560 8.493 0.067 25768 1625 1 2 . 1 1 159 159 HIS N N 159 110.480 110.480 119.549 -9.069 25768 1626 1 2 . 1 1 159 159 HIS C C 159 173.130 173.130 174.575 -1.445 25768 1627 1 2 . 1 1 159 159 HIS CA C 159 56.770 56.770 55.146 1.624 25768 1628 1 2 . 1 1 159 159 HIS CB C 159 32.630 32.630 29.419 3.211 25768 1629 1 2 . 1 1 159 159 HIS H H 159 8.190 8.190 7.624 0.566 25768 1630 1 2 . 1 1 160 160 ALA N N 160 122.890 122.890 120.938 1.952 25768 1631 1 2 . 1 1 160 160 ALA C C 160 176.200 176.200 175.326 0.874 25768 1632 1 2 . 1 1 160 160 ALA CA C 160 51.730 51.730 53.172 -1.442 25768 1633 1 2 . 1 1 160 160 ALA CB C 160 21.560 21.560 18.769 2.791 25768 1634 1 2 . 1 1 160 160 ALA H H 160 8.400 8.400 7.515 0.885 25768 1635 1 2 . 1 1 161 161 LEU N N 161 116.540 116.540 119.263 -2.723 25768 1636 1 2 . 1 1 161 161 LEU C C 161 174.930 174.930 176.335 -1.405 25768 1637 1 2 . 1 1 161 161 LEU CA C 161 54.280 54.280 53.645 0.634 25768 1638 1 2 . 1 1 161 161 LEU CB C 161 45.640 45.640 42.939 2.701 25768 1639 1 2 . 1 1 161 161 LEU H H 161 8.590 8.590 8.127 0.463 25768 1640 1 2 . 1 1 162 162 PHE N N 162 121.780 121.780 126.272 -4.492 25768 1641 1 2 . 1 1 162 162 PHE C C 162 171.960 171.960 174.567 -2.607 25768 1642 1 2 . 1 1 162 162 PHE CA C 162 56.420 56.420 56.822 -0.402 25768 1643 1 2 . 1 1 162 162 PHE CB C 162 43.340 43.340 41.075 2.265 25768 1644 1 2 . 1 1 162 162 PHE H H 162 9.180 9.180 8.937 0.243 25768 1645 1 2 . 1 1 163 163 ASN N N 163 127.850 127.850 123.750 4.100 25768 1646 1 2 . 1 1 163 163 ASN C C 163 171.320 171.320 174.136 -2.816 25768 1647 1 2 . 1 1 163 163 ASN CA C 163 52.340 52.340 51.618 0.722 25768 1648 1 2 . 1 1 163 163 ASN CB C 163 46.410 46.410 43.020 3.390 25768 1649 1 2 . 1 1 163 163 ASN H H 163 7.700 7.700 8.019 -0.319 25768 1650 1 2 . 1 1 164 164 MET N N 164 119.950 119.950 118.615 1.335 25768 1651 1 2 . 1 1 164 164 MET C C 164 172.830 172.830 174.881 -2.051 25768 1652 1 2 . 1 1 164 164 MET CA C 164 55.180 55.180 54.274 0.906 25768 1653 1 2 . 1 1 164 164 MET CB C 164 37.770 37.770 38.222 -0.452 25768 1654 1 2 . 1 1 164 164 MET H H 164 7.070 7.070 8.092 -1.022 25768 1655 1 2 . 1 1 165 165 ALA N N 165 120.600 120.600 122.922 -2.322 25768 1656 1 2 . 1 1 165 165 ALA C C 165 174.240 174.240 175.045 -0.805 25768 1657 1 2 . 1 1 165 165 ALA CA C 165 51.630 51.630 51.101 0.529 25768 1658 1 2 . 1 1 165 165 ALA CB C 165 22.330 22.330 22.147 0.183 25768 1659 1 2 . 1 1 165 165 ALA H H 165 8.290 8.290 8.435 -0.145 25768 1660 1 2 . 1 1 166 166 VAL N N 166 117.900 117.900 120.343 -2.443 25768 1661 1 2 . 1 1 166 166 VAL C C 166 172.950 172.950 174.277 -1.327 25768 1662 1 2 . 1 1 166 166 VAL CA C 166 59.710 59.710 60.536 -0.826 25768 1663 1 2 . 1 1 166 166 VAL CB C 166 35.290 35.290 36.321 -1.030 25768 1664 1 2 . 1 1 166 166 VAL H H 166 8.720 8.720 8.743 -0.023 25768 1665 1 2 . 1 1 171 171 ILE C C 171 175.750 175.750 175.095 0.655 25768 1666 1 2 . 1 1 171 171 ILE CA C 171 61.720 61.720 61.132 0.588 25768 1667 1 2 . 1 1 171 171 ILE CB C 171 39.300 39.300 40.104 -0.804 25768 1668 1 2 . 1 1 172 172 ASP N N 172 124.070 124.070 123.147 0.923 25768 1669 1 2 . 1 1 172 172 ASP C C 172 176.590 176.590 175.589 1.001 25768 1670 1 2 . 1 1 172 172 ASP CA C 172 54.460 54.460 55.684 -1.224 25768 1671 1 2 . 1 1 172 172 ASP CB C 172 41.410 41.410 41.070 0.340 25768 1672 1 2 . 1 1 172 172 ASP H H 172 8.460 8.460 7.941 0.519 25768 1673 1 2 . 1 1 173 173 THR N N 173 115.570 115.570 116.075 -0.505 25768 1674 1 2 . 1 1 173 173 THR C C 173 175.030 175.030 174.091 0.939 25768 1675 1 2 . 1 1 173 173 THR CA C 173 62.680 62.680 61.385 1.295 25768 1676 1 2 . 1 1 173 173 THR CB C 173 69.840 69.840 70.288 -0.448 25768 1677 1 2 . 1 1 173 173 THR H H 173 8.080 8.080 7.760 0.320 25768 1678 1 2 . 1 1 174 174 LYS N N 174 122.680 122.680 120.900 1.780 25768 1679 1 2 . 1 1 174 174 LYS C C 174 176.340 176.340 176.761 -0.421 25768 1680 1 2 . 1 1 174 174 LYS CA C 174 56.820 56.820 56.561 0.259 25768 1681 1 2 . 1 1 174 174 LYS CB C 174 32.790 32.790 32.852 -0.062 25768 1682 1 2 . 1 1 174 174 LYS H H 174 8.180 8.180 8.519 -0.339 25768 1683 1 2 . 1 1 175 175 ALA N N 175 124.050 124.050 122.953 1.097 25768 1684 1 2 . 1 1 175 175 ALA C C 175 177.550 177.550 176.526 1.024 25768 1685 1 2 . 1 1 175 175 ALA CA C 175 52.840 52.840 52.062 0.778 25768 1686 1 2 . 1 1 175 175 ALA CB C 175 19.580 19.580 19.668 -0.088 25768 1687 1 2 . 1 1 175 175 ALA H H 175 8.050 8.050 7.738 0.312 25768 1688 1 2 . 1 1 176 176 SER N N 176 114.920 114.920 113.874 1.046 25768 1689 1 2 . 1 1 176 176 SER C C 176 174.240 174.240 173.845 0.395 25768 1690 1 2 . 1 1 176 176 SER CA C 176 58.390 58.390 57.734 0.656 25768 1691 1 2 . 1 1 176 176 SER CB C 176 64.370 64.370 65.399 -1.029 25768 1692 1 2 . 1 1 176 176 SER H H 176 8.070 8.070 8.200 -0.130 25768 1693 1 2 . 1 1 177 177 ILE N N 177 121.650 121.650 121.698 -0.048 25768 1694 1 2 . 1 1 177 177 ILE C C 177 174.990 174.990 175.059 -0.069 25768 1695 1 2 . 1 1 177 177 ILE CA C 177 61.570 61.570 60.872 0.698 25768 1696 1 2 . 1 1 177 177 ILE CB C 177 39.100 39.100 39.459 -0.359 25768 1697 1 2 . 1 1 177 177 ILE H H 177 7.960 7.960 8.273 -0.313 25768 1698 1 2 . 1 1 178 178 ASN N N 178 127.040 127.040 121.932 5.108 25768 1699 1 2 . 1 1 178 178 ASN C C 178 179.160 179.160 175.181 3.979 25768 1700 1 2 . 1 1 178 178 ASN CA C 178 55.100 55.100 53.324 1.776 25768 1701 1 2 . 1 1 178 178 ASN CB C 178 41.300 41.300 38.838 2.462 25768 1702 1 2 . 1 1 178 178 ASN H H 178 7.850 7.850 8.499 -0.649 25768 1703 1 2 . 1 1 180 180 PRO C C 180 177.520 177.520 176.625 0.895 25768 1704 1 2 . 1 1 180 180 PRO CA C 180 63.980 63.980 63.502 0.478 25768 1705 1 2 . 1 1 180 180 PRO CB C 180 32.190 32.190 31.892 0.298 25768 1706 1 2 . 1 1 181 181 SER N N 181 115.600 115.600 118.902 -3.302 25768 1707 1 2 . 1 1 181 181 SER C C 181 174.710 174.710 173.060 1.650 25768 1708 1 2 . 1 1 181 181 SER CA C 181 58.900 58.900 58.545 0.355 25768 1709 1 2 . 1 1 181 181 SER CB C 181 64.070 64.070 63.115 0.955 25768 1710 1 2 . 1 1 181 181 SER H H 181 8.260 8.260 8.459 -0.199 25768 1711 1 2 . 1 1 182 182 ALA N N 182 125.880 125.880 126.477 -0.597 25768 1712 1 2 . 1 1 182 182 ALA C C 182 177.560 177.560 176.423 1.137 25768 1713 1 2 . 1 1 182 182 ALA CA C 182 53.090 53.090 52.069 1.021 25768 1714 1 2 . 1 1 182 182 ALA CB C 182 19.310 19.310 19.704 -0.394 25768 1715 1 2 . 1 1 182 182 ALA H H 182 8.130 8.130 8.321 -0.191 25768 1716 1 2 . 1 1 183 183 LEU N N 183 119.980 119.980 124.983 -5.003 25768 1717 1 2 . 1 1 183 183 LEU C C 183 177.850 177.850 178.774 -0.924 25768 1718 1 2 . 1 1 183 183 LEU CA C 183 55.650 55.650 54.707 0.943 25768 1719 1 2 . 1 1 183 183 LEU CB C 183 42.530 42.530 42.312 0.217 25768 1720 1 2 . 1 1 183 183 LEU H H 183 7.940 7.940 8.580 -0.640 25768 1721 1 2 . 1 1 184 184 GLY N N 184 109.250 109.250 107.979 1.271 25768 1722 1 2 . 1 1 184 184 GLY C C 184 174.250 174.250 174.402 -0.152 25768 1723 1 2 . 1 1 184 184 GLY CA C 184 45.830 45.830 44.962 0.868 25768 1724 1 2 . 1 1 184 184 GLY H H 184 8.150 8.150 8.321 -0.171 25768 1725 1 2 . 1 1 185 185 VAL N N 185 118.830 118.830 122.988 -4.158 25768 1726 1 2 . 1 1 185 185 VAL C C 185 175.890 175.890 175.943 -0.053 25768 1727 1 2 . 1 1 185 185 VAL CA C 185 62.740 62.740 61.604 1.136 25768 1728 1 2 . 1 1 185 185 VAL CB C 185 32.770 32.770 32.400 0.370 25768 1729 1 2 . 1 1 185 185 VAL H H 185 7.760 7.760 7.930 -0.170 25768 1730 1 2 . 1 1 186 186 ASN N N 186 121.850 121.850 123.802 -1.952 25768 1731 1 2 . 1 1 186 186 ASN C C 186 174.970 174.970 174.543 0.427 25768 1732 1 2 . 1 1 186 186 ASN CA C 186 53.590 53.590 53.352 0.238 25768 1733 1 2 . 1 1 186 186 ASN CB C 186 39.160 39.160 39.228 -0.069 25768 1734 1 2 . 1 1 186 186 ASN H H 186 8.380 8.380 8.560 -0.180 25768 1735 1 2 . 1 1 187 187 LYS N N 187 122.120 122.120 119.905 2.215 25768 1736 1 2 . 1 1 187 187 LYS C C 187 176.490 176.490 175.543 0.947 25768 1737 1 2 . 1 1 187 187 LYS CA C 187 56.750 56.750 55.217 1.533 25768 1738 1 2 . 1 1 187 187 LYS CB C 187 33.250 33.250 34.758 -1.508 25768 1739 1 2 . 1 1 187 187 LYS H H 187 8.140 8.140 7.551 0.589 25768 1740 1 2 . 1 1 188 188 THR N N 188 115.250 115.250 112.010 3.240 25768 1741 1 2 . 1 1 188 188 THR C C 188 174.250 174.250 173.812 0.438 25768 1742 1 2 . 1 1 188 188 THR CA C 188 62.360 62.360 62.036 0.324 25768 1743 1 2 . 1 1 188 188 THR CB C 188 70.280 70.280 69.334 0.946 25768 1744 1 2 . 1 1 188 188 THR H H 188 8.100 8.100 8.471 -0.371 25768 1745 1 2 . 1 1 189 189 LYS N N 189 123.780 123.780 122.355 1.425 25768 1746 1 2 . 1 1 189 189 LYS C C 189 176.090 176.090 175.483 0.607 25768 1747 1 2 . 1 1 189 189 LYS CA C 189 56.590 56.590 55.829 0.761 25768 1748 1 2 . 1 1 189 189 LYS CB C 189 33.350 33.350 35.354 -2.004 25768 1749 1 2 . 1 1 189 189 LYS H H 189 8.110 8.110 7.875 0.235 25768 1750 1 2 . 1 1 190 190 VAL N N 190 120.920 120.920 122.906 -1.986 25768 1751 1 2 . 1 1 190 190 VAL C C 190 175.590 175.590 175.917 -0.327 25768 1752 1 2 . 1 1 190 190 VAL CA C 190 62.400 62.400 62.548 -0.148 25768 1753 1 2 . 1 1 190 190 VAL CB C 190 32.990 32.990 30.254 2.736 25768 1754 1 2 . 1 1 190 190 VAL H H 190 8.040 8.040 8.696 -0.656 25768 1755 1 2 . 1 1 191 191 ASP N N 191 123.790 123.790 126.751 -2.961 25768 1756 1 2 . 1 1 191 191 ASP C C 191 175.750 175.750 176.833 -1.083 25768 1757 1 2 . 1 1 191 191 ASP CA C 191 54.650 54.650 56.050 -1.399 25768 1758 1 2 . 1 1 191 191 ASP CB C 191 41.450 41.450 42.215 -0.765 25768 1759 1 2 . 1 1 191 191 ASP H H 191 8.240 8.240 8.511 -0.271 25768 1760 1 2 . 1 1 192 192 VAL N N 192 118.850 118.850 115.156 3.694 25768 1761 1 2 . 1 1 192 192 VAL C C 192 175.380 175.380 174.889 0.491 25768 1762 1 2 . 1 1 192 192 VAL CA C 192 62.110 62.110 61.629 0.481 25768 1763 1 2 . 1 1 192 192 VAL CB C 192 33.290 33.290 32.670 0.620 25768 1764 1 2 . 1 1 192 192 VAL H H 192 7.860 7.860 7.698 0.162 25768 1765 1 2 . 1 1 193 193 ASP N N 193 124.190 124.190 120.418 3.772 25768 1766 1 2 . 1 1 193 193 ASP C C 193 175.630 175.630 175.332 0.298 25768 1767 1 2 . 1 1 193 193 ASP CA C 193 54.540 54.540 54.581 -0.041 25768 1768 1 2 . 1 1 193 193 ASP CB C 193 41.410 41.410 41.623 -0.213 25768 1769 1 2 . 1 1 193 193 ASP H H 193 8.310 8.310 8.183 0.127 25768 1770 1 2 . 1 1 194 194 VAL N N 194 119.580 119.580 117.641 1.939 25768 1771 1 2 . 1 1 194 194 VAL C C 194 174.950 174.950 174.722 0.228 25768 1772 1 2 . 1 1 194 194 VAL CA C 194 61.770 61.770 63.695 -1.925 25768 1773 1 2 . 1 1 194 194 VAL CB C 194 33.680 33.680 33.111 0.569 25768 1774 1 2 . 1 1 194 194 VAL H H 194 7.890 7.890 7.479 0.411 25768 1775 1 2 . 1 1 195 195 ASP N N 195 125.660 125.660 123.383 2.277 25768 1776 1 2 . 1 1 195 195 ASP C C 195 174.290 174.290 174.939 -0.649 25768 1777 1 2 . 1 1 195 195 ASP CA C 195 51.940 51.940 52.335 -0.395 25768 1778 1 2 . 1 1 195 195 ASP CB C 195 40.950 40.950 41.417 -0.467 25768 1779 1 2 . 1 1 195 195 ASP H H 195 8.410 8.410 8.159 0.251 25768 1780 1 2 . 1 1 198 198 VAL C C 198 173.940 173.940 174.260 -0.320 25768 1781 1 2 . 1 1 198 198 VAL CA C 198 61.270 61.270 59.494 1.776 25768 1782 1 2 . 1 1 198 198 VAL CB C 198 35.910 35.910 34.127 1.783 25768 1783 1 2 . 1 1 199 199 TYR N N 199 123.780 123.780 125.032 -1.252 25768 1784 1 2 . 1 1 199 199 TYR C C 199 174.150 174.150 173.873 0.277 25768 1785 1 2 . 1 1 199 199 TYR CA C 199 56.220 56.220 57.132 -0.912 25768 1786 1 2 . 1 1 199 199 TYR CB C 199 41.660 41.660 42.694 -1.034 25768 1787 1 2 . 1 1 199 199 TYR H H 199 8.540 8.540 8.111 0.429 25768 1788 1 2 . 1 1 200 200 MET N N 200 123.920 123.920 126.288 -2.368 25768 1789 1 2 . 1 1 200 200 MET C C 200 173.810 173.810 174.255 -0.445 25768 1790 1 2 . 1 1 200 200 MET CA C 200 54.710 54.710 54.499 0.211 25768 1791 1 2 . 1 1 200 200 MET CB C 200 37.110 37.110 35.047 2.063 25768 1792 1 2 . 1 1 200 200 MET H H 200 9.130 9.130 8.312 0.818 25768 1793 1 2 . 1 1 201 201 ILE N N 201 123.670 123.670 120.296 3.374 25768 1794 1 2 . 1 1 201 201 ILE C C 201 174.030 174.030 174.284 -0.254 25768 1795 1 2 . 1 1 201 201 ILE CA C 201 59.820 59.820 59.088 0.732 25768 1796 1 2 . 1 1 201 201 ILE CB C 201 41.720 41.720 40.761 0.959 25768 1797 1 2 . 1 1 201 201 ILE H H 201 8.030 8.030 8.017 0.013 25768 1798 1 2 . 1 1 202 202 GLY N N 202 112.910 112.910 112.636 0.274 25768 1799 1 2 . 1 1 202 202 GLY C C 202 170.280 170.280 172.069 -1.789 25768 1800 1 2 . 1 1 202 202 GLY CA C 202 46.800 46.800 45.251 1.549 25768 1801 1 2 . 1 1 202 202 GLY H H 202 8.580 8.580 7.653 0.927 25768 1802 1 2 . 1 1 203 203 PHE N N 203 116.240 116.240 115.785 0.455 25768 1803 1 2 . 1 1 203 203 PHE C C 203 173.940 173.940 173.953 -0.013 25768 1804 1 2 . 1 1 203 203 PHE CA C 203 55.890 55.890 54.632 1.258 25768 1805 1 2 . 1 1 203 203 PHE CB C 203 45.060 45.060 41.947 3.113 25768 1806 1 2 . 1 1 203 203 PHE H H 203 8.620 8.620 8.485 0.135 25768 1807 1 2 . 1 1 204 204 GLY N N 204 105.610 105.610 105.309 0.301 25768 1808 1 2 . 1 1 204 204 GLY C C 204 171.190 171.190 171.812 -0.622 25768 1809 1 2 . 1 1 204 204 GLY CA C 204 46.720 46.720 44.624 2.096 25768 1810 1 2 . 1 1 204 204 GLY H H 204 8.960 8.960 8.321 0.639 25768 1811 1 2 . 1 1 205 205 TYR N N 205 121.160 121.160 118.516 2.644 25768 1812 1 2 . 1 1 205 205 TYR C C 205 173.030 173.030 173.590 -0.560 25768 1813 1 2 . 1 1 205 205 TYR CA C 205 57.190 57.190 57.421 -0.231 25768 1814 1 2 . 1 1 205 205 TYR CB C 205 44.400 44.400 43.437 0.963 25768 1815 1 2 . 1 1 205 205 TYR H H 205 9.380 9.380 8.862 0.518 25768 1816 1 2 . 1 1 206 206 LYS N N 206 126.970 126.970 126.088 0.882 25768 1817 1 2 . 1 1 206 206 LYS C C 206 174.210 174.210 175.428 -1.218 25768 1818 1 2 . 1 1 206 206 LYS CA C 206 54.770 54.770 56.023 -1.253 25768 1819 1 2 . 1 1 206 206 LYS CB C 206 34.440 34.440 33.012 1.428 25768 1820 1 2 . 1 1 206 206 LYS H H 206 8.380 8.380 8.258 0.122 25768 1821 1 2 . 1 1 207 207 PHE N N 207 126.330 126.330 126.608 -0.278 25768 1822 1 2 . 1 1 207 207 PHE C C 207 175.020 175.020 173.618 1.402 25768 1823 1 2 . 1 1 207 207 PHE CA C 207 58.170 58.170 57.319 0.851 25768 1824 1 2 . 1 1 207 207 PHE CB C 207 40.920 40.920 41.862 -0.942 25768 1825 1 2 . 1 1 207 207 PHE H H 207 9.290 9.290 8.367 0.923 25768 1826 1 2 . 1 1 208 208 LEU N N 208 122.740 122.740 123.872 -1.132 25768 1827 1 2 . 1 1 208 208 LEU C C 208 176.510 176.510 176.073 0.437 25768 1828 1 2 . 1 1 208 208 LEU CA C 208 54.910 54.910 53.468 1.442 25768 1829 1 2 . 1 1 208 208 LEU CB C 208 43.830 43.830 45.379 -1.549 25768 1830 1 2 . 1 1 208 208 LEU H H 208 8.310 8.310 7.608 0.702 25768 1831 1 3 . 1 1 2 2 HIS C C 2 175.310 175.310 174.251 1.059 25768 1832 1 3 . 1 1 3 3 LYS N N 3 122.080 122.080 124.377 -2.297 25768 1833 1 3 . 1 1 3 3 LYS C C 3 173.490 173.490 174.851 -1.361 25768 1834 1 3 . 1 1 3 3 LYS CA C 3 55.050 55.050 54.181 0.869 25768 1835 1 3 . 1 1 3 3 LYS CB C 3 35.380 35.380 35.372 0.008 25768 1836 1 3 . 1 1 3 3 LYS H H 3 8.620 8.620 7.903 0.717 25768 1837 1 3 . 1 1 4 4 ALA N N 4 120.860 120.860 123.570 -2.710 25768 1838 1 3 . 1 1 4 4 ALA C C 4 178.190 178.190 177.855 0.335 25768 1839 1 3 . 1 1 4 4 ALA CA C 4 53.480 53.480 52.362 1.118 25768 1840 1 3 . 1 1 4 4 ALA CB C 4 18.140 18.140 18.420 -0.280 25768 1841 1 3 . 1 1 4 4 ALA H H 4 8.580 8.580 8.251 0.329 25768 1842 1 3 . 1 1 5 5 GLY N N 5 112.890 112.890 112.393 0.497 25768 1843 1 3 . 1 1 5 5 GLY C C 5 173.830 173.830 173.685 0.145 25768 1844 1 3 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.346 0.534 25768 1845 1 3 . 1 1 5 5 GLY H H 5 9.210 9.210 8.087 1.123 25768 1846 1 3 . 1 1 6 6 ASP N N 6 121.590 121.590 121.116 0.474 25768 1847 1 3 . 1 1 6 6 ASP C C 6 174.380 174.380 175.049 -0.669 25768 1848 1 3 . 1 1 6 6 ASP CA C 6 55.790 55.790 54.846 0.944 25768 1849 1 3 . 1 1 6 6 ASP CB C 6 41.760 41.760 42.103 -0.343 25768 1850 1 3 . 1 1 6 6 ASP H H 6 7.620 7.620 7.484 0.136 25768 1851 1 3 . 1 1 7 7 PHE N N 7 120.860 120.860 124.020 -3.160 25768 1852 1 3 . 1 1 7 7 PHE C C 7 174.050 174.050 174.418 -0.368 25768 1853 1 3 . 1 1 7 7 PHE CA C 7 56.110 56.110 58.279 -2.168 25768 1854 1 3 . 1 1 7 7 PHE CB C 7 42.550 42.550 41.136 1.414 25768 1855 1 3 . 1 1 7 7 PHE H H 7 8.250 8.250 8.908 -0.658 25768 1856 1 3 . 1 1 8 8 ILE N N 8 127.950 127.950 126.133 1.817 25768 1857 1 3 . 1 1 8 8 ILE C C 8 174.000 174.000 174.368 -0.368 25768 1858 1 3 . 1 1 8 8 ILE CA C 8 61.160 61.160 58.939 2.221 25768 1859 1 3 . 1 1 8 8 ILE CB C 8 42.660 42.660 41.969 0.691 25768 1860 1 3 . 1 1 8 8 ILE H H 8 9.230 9.230 8.703 0.527 25768 1861 1 3 . 1 1 9 9 ILE N N 9 125.380 125.380 119.830 5.550 25768 1862 1 3 . 1 1 9 9 ILE C C 9 173.630 173.630 174.494 -0.864 25768 1863 1 3 . 1 1 9 9 ILE CA C 9 59.600 59.600 59.602 -0.002 25768 1864 1 3 . 1 1 9 9 ILE CB C 9 41.180 41.180 41.471 -0.291 25768 1865 1 3 . 1 1 9 9 ILE H H 9 8.580 8.580 8.749 -0.169 25768 1866 1 3 . 1 1 10 10 ARG N N 10 124.950 124.950 122.289 2.661 25768 1867 1 3 . 1 1 10 10 ARG C C 10 175.030 175.030 174.886 0.144 25768 1868 1 3 . 1 1 10 10 ARG CA C 10 53.920 53.920 54.785 -0.865 25768 1869 1 3 . 1 1 10 10 ARG CB C 10 31.880 31.880 35.182 -3.302 25768 1870 1 3 . 1 1 10 10 ARG H H 10 9.230 9.230 8.195 1.035 25768 1871 1 3 . 1 1 11 11 GLY N N 11 105.650 105.650 109.280 -3.630 25768 1872 1 3 . 1 1 11 11 GLY C C 11 172.090 172.090 172.231 -0.141 25768 1873 1 3 . 1 1 11 11 GLY CA C 11 44.460 44.460 43.338 1.122 25768 1874 1 3 . 1 1 11 11 GLY H H 11 8.780 8.780 8.379 0.401 25768 1875 1 3 . 1 1 12 12 GLY N N 12 107.800 107.800 107.450 0.350 25768 1876 1 3 . 1 1 12 12 GLY C C 12 171.460 171.460 171.592 -0.132 25768 1877 1 3 . 1 1 12 12 GLY CA C 12 46.630 46.630 43.678 2.953 25768 1878 1 3 . 1 1 12 12 GLY H H 12 8.510 8.510 8.665 -0.155 25768 1879 1 3 . 1 1 13 13 PHE N N 13 119.900 119.900 119.617 0.283 25768 1880 1 3 . 1 1 13 13 PHE C C 13 174.190 174.190 173.514 0.676 25768 1881 1 3 . 1 1 13 13 PHE CA C 13 56.340 56.340 56.872 -0.532 25768 1882 1 3 . 1 1 13 13 PHE CB C 13 41.090 41.090 43.680 -2.590 25768 1883 1 3 . 1 1 13 13 PHE H H 13 8.610 8.610 7.825 0.785 25768 1884 1 3 . 1 1 14 14 ALA N N 14 128.030 128.030 126.885 1.145 25768 1885 1 3 . 1 1 14 14 ALA C C 14 176.560 176.560 176.955 -0.395 25768 1886 1 3 . 1 1 14 14 ALA CA C 14 49.940 49.940 50.915 -0.975 25768 1887 1 3 . 1 1 14 14 ALA CB C 14 20.360 20.360 20.119 0.241 25768 1888 1 3 . 1 1 14 14 ALA H H 14 9.220 9.220 8.417 0.803 25768 1889 1 3 . 1 1 15 15 THR N N 15 118.620 118.620 119.209 -0.589 25768 1890 1 3 . 1 1 15 15 THR CA C 15 61.440 61.440 63.052 -1.612 25768 1891 1 3 . 1 1 15 15 THR CB C 15 71.370 71.370 69.675 1.695 25768 1892 1 3 . 1 1 15 15 THR H H 15 9.220 9.220 8.123 1.097 25768 1893 1 3 . 1 1 18 18 PRO C C 18 176.690 176.690 176.228 0.462 25768 1894 1 3 . 1 1 18 18 PRO CA C 18 63.610 63.610 62.684 0.926 25768 1895 1 3 . 1 1 18 18 PRO CB C 18 32.440 32.440 32.552 -0.112 25768 1896 1 3 . 1 1 19 19 ASP N N 19 120.320 120.320 122.091 -1.771 25768 1897 1 3 . 1 1 19 19 ASP C C 19 175.950 175.950 176.838 -0.888 25768 1898 1 3 . 1 1 19 19 ASP CA C 19 54.710 54.710 55.732 -1.022 25768 1899 1 3 . 1 1 19 19 ASP CB C 19 41.450 41.450 41.001 0.449 25768 1900 1 3 . 1 1 19 19 ASP H H 19 8.330 8.330 8.550 -0.220 25768 1901 1 3 . 1 1 20 20 ASP N N 20 121.990 121.990 118.683 3.307 25768 1902 1 3 . 1 1 20 20 ASP C C 20 176.760 176.760 176.169 0.591 25768 1903 1 3 . 1 1 20 20 ASP CA C 20 54.470 54.470 54.783 -0.313 25768 1904 1 3 . 1 1 20 20 ASP CB C 20 41.310 41.310 41.150 0.160 25768 1905 1 3 . 1 1 20 20 ASP H H 20 8.240 8.240 8.023 0.217 25768 1906 1 3 . 1 1 21 21 SER N N 21 117.050 117.050 114.138 2.912 25768 1907 1 3 . 1 1 21 21 SER C C 21 175.170 175.170 173.982 1.188 25768 1908 1 3 . 1 1 21 21 SER CA C 21 59.490 59.490 59.178 0.312 25768 1909 1 3 . 1 1 21 21 SER CB C 21 64.080 64.080 64.003 0.077 25768 1910 1 3 . 1 1 21 21 SER H H 21 8.360 8.360 7.980 0.380 25768 1911 1 3 . 1 1 22 22 SER N N 22 117.820 117.820 119.062 -1.242 25768 1912 1 3 . 1 1 22 22 SER C C 22 174.940 174.940 174.728 0.212 25768 1913 1 3 . 1 1 22 22 SER CA C 22 59.160 59.160 58.303 0.857 25768 1914 1 3 . 1 1 22 22 SER CB C 22 64.110 64.110 64.515 -0.405 25768 1915 1 3 . 1 1 22 22 SER H H 22 8.310 8.310 8.665 -0.355 25768 1916 1 3 . 1 1 23 23 SER N N 23 117.660 117.660 119.155 -1.495 25768 1917 1 3 . 1 1 23 23 SER C C 23 174.340 174.340 173.750 0.590 25768 1918 1 3 . 1 1 23 23 SER CA C 23 59.050 59.050 57.904 1.146 25768 1919 1 3 . 1 1 23 23 SER CB C 23 64.210 64.210 64.475 -0.265 25768 1920 1 3 . 1 1 23 23 SER H H 23 8.120 8.120 8.029 0.091 25768 1921 1 3 . 1 1 24 24 ASP N N 24 122.590 122.590 122.328 0.262 25768 1922 1 3 . 1 1 24 24 ASP C C 24 176.250 176.250 176.114 0.136 25768 1923 1 3 . 1 1 24 24 ASP CA C 24 54.910 54.910 54.833 0.077 25768 1924 1 3 . 1 1 24 24 ASP CB C 24 41.270 41.270 41.772 -0.502 25768 1925 1 3 . 1 1 24 24 ASP H H 24 8.230 8.230 8.479 -0.249 25768 1926 1 3 . 1 1 25 25 ILE N N 25 120.650 120.650 114.449 6.201 25768 1927 1 3 . 1 1 25 25 ILE C C 25 176.190 176.190 175.768 0.422 25768 1928 1 3 . 1 1 25 25 ILE CA C 25 61.880 61.880 61.297 0.583 25768 1929 1 3 . 1 1 25 25 ILE CB C 25 38.730 38.730 38.540 0.190 25768 1930 1 3 . 1 1 25 25 ILE H H 25 7.860 7.860 8.135 -0.275 25768 1931 1 3 . 1 1 26 26 LYS N N 26 124.420 124.420 121.663 2.757 25768 1932 1 3 . 1 1 26 26 LYS C C 26 176.640 176.640 176.245 0.395 25768 1933 1 3 . 1 1 26 26 LYS CA C 26 56.520 56.520 56.166 0.354 25768 1934 1 3 . 1 1 26 26 LYS CB C 26 32.890 32.890 32.645 0.245 25768 1935 1 3 . 1 1 26 26 LYS H H 26 8.140 8.140 8.329 -0.189 25768 1936 1 3 . 1 1 27 27 LEU N N 27 123.120 123.120 124.865 -1.745 25768 1937 1 3 . 1 1 27 27 LEU C C 27 177.110 177.110 177.746 -0.636 25768 1938 1 3 . 1 1 27 27 LEU CA C 27 55.590 55.590 56.071 -0.481 25768 1939 1 3 . 1 1 27 27 LEU CB C 27 42.500 42.500 41.941 0.559 25768 1940 1 3 . 1 1 27 27 LEU H H 27 8.080 8.080 8.490 -0.410 25768 1941 1 3 . 1 1 28 28 ASP N N 28 120.850 120.850 120.224 0.626 25768 1942 1 3 . 1 1 28 28 ASP C C 28 176.960 176.960 176.234 0.726 25768 1943 1 3 . 1 1 28 28 ASP CA C 28 54.800 54.800 54.534 0.266 25768 1944 1 3 . 1 1 28 28 ASP CB C 28 41.380 41.380 41.109 0.271 25768 1945 1 3 . 1 1 28 28 ASP H H 28 8.180 8.180 8.031 0.149 25768 1946 1 3 . 1 1 29 29 GLY N N 29 109.800 109.800 110.481 -0.681 25768 1947 1 3 . 1 1 29 29 GLY C C 29 174.370 174.370 172.820 1.550 25768 1948 1 3 . 1 1 29 29 GLY CA C 29 46.150 46.150 44.670 1.480 25768 1949 1 3 . 1 1 29 29 GLY H H 29 8.230 8.230 8.211 0.019 25768 1950 1 3 . 1 1 30 30 ALA N N 30 123.880 123.880 126.133 -2.253 25768 1951 1 3 . 1 1 30 30 ALA C C 30 178.040 178.040 176.826 1.214 25768 1952 1 3 . 1 1 30 30 ALA CA C 30 53.140 53.140 52.164 0.976 25768 1953 1 3 . 1 1 30 30 ALA CB C 30 19.350 19.350 20.555 -1.206 25768 1954 1 3 . 1 1 30 30 ALA H H 30 8.040 8.040 8.258 -0.218 25768 1955 1 3 . 1 1 31 31 LYS N N 31 119.800 119.800 125.309 -5.509 25768 1956 1 3 . 1 1 31 31 LYS C C 31 176.770 176.770 175.768 1.002 25768 1957 1 3 . 1 1 31 31 LYS CA C 31 56.870 56.870 55.997 0.873 25768 1958 1 3 . 1 1 31 31 LYS CB C 31 32.980 32.980 32.486 0.494 25768 1959 1 3 . 1 1 31 31 LYS H H 31 8.060 8.060 8.570 -0.510 25768 1960 1 3 . 1 1 32 32 GLN N N 32 120.930 120.930 122.797 -1.867 25768 1961 1 3 . 1 1 32 32 GLN C C 32 176.000 176.000 176.303 -0.303 25768 1962 1 3 . 1 1 32 32 GLN CA C 32 56.280 56.280 55.563 0.717 25768 1963 1 3 . 1 1 32 32 GLN CB C 32 29.580 29.580 30.282 -0.702 25768 1964 1 3 . 1 1 32 32 GLN H H 32 8.170 8.170 8.711 -0.541 25768 1965 1 3 . 1 1 33 33 ARG N N 33 122.370 122.370 124.835 -2.465 25768 1966 1 3 . 1 1 33 33 ARG C C 33 176.820 176.820 177.086 -0.266 25768 1967 1 3 . 1 1 33 33 ARG CA C 33 56.680 56.680 57.353 -0.673 25768 1968 1 3 . 1 1 33 33 ARG CB C 33 31.040 31.040 30.868 0.172 25768 1969 1 3 . 1 1 33 33 ARG H H 33 8.270 8.270 9.093 -0.823 25768 1970 1 3 . 1 1 34 34 GLY N N 34 110.210 110.210 105.326 4.884 25768 1971 1 3 . 1 1 34 34 GLY C C 34 174.280 174.280 174.501 -0.221 25768 1972 1 3 . 1 1 34 34 GLY CA C 34 45.770 45.770 45.322 0.448 25768 1973 1 3 . 1 1 34 34 GLY H H 34 8.360 8.360 8.274 0.086 25768 1974 1 3 . 1 1 35 35 THR N N 35 114.100 114.100 113.336 0.764 25768 1975 1 3 . 1 1 35 35 THR C C 35 174.550 174.550 174.868 -0.318 25768 1976 1 3 . 1 1 35 35 THR CA C 35 62.140 62.140 62.912 -0.772 25768 1977 1 3 . 1 1 35 35 THR CB C 35 70.330 70.330 70.579 -0.249 25768 1978 1 3 . 1 1 35 35 THR H H 35 7.970 7.970 8.015 -0.045 25768 1979 1 3 . 1 1 36 36 LYS N N 36 123.850 123.850 122.320 1.530 25768 1980 1 3 . 1 1 36 36 LYS C C 36 176.040 176.040 175.215 0.825 25768 1981 1 3 . 1 1 36 36 LYS CA C 36 56.600 56.600 55.454 1.146 25768 1982 1 3 . 1 1 36 36 LYS CB C 36 33.280 33.280 34.316 -1.036 25768 1983 1 3 . 1 1 36 36 LYS H H 36 8.230 8.230 7.691 0.539 25768 1984 1 3 . 1 1 37 37 ALA N N 37 125.650 125.650 122.427 3.223 25768 1985 1 3 . 1 1 37 37 ALA C C 37 177.570 177.570 176.474 1.096 25768 1986 1 3 . 1 1 37 37 ALA CA C 37 52.860 52.860 52.139 0.721 25768 1987 1 3 . 1 1 37 37 ALA CB C 37 19.610 19.610 19.450 0.160 25768 1988 1 3 . 1 1 37 37 ALA H H 37 8.290 8.290 8.375 -0.085 25768 1989 1 3 . 1 1 38 38 THR N N 38 113.350 113.350 115.209 -1.859 25768 1990 1 3 . 1 1 38 38 THR C C 38 174.540 174.540 175.378 -0.838 25768 1991 1 3 . 1 1 38 38 THR CA C 38 62.010 62.010 62.050 -0.040 25768 1992 1 3 . 1 1 38 38 THR CB C 38 70.350 70.350 69.140 1.210 25768 1993 1 3 . 1 1 38 38 THR H H 38 7.970 7.970 7.750 0.220 25768 1994 1 3 . 1 1 39 39 VAL N N 39 120.790 120.790 122.622 -1.832 25768 1995 1 3 . 1 1 39 39 VAL C C 39 175.620 175.620 175.372 0.248 25768 1996 1 3 . 1 1 39 39 VAL CA C 39 62.470 62.470 62.426 0.044 25768 1997 1 3 . 1 1 39 39 VAL CB C 39 32.940 32.940 32.309 0.631 25768 1998 1 3 . 1 1 39 39 VAL H H 39 8.020 8.020 8.640 -0.620 25768 1999 1 3 . 1 1 40 40 ASP N N 40 123.690 123.690 119.907 3.783 25768 2000 1 3 . 1 1 40 40 ASP C C 40 176.190 176.190 176.010 0.180 25768 2001 1 3 . 1 1 40 40 ASP CA C 40 54.780 54.780 54.858 -0.078 25768 2002 1 3 . 1 1 40 40 ASP CB C 40 41.590 41.590 41.389 0.201 25768 2003 1 3 . 1 1 40 40 ASP H H 40 8.310 8.310 8.001 0.309 25768 2004 1 3 . 1 1 41 41 SER N N 41 115.470 115.470 117.080 -1.610 25768 2005 1 3 . 1 1 41 41 SER C C 41 174.170 174.170 173.896 0.274 25768 2006 1 3 . 1 1 41 41 SER CA C 41 59.000 59.000 58.648 0.352 25768 2007 1 3 . 1 1 41 41 SER CB C 41 64.420 64.420 64.009 0.411 25768 2008 1 3 . 1 1 41 41 SER H H 41 8.130 8.130 8.441 -0.311 25768 2009 1 3 . 1 1 42 42 ASP N N 42 122.430 122.430 121.168 1.262 25768 2010 1 3 . 1 1 42 42 ASP C C 42 175.740 175.740 174.567 1.173 25768 2011 1 3 . 1 1 42 42 ASP CA C 42 54.780 54.780 55.003 -0.223 25768 2012 1 3 . 1 1 42 42 ASP CB C 42 41.620 41.620 40.479 1.141 25768 2013 1 3 . 1 1 42 42 ASP H H 42 8.410 8.410 8.475 -0.065 25768 2014 1 3 . 1 1 43 43 THR N N 43 117.580 117.580 116.163 1.417 25768 2015 1 3 . 1 1 43 43 THR C C 43 173.630 173.630 172.841 0.789 25768 2016 1 3 . 1 1 43 43 THR CA C 43 63.120 63.120 61.694 1.427 25768 2017 1 3 . 1 1 43 43 THR CB C 43 70.650 70.650 69.537 1.113 25768 2018 1 3 . 1 1 43 43 THR H H 43 8.010 8.010 8.146 -0.136 25768 2019 1 3 . 1 1 44 44 GLN N N 44 125.420 125.420 124.660 0.760 25768 2020 1 3 . 1 1 44 44 GLN C C 44 174.080 174.080 174.844 -0.764 25768 2021 1 3 . 1 1 44 44 GLN CA C 44 55.110 55.110 55.136 -0.026 25768 2022 1 3 . 1 1 44 44 GLN CB C 44 31.570 31.570 31.948 -0.378 25768 2023 1 3 . 1 1 44 44 GLN H H 44 9.260 9.260 8.340 0.920 25768 2024 1 3 . 1 1 45 45 LEU N N 45 124.190 124.190 122.261 1.929 25768 2025 1 3 . 1 1 45 45 LEU C C 45 175.970 175.970 177.202 -1.232 25768 2026 1 3 . 1 1 45 45 LEU CA C 45 54.690 54.690 55.992 -1.302 25768 2027 1 3 . 1 1 45 45 LEU CB C 45 42.270 42.270 42.836 -0.566 25768 2028 1 3 . 1 1 45 45 LEU H H 45 8.550 8.550 8.153 0.397 25768 2029 1 3 . 1 1 46 46 GLY N N 46 113.310 113.310 110.352 2.958 25768 2030 1 3 . 1 1 46 46 GLY C C 46 171.180 171.180 172.564 -1.384 25768 2031 1 3 . 1 1 46 46 GLY CA C 46 44.400 44.400 44.263 0.137 25768 2032 1 3 . 1 1 46 46 GLY H H 46 8.810 8.810 8.451 0.359 25768 2033 1 3 . 1 1 47 47 LEU N N 47 123.890 123.890 129.332 -5.442 25768 2034 1 3 . 1 1 47 47 LEU C C 47 175.400 175.400 174.928 0.472 25768 2035 1 3 . 1 1 47 47 LEU CA C 47 53.750 53.750 54.098 -0.348 25768 2036 1 3 . 1 1 47 47 LEU CB C 47 46.800 46.800 45.465 1.335 25768 2037 1 3 . 1 1 47 47 LEU H H 47 8.590 8.590 9.004 -0.414 25768 2038 1 3 . 1 1 48 48 THR N N 48 111.210 111.210 115.655 -4.445 25768 2039 1 3 . 1 1 48 48 THR C C 48 172.520 172.520 173.036 -0.516 25768 2040 1 3 . 1 1 48 48 THR CA C 48 58.950 58.950 60.067 -1.117 25768 2041 1 3 . 1 1 48 48 THR CB C 48 72.360 72.360 71.797 0.563 25768 2042 1 3 . 1 1 48 48 THR H H 48 8.620 8.620 8.461 0.159 25768 2043 1 3 . 1 1 49 49 PHE N N 49 118.810 118.810 121.940 -3.130 25768 2044 1 3 . 1 1 49 49 PHE C C 49 174.700 174.700 175.249 -0.549 25768 2045 1 3 . 1 1 49 49 PHE CA C 49 55.080 55.080 56.484 -1.404 25768 2046 1 3 . 1 1 49 49 PHE CB C 49 42.360 42.360 40.107 2.253 25768 2047 1 3 . 1 1 49 49 PHE H H 49 8.410 8.410 8.383 0.027 25768 2048 1 3 . 1 1 50 50 THR N N 50 121.230 121.230 121.216 0.014 25768 2049 1 3 . 1 1 50 50 THR C C 50 173.250 173.250 173.206 0.044 25768 2050 1 3 . 1 1 50 50 THR CA C 50 62.740 62.740 61.588 1.152 25768 2051 1 3 . 1 1 50 50 THR CB C 50 73.740 73.740 69.509 4.231 25768 2052 1 3 . 1 1 50 50 THR H H 50 9.330 9.330 8.600 0.730 25768 2053 1 3 . 1 1 51 51 TYR N N 51 126.010 126.010 126.161 -0.151 25768 2054 1 3 . 1 1 51 51 TYR C C 51 174.850 174.850 175.853 -1.003 25768 2055 1 3 . 1 1 51 51 TYR CA C 51 56.240 56.240 55.920 0.320 25768 2056 1 3 . 1 1 51 51 TYR CB C 51 41.630 41.630 38.584 3.046 25768 2057 1 3 . 1 1 51 51 TYR H H 51 9.150 9.150 9.260 -0.110 25768 2058 1 3 . 1 1 52 52 MET N N 52 127.390 127.390 122.600 4.790 25768 2059 1 3 . 1 1 52 52 MET C C 52 174.490 174.490 175.036 -0.546 25768 2060 1 3 . 1 1 52 52 MET CA C 52 52.450 52.450 57.144 -4.694 25768 2061 1 3 . 1 1 52 52 MET CB C 52 28.590 28.590 33.413 -4.823 25768 2062 1 3 . 1 1 52 52 MET H H 52 7.950 7.950 8.269 -0.319 25768 2063 1 3 . 1 1 53 53 PHE N N 53 123.830 123.830 124.384 -0.554 25768 2064 1 3 . 1 1 53 53 PHE C C 53 173.720 173.720 174.019 -0.299 25768 2065 1 3 . 1 1 53 53 PHE CA C 53 57.110 57.110 57.231 -0.121 25768 2066 1 3 . 1 1 53 53 PHE CB C 53 39.420 39.420 41.019 -1.599 25768 2067 1 3 . 1 1 53 53 PHE H H 53 7.720 7.720 8.290 -0.570 25768 2068 1 3 . 1 1 54 54 ALA N N 54 125.650 125.650 127.588 -1.938 25768 2069 1 3 . 1 1 54 54 ALA C C 54 175.020 175.020 175.935 -0.915 25768 2070 1 3 . 1 1 54 54 ALA CA C 54 50.740 50.740 52.879 -2.139 25768 2071 1 3 . 1 1 54 54 ALA CB C 54 22.700 22.700 19.141 3.559 25768 2072 1 3 . 1 1 54 54 ALA H H 54 8.360 8.360 8.578 -0.218 25768 2073 1 3 . 1 1 55 55 ASP N N 55 118.790 118.790 118.740 0.050 25768 2074 1 3 . 1 1 55 55 ASP C C 55 174.780 174.780 175.482 -0.702 25768 2075 1 3 . 1 1 55 55 ASP CA C 55 58.590 58.590 54.142 4.448 25768 2076 1 3 . 1 1 55 55 ASP CB C 55 40.430 40.430 39.357 1.073 25768 2077 1 3 . 1 1 55 55 ASP H H 55 8.590 8.590 8.690 -0.100 25768 2078 1 3 . 1 1 56 56 LYS N N 56 106.200 106.200 114.313 -8.113 25768 2079 1 3 . 1 1 56 56 LYS C C 56 174.940 174.940 175.089 -0.149 25768 2080 1 3 . 1 1 56 56 LYS CA C 56 55.260 55.260 56.640 -1.380 25768 2081 1 3 . 1 1 56 56 LYS CB C 56 34.510 34.510 33.211 1.299 25768 2082 1 3 . 1 1 56 56 LYS H H 56 7.260 7.260 7.148 0.112 25768 2083 1 3 . 1 1 57 57 TRP N N 57 115.680 115.680 122.950 -7.270 25768 2084 1 3 . 1 1 57 57 TRP C C 57 173.940 173.940 175.861 -1.921 25768 2085 1 3 . 1 1 57 57 TRP CA C 57 55.410 55.410 58.704 -3.294 25768 2086 1 3 . 1 1 57 57 TRP CB C 57 34.470 34.470 32.543 1.927 25768 2087 1 3 . 1 1 57 57 TRP H H 57 6.570 6.570 7.953 -1.383 25768 2088 1 3 . 1 1 58 58 GLY N N 58 107.610 107.610 107.010 0.600 25768 2089 1 3 . 1 1 58 58 GLY C C 58 172.730 172.730 171.980 0.750 25768 2090 1 3 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.771 -0.721 25768 2091 1 3 . 1 1 58 58 GLY H H 58 9.260 9.260 8.514 0.746 25768 2092 1 3 . 1 1 59 59 VAL N N 59 118.130 118.130 114.830 3.300 25768 2093 1 3 . 1 1 59 59 VAL C C 59 173.000 173.000 173.230 -0.230 25768 2094 1 3 . 1 1 59 59 VAL CA C 59 59.950 59.950 60.104 -0.154 25768 2095 1 3 . 1 1 59 59 VAL CB C 59 35.170 35.170 34.922 0.248 25768 2096 1 3 . 1 1 59 59 VAL H H 59 9.030 9.030 8.219 0.811 25768 2097 1 3 . 1 1 60 60 GLU N N 60 127.900 127.900 123.802 4.098 25768 2098 1 3 . 1 1 60 60 GLU C C 60 174.470 174.470 174.691 -0.221 25768 2099 1 3 . 1 1 60 60 GLU CA C 60 52.940 52.940 54.009 -1.069 25768 2100 1 3 . 1 1 60 60 GLU CB C 60 35.100 35.100 34.565 0.535 25768 2101 1 3 . 1 1 60 60 GLU H H 60 9.440 9.440 8.188 1.252 25768 2102 1 3 . 1 1 61 61 LEU N N 61 127.410 127.410 121.736 5.674 25768 2103 1 3 . 1 1 61 61 LEU C C 61 174.950 174.950 175.416 -0.466 25768 2104 1 3 . 1 1 61 61 LEU CA C 61 53.390 53.390 53.651 -0.261 25768 2105 1 3 . 1 1 61 61 LEU CB C 61 45.980 45.980 45.440 0.540 25768 2106 1 3 . 1 1 61 61 LEU H H 61 8.740 8.740 8.135 0.605 25768 2107 1 3 . 1 1 62 62 VAL N N 62 125.750 125.750 117.016 8.734 25768 2108 1 3 . 1 1 62 62 VAL C C 62 173.960 173.960 174.264 -0.304 25768 2109 1 3 . 1 1 62 62 VAL CA C 62 61.350 61.350 59.832 1.518 25768 2110 1 3 . 1 1 62 62 VAL CB C 62 34.740 34.740 33.821 0.919 25768 2111 1 3 . 1 1 62 62 VAL H H 62 8.790 8.790 7.881 0.909 25768 2112 1 3 . 1 1 63 63 ALA N N 63 127.230 127.230 126.053 1.177 25768 2113 1 3 . 1 1 63 63 ALA C C 63 173.930 173.930 174.660 -0.730 25768 2114 1 3 . 1 1 63 63 ALA CA C 63 51.140 51.140 51.888 -0.748 25768 2115 1 3 . 1 1 63 63 ALA CB C 63 22.500 22.500 21.758 0.742 25768 2116 1 3 . 1 1 63 63 ALA H H 63 8.740 8.740 8.076 0.664 25768 2117 1 3 . 1 1 64 64 ALA N N 64 120.410 120.410 126.288 -5.878 25768 2118 1 3 . 1 1 64 64 ALA C C 64 176.770 176.770 177.470 -0.700 25768 2119 1 3 . 1 1 64 64 ALA CA C 64 51.420 51.420 50.297 1.123 25768 2120 1 3 . 1 1 64 64 ALA CB C 64 22.590 22.590 20.956 1.633 25768 2121 1 3 . 1 1 64 64 ALA H H 64 8.290 8.290 8.559 -0.269 25768 2122 1 3 . 1 1 65 65 THR N N 65 116.130 116.130 115.038 1.092 25768 2123 1 3 . 1 1 65 65 THR C C 65 171.220 171.220 172.496 -1.276 25768 2124 1 3 . 1 1 65 65 THR CA C 65 58.860 58.860 59.070 -0.210 25768 2125 1 3 . 1 1 65 65 THR CB C 65 72.020 72.020 69.181 2.839 25768 2126 1 3 . 1 1 65 65 THR H H 65 8.760 8.760 8.362 0.398 25768 2127 1 3 . 1 1 66 66 PRO C C 66 176.720 176.720 176.279 0.441 25768 2128 1 3 . 1 1 66 66 PRO CA C 66 63.610 63.610 62.532 1.078 25768 2129 1 3 . 1 1 66 66 PRO CB C 66 32.550 32.550 32.382 0.168 25768 2130 1 3 . 1 1 67 67 PHE N N 67 120.360 120.360 121.954 -1.594 25768 2131 1 3 . 1 1 67 67 PHE C C 67 175.480 175.480 174.496 0.984 25768 2132 1 3 . 1 1 67 67 PHE CA C 67 58.840 58.840 57.336 1.504 25768 2133 1 3 . 1 1 67 67 PHE CB C 67 40.170 40.170 39.550 0.620 25768 2134 1 3 . 1 1 67 67 PHE H H 67 8.590 8.590 8.629 -0.039 25768 2135 1 3 . 1 1 68 68 ASN N N 68 119.030 119.030 124.748 -5.718 25768 2136 1 3 . 1 1 68 68 ASN C C 68 174.740 174.740 173.719 1.021 25768 2137 1 3 . 1 1 68 68 ASN CA C 68 53.430 53.430 52.227 1.203 25768 2138 1 3 . 1 1 68 68 ASN CB C 68 39.420 39.420 40.829 -1.409 25768 2139 1 3 . 1 1 68 68 ASN H H 68 8.340 8.340 8.336 0.004 25768 2140 1 3 . 1 1 69 69 HIS N N 69 119.590 119.590 118.181 1.409 25768 2141 1 3 . 1 1 69 69 HIS C C 69 174.370 174.370 176.148 -1.778 25768 2142 1 3 . 1 1 69 69 HIS CA C 69 55.950 55.950 56.735 -0.785 25768 2143 1 3 . 1 1 69 69 HIS CB C 69 29.960 29.960 30.867 -0.907 25768 2144 1 3 . 1 1 69 69 HIS H H 69 8.350 8.350 8.525 -0.175 25768 2145 1 3 . 1 1 70 70 GLN N N 70 121.980 121.980 122.260 -0.280 25768 2146 1 3 . 1 1 70 70 GLN C C 70 175.740 175.740 175.276 0.464 25768 2147 1 3 . 1 1 70 70 GLN CA C 70 56.340 56.340 55.964 0.376 25768 2148 1 3 . 1 1 70 70 GLN CB C 70 29.660 29.660 27.779 1.881 25768 2149 1 3 . 1 1 70 70 GLN H H 70 8.350 8.350 8.519 -0.169 25768 2150 1 3 . 1 1 71 71 VAL N N 71 120.530 120.530 122.690 -2.160 25768 2151 1 3 . 1 1 71 71 VAL C C 71 175.500 175.500 175.131 0.369 25768 2152 1 3 . 1 1 71 71 VAL CA C 71 62.540 62.540 61.914 0.625 25768 2153 1 3 . 1 1 71 71 VAL CB C 71 33.090 33.090 31.480 1.610 25768 2154 1 3 . 1 1 71 71 VAL H H 71 8.020 8.020 8.193 -0.173 25768 2155 1 3 . 1 1 72 72 ASP N N 72 123.910 123.910 125.974 -2.064 25768 2156 1 3 . 1 1 72 72 ASP C C 72 176.300 176.300 176.433 -0.133 25768 2157 1 3 . 1 1 72 72 ASP CA C 72 54.340 54.340 55.300 -0.960 25768 2158 1 3 . 1 1 72 72 ASP CB C 72 41.480 41.480 41.910 -0.430 25768 2159 1 3 . 1 1 72 72 ASP H H 72 8.280 8.280 8.866 -0.586 25768 2160 1 3 . 1 1 73 73 VAL N N 73 120.580 120.580 118.275 2.305 25768 2161 1 3 . 1 1 73 73 VAL C C 73 176.350 176.350 175.367 0.983 25768 2162 1 3 . 1 1 73 73 VAL CA C 73 62.970 62.970 62.823 0.147 25768 2163 1 3 . 1 1 73 73 VAL CB C 73 32.550 32.550 33.178 -0.629 25768 2164 1 3 . 1 1 73 73 VAL H H 73 7.960 7.960 7.980 -0.020 25768 2165 1 3 . 1 1 74 74 LYS N N 74 123.620 123.620 123.475 0.145 25768 2166 1 3 . 1 1 74 74 LYS C C 74 177.130 177.130 176.834 0.296 25768 2167 1 3 . 1 1 74 74 LYS CA C 74 57.060 57.060 56.694 0.366 25768 2168 1 3 . 1 1 74 74 LYS CB C 74 32.860 32.860 31.768 1.092 25768 2169 1 3 . 1 1 74 74 LYS H H 74 8.230 8.230 7.984 0.246 25768 2170 1 3 . 1 1 75 75 GLY N N 75 109.370 109.370 111.153 -1.783 25768 2171 1 3 . 1 1 75 75 GLY C C 75 174.030 174.030 173.775 0.255 25768 2172 1 3 . 1 1 75 75 GLY CA C 75 45.800 45.800 45.196 0.604 25768 2173 1 3 . 1 1 75 75 GLY H H 75 8.160 8.160 8.542 -0.382 25768 2174 1 3 . 1 1 76 76 LEU N N 76 121.660 121.660 123.799 -2.139 25768 2175 1 3 . 1 1 76 76 LEU C C 76 177.410 177.410 177.147 0.263 25768 2176 1 3 . 1 1 76 76 LEU CA C 76 55.410 55.410 54.535 0.875 25768 2177 1 3 . 1 1 76 76 LEU CB C 76 42.790 42.790 39.601 3.189 25768 2178 1 3 . 1 1 76 76 LEU H H 76 8.030 8.030 8.428 -0.398 25768 2179 1 3 . 1 1 77 77 GLY N N 77 109.330 109.330 112.452 -3.122 25768 2180 1 3 . 1 1 77 77 GLY C C 77 171.800 171.800 171.770 0.030 25768 2181 1 3 . 1 1 77 77 GLY CA C 77 44.990 44.990 44.069 0.922 25768 2182 1 3 . 1 1 77 77 GLY H H 77 8.100 8.100 7.859 0.241 25768 2183 1 3 . 1 1 78 78 PRO C C 78 177.740 177.740 176.669 1.071 25768 2184 1 3 . 1 1 78 78 PRO CA C 78 63.890 63.890 62.883 1.007 25768 2185 1 3 . 1 1 78 78 PRO CB C 78 32.170 32.170 32.381 -0.211 25768 2186 1 3 . 1 1 79 79 GLY N N 79 109.530 109.530 107.732 1.798 25768 2187 1 3 . 1 1 79 79 GLY C C 79 174.460 174.460 173.162 1.298 25768 2188 1 3 . 1 1 79 79 GLY CA C 79 45.780 45.780 44.885 0.895 25768 2189 1 3 . 1 1 79 79 GLY H H 79 8.410 8.410 8.406 0.004 25768 2190 1 3 . 1 1 80 80 LEU N N 80 121.880 121.880 122.538 -0.658 25768 2191 1 3 . 1 1 80 80 LEU C C 80 177.100 177.100 175.778 1.322 25768 2192 1 3 . 1 1 80 80 LEU CA C 80 55.720 55.720 54.441 1.279 25768 2193 1 3 . 1 1 80 80 LEU CB C 80 42.580 42.580 44.165 -1.585 25768 2194 1 3 . 1 1 80 80 LEU H H 80 8.010 8.010 7.869 0.141 25768 2195 1 3 . 1 1 81 81 ASP N N 81 119.990 119.990 120.841 -0.851 25768 2196 1 3 . 1 1 81 81 ASP C C 81 176.880 176.880 175.585 1.295 25768 2197 1 3 . 1 1 81 81 ASP CA C 81 54.770 54.770 56.297 -1.527 25768 2198 1 3 . 1 1 81 81 ASP CB C 81 41.390 41.390 41.496 -0.106 25768 2199 1 3 . 1 1 81 81 ASP H H 81 8.220 8.220 9.024 -0.804 25768 2200 1 3 . 1 1 82 82 GLY N N 82 109.270 109.270 112.124 -2.854 25768 2201 1 3 . 1 1 82 82 GLY C C 82 174.190 174.190 174.323 -0.133 25768 2202 1 3 . 1 1 82 82 GLY CA C 82 45.990 45.990 44.542 1.448 25768 2203 1 3 . 1 1 82 82 GLY H H 82 8.170 8.170 7.870 0.300 25768 2204 1 3 . 1 1 83 83 LYS N N 83 121.000 121.000 119.961 1.039 25768 2205 1 3 . 1 1 83 83 LYS C C 83 176.610 176.610 176.568 0.042 25768 2206 1 3 . 1 1 83 83 LYS CA C 83 56.620 56.620 56.645 -0.025 25768 2207 1 3 . 1 1 83 83 LYS CB C 83 33.020 33.020 32.920 0.100 25768 2208 1 3 . 1 1 83 83 LYS H H 83 7.970 7.970 8.304 -0.334 25768 2209 1 3 . 1 1 84 84 LEU N N 84 123.120 123.120 120.380 2.740 25768 2210 1 3 . 1 1 84 84 LEU C C 84 176.920 176.920 174.706 2.214 25768 2211 1 3 . 1 1 84 84 LEU CA C 84 55.550 55.550 54.340 1.210 25768 2212 1 3 . 1 1 84 84 LEU CB C 84 42.430 42.430 42.408 0.022 25768 2213 1 3 . 1 1 84 84 LEU H H 84 8.130 8.130 7.599 0.531 25768 2214 1 3 . 1 1 85 85 ALA N N 85 123.930 123.930 127.392 -3.462 25768 2215 1 3 . 1 1 85 85 ALA C C 85 177.060 177.060 176.942 0.118 25768 2216 1 3 . 1 1 85 85 ALA CA C 85 52.790 52.790 51.384 1.406 25768 2217 1 3 . 1 1 85 85 ALA CB C 85 19.670 19.670 20.892 -1.222 25768 2218 1 3 . 1 1 85 85 ALA H H 85 8.040 8.040 8.085 -0.045 25768 2219 1 3 . 1 1 86 86 ASP N N 86 119.760 119.760 121.090 -1.330 25768 2220 1 3 . 1 1 86 86 ASP C C 86 175.820 175.820 175.849 -0.029 25768 2221 1 3 . 1 1 86 86 ASP CA C 86 54.520 54.520 54.391 0.129 25768 2222 1 3 . 1 1 86 86 ASP CB C 86 41.390 41.390 41.569 -0.179 25768 2223 1 3 . 1 1 86 86 ASP H H 86 8.110 8.110 8.391 -0.281 25768 2224 1 3 . 1 1 87 87 ILE N N 87 120.620 120.620 119.537 1.083 25768 2225 1 3 . 1 1 87 87 ILE C C 87 175.740 175.740 175.750 -0.010 25768 2226 1 3 . 1 1 87 87 ILE CA C 87 61.160 61.160 61.921 -0.761 25768 2227 1 3 . 1 1 87 87 ILE CB C 87 39.260 39.260 38.914 0.346 25768 2228 1 3 . 1 1 87 87 ILE H H 87 7.800 7.800 8.279 -0.479 25768 2229 1 3 . 1 1 88 88 LYS N N 88 125.820 125.820 122.037 3.783 25768 2230 1 3 . 1 1 88 88 LYS C C 88 175.340 175.340 175.861 -0.521 25768 2231 1 3 . 1 1 88 88 LYS CA C 88 56.300 56.300 55.668 0.632 25768 2232 1 3 . 1 1 88 88 LYS CB C 88 32.900 32.900 33.266 -0.366 25768 2233 1 3 . 1 1 88 88 LYS H H 88 8.250 8.250 8.090 0.160 25768 2234 1 3 . 1 1 89 89 GLN N N 89 121.750 121.750 122.852 -1.102 25768 2235 1 3 . 1 1 89 89 GLN C C 89 175.000 175.000 175.950 -0.950 25768 2236 1 3 . 1 1 89 89 GLN CA C 89 55.210 55.210 55.282 -0.072 25768 2237 1 3 . 1 1 89 89 GLN CB C 89 30.570 30.570 30.593 -0.023 25768 2238 1 3 . 1 1 89 89 GLN H H 89 8.000 8.000 8.331 -0.331 25768 2239 1 3 . 1 1 90 90 LEU N N 90 126.660 126.660 121.112 5.548 25768 2240 1 3 . 1 1 90 90 LEU C C 90 174.240 174.240 174.750 -0.510 25768 2241 1 3 . 1 1 90 90 LEU CA C 90 52.720 52.720 53.525 -0.805 25768 2242 1 3 . 1 1 90 90 LEU CB C 90 42.350 42.350 41.646 0.704 25768 2243 1 3 . 1 1 90 90 LEU H H 90 8.630 8.630 8.588 0.042 25768 2244 1 3 . 1 1 92 92 PRO C C 92 173.900 173.900 176.624 -2.724 25768 2245 1 3 . 1 1 92 92 PRO CA C 92 63.320 63.320 62.579 0.741 25768 2246 1 3 . 1 1 92 92 PRO CB C 92 31.920 31.920 32.546 -0.626 25768 2247 1 3 . 1 1 93 93 THR N N 93 119.770 119.770 119.381 0.389 25768 2248 1 3 . 1 1 93 93 THR C C 93 171.360 171.360 173.807 -2.447 25768 2249 1 3 . 1 1 93 93 THR CA C 93 62.610 62.610 63.075 -0.465 25768 2250 1 3 . 1 1 93 93 THR CB C 93 72.680 72.680 69.751 2.929 25768 2251 1 3 . 1 1 93 93 THR H H 93 8.290 8.290 8.328 -0.038 25768 2252 1 3 . 1 1 94 94 LEU N N 94 128.880 128.880 127.106 1.774 25768 2253 1 3 . 1 1 94 94 LEU C C 94 175.130 175.130 175.028 0.102 25768 2254 1 3 . 1 1 94 94 LEU CA C 94 53.520 53.520 54.497 -0.977 25768 2255 1 3 . 1 1 94 94 LEU CB C 94 46.140 46.140 44.110 2.030 25768 2256 1 3 . 1 1 94 94 LEU H H 94 8.680 8.680 8.640 0.040 25768 2257 1 3 . 1 1 95 95 LEU N N 95 123.630 123.630 119.188 4.442 25768 2258 1 3 . 1 1 95 95 LEU C C 95 175.540 175.540 175.191 0.349 25768 2259 1 3 . 1 1 95 95 LEU CA C 95 55.190 55.190 54.213 0.977 25768 2260 1 3 . 1 1 95 95 LEU CB C 95 45.300 45.300 45.965 -0.665 25768 2261 1 3 . 1 1 95 95 LEU H H 95 9.580 9.580 7.996 1.584 25768 2262 1 3 . 1 1 96 96 LEU N N 96 123.150 123.150 120.778 2.372 25768 2263 1 3 . 1 1 96 96 LEU C C 96 174.960 174.960 175.248 -0.288 25768 2264 1 3 . 1 1 96 96 LEU CA C 96 54.420 54.420 53.997 0.423 25768 2265 1 3 . 1 1 96 96 LEU CB C 96 44.560 44.560 45.667 -1.107 25768 2266 1 3 . 1 1 96 96 LEU H H 96 8.770 8.770 9.162 -0.392 25768 2267 1 3 . 1 1 97 97 GLN N N 97 121.290 121.290 119.724 1.566 25768 2268 1 3 . 1 1 97 97 GLN C C 97 174.380 174.380 173.809 0.571 25768 2269 1 3 . 1 1 97 97 GLN CA C 97 54.740 54.740 54.422 0.318 25768 2270 1 3 . 1 1 97 97 GLN CB C 97 36.600 36.600 31.063 5.537 25768 2271 1 3 . 1 1 97 97 GLN H H 97 9.480 9.480 8.961 0.519 25768 2272 1 3 . 1 1 98 98 TYR N N 98 122.250 122.250 123.515 -1.265 25768 2273 1 3 . 1 1 98 98 TYR C C 98 173.460 173.460 173.356 0.104 25768 2274 1 3 . 1 1 98 98 TYR CA C 98 55.160 55.160 56.253 -1.093 25768 2275 1 3 . 1 1 98 98 TYR CB C 98 42.420 42.420 43.066 -0.646 25768 2276 1 3 . 1 1 98 98 TYR H H 98 9.010 9.010 9.039 -0.029 25768 2277 1 3 . 1 1 99 99 TYR N N 99 126.860 126.860 123.579 3.281 25768 2278 1 3 . 1 1 99 99 TYR C C 99 175.380 175.380 174.976 0.404 25768 2279 1 3 . 1 1 99 99 TYR CA C 99 54.220 54.220 55.201 -0.981 25768 2280 1 3 . 1 1 99 99 TYR CB C 99 38.890 38.890 37.686 1.204 25768 2281 1 3 . 1 1 99 99 TYR H H 99 8.300 8.300 7.581 0.719 25768 2282 1 3 . 1 1 100 100 PRO C C 100 178.330 178.330 176.824 1.506 25768 2283 1 3 . 1 1 100 100 PRO CA C 100 64.750 64.750 64.880 -0.130 25768 2284 1 3 . 1 1 100 100 PRO CB C 100 32.130 32.130 32.070 0.060 25768 2285 1 3 . 1 1 101 101 MET N N 101 114.520 114.520 116.332 -1.812 25768 2286 1 3 . 1 1 101 101 MET C C 101 178.240 178.240 175.531 2.709 25768 2287 1 3 . 1 1 101 101 MET CA C 101 53.500 53.500 54.458 -0.958 25768 2288 1 3 . 1 1 101 101 MET CB C 101 30.160 30.160 32.570 -2.410 25768 2289 1 3 . 1 1 101 101 MET H H 101 9.390 9.390 8.079 1.311 25768 2290 1 3 . 1 1 102 102 GLY N N 102 117.500 117.500 107.410 10.090 25768 2291 1 3 . 1 1 102 102 GLY C C 102 175.690 175.690 175.070 0.620 25768 2292 1 3 . 1 1 102 102 GLY CA C 102 46.760 46.760 45.008 1.752 25768 2293 1 3 . 1 1 102 102 GLY H H 102 8.640 8.640 7.482 1.158 25768 2294 1 3 . 1 1 103 103 GLY N N 103 111.030 111.030 108.890 2.140 25768 2295 1 3 . 1 1 103 103 GLY C C 103 174.070 174.070 174.330 -0.260 25768 2296 1 3 . 1 1 103 103 GLY CA C 103 46.140 46.140 44.748 1.392 25768 2297 1 3 . 1 1 103 103 GLY H H 103 9.390 9.390 8.278 1.112 25768 2298 1 3 . 1 1 104 104 THR N N 104 109.290 109.290 112.945 -3.655 25768 2299 1 3 . 1 1 104 104 THR C C 104 174.290 174.290 173.991 0.299 25768 2300 1 3 . 1 1 104 104 THR CA C 104 60.900 60.900 60.334 0.566 25768 2301 1 3 . 1 1 104 104 THR CB C 104 72.070 72.070 70.123 1.947 25768 2302 1 3 . 1 1 104 104 THR H H 104 7.290 7.290 7.737 -0.447 25768 2303 1 3 . 1 1 105 105 ASN C C 105 175.050 175.050 174.414 0.636 25768 2304 1 3 . 1 1 105 105 ASN CA C 105 52.880 52.880 53.079 -0.199 25768 2305 1 3 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.752 -0.492 25768 2306 1 3 . 1 1 106 106 SER N N 106 113.000 113.000 115.189 -2.189 25768 2307 1 3 . 1 1 106 106 SER C C 106 176.000 176.000 174.215 1.785 25768 2308 1 3 . 1 1 106 106 SER CA C 106 58.700 58.700 57.217 1.483 25768 2309 1 3 . 1 1 106 106 SER CB C 106 64.540 64.540 64.630 -0.090 25768 2310 1 3 . 1 1 106 106 SER H H 106 7.450 7.450 7.429 0.021 25768 2311 1 3 . 1 1 107 107 ALA N N 107 132.220 132.220 124.875 7.345 25768 2312 1 3 . 1 1 107 107 ALA C C 107 176.610 176.610 178.017 -1.407 25768 2313 1 3 . 1 1 107 107 ALA CA C 107 54.380 54.380 53.220 1.160 25768 2314 1 3 . 1 1 107 107 ALA CB C 107 18.690 18.690 19.190 -0.500 25768 2315 1 3 . 1 1 107 107 ALA H H 107 8.870 8.870 8.486 0.384 25768 2316 1 3 . 1 1 108 108 PHE N N 108 116.050 116.050 116.149 -0.099 25768 2317 1 3 . 1 1 108 108 PHE C C 108 174.270 174.270 174.392 -0.122 25768 2318 1 3 . 1 1 108 108 PHE CA C 108 56.140 56.140 56.375 -0.235 25768 2319 1 3 . 1 1 108 108 PHE CB C 108 40.520 40.520 39.905 0.615 25768 2320 1 3 . 1 1 108 108 PHE H H 108 7.550 7.550 7.856 -0.306 25768 2321 1 3 . 1 1 109 109 GLN N N 109 128.260 128.260 123.212 5.048 25768 2322 1 3 . 1 1 109 109 GLN C C 109 172.300 172.300 173.945 -1.645 25768 2323 1 3 . 1 1 109 109 GLN CA C 109 52.310 52.310 53.024 -0.714 25768 2324 1 3 . 1 1 109 109 GLN CB C 109 29.050 29.050 31.479 -2.429 25768 2325 1 3 . 1 1 109 109 GLN H H 109 9.060 9.060 8.760 0.300 25768 2326 1 3 . 1 1 110 110 PRO C C 110 175.020 175.020 176.229 -1.209 25768 2327 1 3 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.999 -1.449 25768 2328 1 3 . 1 1 110 110 PRO CB C 110 33.280 33.280 32.308 0.972 25768 2329 1 3 . 1 1 111 111 TYR N N 111 115.730 115.730 118.008 -2.278 25768 2330 1 3 . 1 1 111 111 TYR C C 111 173.850 173.850 174.940 -1.090 25768 2331 1 3 . 1 1 111 111 TYR CA C 111 56.470 56.470 57.991 -1.521 25768 2332 1 3 . 1 1 111 111 TYR CB C 111 38.650 38.650 41.576 -2.926 25768 2333 1 3 . 1 1 111 111 TYR H H 111 8.500 8.500 8.108 0.392 25768 2334 1 3 . 1 1 112 112 GLY N N 112 103.570 103.570 113.299 -9.729 25768 2335 1 3 . 1 1 112 112 GLY C C 112 172.020 172.020 172.959 -0.939 25768 2336 1 3 . 1 1 112 112 GLY CA C 112 43.950 43.950 44.370 -0.420 25768 2337 1 3 . 1 1 112 112 GLY H H 112 8.110 8.110 8.471 -0.361 25768 2338 1 3 . 1 1 113 113 GLY N N 113 108.510 108.510 112.900 -4.390 25768 2339 1 3 . 1 1 113 113 GLY C C 113 171.540 171.540 171.985 -0.445 25768 2340 1 3 . 1 1 113 113 GLY CA C 113 46.120 46.120 43.336 2.784 25768 2341 1 3 . 1 1 113 113 GLY H H 113 9.080 9.080 8.308 0.772 25768 2342 1 3 . 1 1 114 114 LEU N N 114 120.270 120.270 124.763 -4.493 25768 2343 1 3 . 1 1 114 114 LEU C C 114 175.810 175.810 175.864 -0.054 25768 2344 1 3 . 1 1 114 114 LEU CA C 114 53.920 53.920 54.172 -0.252 25768 2345 1 3 . 1 1 114 114 LEU CB C 114 47.940 47.940 46.484 1.456 25768 2346 1 3 . 1 1 114 114 LEU H H 114 8.620 8.620 8.697 -0.076 25768 2347 1 3 . 1 1 115 115 GLY N N 115 110.620 110.620 111.046 -0.426 25768 2348 1 3 . 1 1 115 115 GLY C C 115 171.560 171.560 172.753 -1.193 25768 2349 1 3 . 1 1 115 115 GLY CA C 115 46.940 46.940 43.969 2.971 25768 2350 1 3 . 1 1 115 115 GLY H H 115 9.000 9.000 7.593 1.407 25768 2351 1 3 . 1 1 116 116 VAL N N 116 113.600 113.600 117.584 -3.984 25768 2352 1 3 . 1 1 116 116 VAL C C 116 174.120 174.120 173.971 0.149 25768 2353 1 3 . 1 1 116 116 VAL CA C 116 58.970 58.970 60.895 -1.925 25768 2354 1 3 . 1 1 116 116 VAL CB C 116 36.600 36.600 34.303 2.297 25768 2355 1 3 . 1 1 116 116 VAL H H 116 8.680 8.680 7.675 1.005 25768 2356 1 3 . 1 1 117 117 ASN N N 117 120.020 120.020 122.561 -2.541 25768 2357 1 3 . 1 1 117 117 ASN CA C 117 52.190 52.190 52.845 -0.655 25768 2358 1 3 . 1 1 117 117 ASN CB C 117 42.450 42.450 40.607 1.843 25768 2359 1 3 . 1 1 117 117 ASN H H 117 8.840 8.840 7.926 0.914 25768 2360 1 3 . 1 1 119 119 THR C C 119 174.350 174.350 174.185 0.165 25768 2361 1 3 . 1 1 119 119 THR CA C 119 63.140 63.140 61.647 1.493 25768 2362 1 3 . 1 1 119 119 THR CB C 119 70.170 70.170 69.405 0.765 25768 2363 1 3 . 1 1 120 120 THR N N 120 114.120 114.120 116.916 -2.796 25768 2364 1 3 . 1 1 120 120 THR C C 120 174.220 174.220 173.353 0.867 25768 2365 1 3 . 1 1 120 120 THR CA C 120 61.900 61.900 62.623 -0.723 25768 2366 1 3 . 1 1 120 120 THR CB C 120 70.140 70.140 68.701 1.439 25768 2367 1 3 . 1 1 120 120 THR H H 120 7.570 7.570 8.467 -0.897 25768 2368 1 3 . 1 1 121 121 PHE N N 121 121.230 121.230 122.865 -1.635 25768 2369 1 3 . 1 1 121 121 PHE C C 121 174.910 174.910 174.157 0.753 25768 2370 1 3 . 1 1 121 121 PHE CA C 121 58.720 58.720 56.371 2.349 25768 2371 1 3 . 1 1 121 121 PHE CB C 121 40.470 40.470 39.326 1.144 25768 2372 1 3 . 1 1 121 121 PHE H H 121 7.830 7.830 8.151 -0.321 25768 2373 1 3 . 1 1 122 122 PHE C C 122 175.070 175.070 175.311 -0.241 25768 2374 1 3 . 1 1 122 122 PHE CA C 122 57.890 57.890 58.578 -0.688 25768 2375 1 3 . 1 1 122 122 PHE CB C 122 39.870 39.870 39.158 0.712 25768 2376 1 3 . 1 1 123 123 ASP N N 123 122.170 122.170 123.251 -1.081 25768 2377 1 3 . 1 1 123 123 ASP C C 123 176.150 176.150 176.373 -0.223 25768 2378 1 3 . 1 1 123 123 ASP CA C 123 54.530 54.530 55.154 -0.624 25768 2379 1 3 . 1 1 123 123 ASP CB C 123 41.830 41.830 41.326 0.504 25768 2380 1 3 . 1 1 123 123 ASP H H 123 7.950 7.950 8.703 -0.753 25768 2381 1 3 . 1 1 124 124 GLU N N 124 122.690 122.690 119.839 2.851 25768 2382 1 3 . 1 1 124 124 GLU C C 124 176.630 176.630 178.108 -1.478 25768 2383 1 3 . 1 1 124 124 GLU CA C 124 57.620 57.620 57.898 -0.278 25768 2384 1 3 . 1 1 124 124 GLU CB C 124 30.450 30.450 30.322 0.128 25768 2385 1 3 . 1 1 124 124 GLU H H 124 8.340 8.340 8.524 -0.184 25768 2386 1 3 . 1 1 125 125 ASP N N 125 121.280 121.280 121.678 -0.398 25768 2387 1 3 . 1 1 125 125 ASP C C 125 176.940 176.940 178.807 -1.867 25768 2388 1 3 . 1 1 125 125 ASP CA C 125 55.180 55.180 56.321 -1.141 25768 2389 1 3 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.880 0.341 25768 2390 1 3 . 1 1 125 125 ASP H H 125 8.310 8.310 8.675 -0.365 25768 2391 1 3 . 1 1 126 126 LEU N N 126 122.830 122.830 119.938 2.892 25768 2392 1 3 . 1 1 126 126 LEU C C 126 178.020 178.020 178.079 -0.059 25768 2393 1 3 . 1 1 126 126 LEU CA C 126 56.450 56.450 56.992 -0.542 25768 2394 1 3 . 1 1 126 126 LEU CB C 126 42.150 42.150 41.766 0.384 25768 2395 1 3 . 1 1 126 126 LEU H H 126 8.010 8.010 8.116 -0.106 25768 2396 1 3 . 1 1 127 127 ALA N N 127 122.660 122.660 120.174 2.486 25768 2397 1 3 . 1 1 127 127 ALA C C 127 178.600 178.600 178.018 0.582 25768 2398 1 3 . 1 1 127 127 ALA CA C 127 53.780 53.780 53.809 -0.030 25768 2399 1 3 . 1 1 127 127 ALA CB C 127 19.000 19.000 19.159 -0.159 25768 2400 1 3 . 1 1 127 127 ALA H H 127 8.100 8.100 7.555 0.545 25768 2401 1 3 . 1 1 128 128 SER N N 128 113.740 113.740 114.375 -0.635 25768 2402 1 3 . 1 1 128 128 SER C C 128 175.010 175.010 172.947 2.063 25768 2403 1 3 . 1 1 128 128 SER CA C 128 59.580 59.580 57.757 1.823 25768 2404 1 3 . 1 1 128 128 SER CB C 128 63.800 63.800 63.288 0.512 25768 2405 1 3 . 1 1 128 128 SER H H 128 7.920 7.920 7.672 0.248 25768 2406 1 3 . 1 1 129 129 ASN N N 129 120.300 120.300 122.642 -2.342 25768 2407 1 3 . 1 1 129 129 ASN C C 129 175.590 175.590 175.301 0.289 25768 2408 1 3 . 1 1 129 129 ASN CA C 129 54.180 54.180 52.761 1.419 25768 2409 1 3 . 1 1 129 129 ASN CB C 129 38.900 38.900 40.465 -1.565 25768 2410 1 3 . 1 1 129 129 ASN H H 129 8.120 8.120 8.483 -0.363 25768 2411 1 3 . 1 1 130 130 ARG N N 130 120.630 120.630 123.351 -2.721 25768 2412 1 3 . 1 1 130 130 ARG C C 130 176.720 176.720 175.732 0.988 25768 2413 1 3 . 1 1 130 130 ARG CA C 130 57.240 57.240 55.285 1.955 25768 2414 1 3 . 1 1 130 130 ARG CB C 130 30.500 30.500 29.615 0.885 25768 2415 1 3 . 1 1 130 130 ARG H H 130 8.050 8.050 8.572 -0.522 25768 2416 1 3 . 1 1 131 131 LYS N N 131 121.150 121.150 122.304 -1.154 25768 2417 1 3 . 1 1 131 131 LYS C C 131 176.750 176.750 175.436 1.314 25768 2418 1 3 . 1 1 131 131 LYS CA C 131 57.050 57.050 56.897 0.153 25768 2419 1 3 . 1 1 131 131 LYS CB C 131 32.870 32.870 32.200 0.670 25768 2420 1 3 . 1 1 131 131 LYS H H 131 8.020 8.020 8.496 -0.476 25768 2421 1 3 . 1 1 132 132 ALA N N 132 124.110 124.110 123.044 1.066 25768 2422 1 3 . 1 1 132 132 ALA C C 132 177.680 177.680 176.832 0.848 25768 2423 1 3 . 1 1 132 132 ALA CA C 132 53.070 53.070 51.997 1.073 25768 2424 1 3 . 1 1 132 132 ALA CB C 132 19.250 19.250 19.158 0.092 25768 2425 1 3 . 1 1 132 132 ALA H H 132 8.010 8.010 8.325 -0.315 25768 2426 1 3 . 1 1 133 133 GLN N N 133 118.830 118.830 119.249 -0.419 25768 2427 1 3 . 1 1 133 133 GLN C C 133 176.380 176.380 175.900 0.480 25768 2428 1 3 . 1 1 133 133 GLN CA C 133 56.400 56.400 55.326 1.074 25768 2429 1 3 . 1 1 133 133 GLN CB C 133 29.670 29.670 30.576 -0.906 25768 2430 1 3 . 1 1 133 133 GLN H H 133 8.070 8.070 8.040 0.030 25768 2431 1 3 . 1 1 134 134 GLY N N 134 109.400 109.400 108.972 0.428 25768 2432 1 3 . 1 1 134 134 GLY C C 134 174.060 174.060 173.231 0.829 25768 2433 1 3 . 1 1 134 134 GLY CA C 134 45.690 45.690 44.882 0.808 25768 2434 1 3 . 1 1 134 134 GLY H H 134 8.150 8.150 8.266 -0.116 25768 2435 1 3 . 1 1 135 135 PHE N N 135 120.480 120.480 119.341 1.139 25768 2436 1 3 . 1 1 135 135 PHE C C 135 176.000 176.000 175.035 0.965 25768 2437 1 3 . 1 1 135 135 PHE CA C 135 58.370 58.370 57.505 0.865 25768 2438 1 3 . 1 1 135 135 PHE CB C 135 39.710 39.710 41.026 -1.317 25768 2439 1 3 . 1 1 135 135 PHE H H 135 8.060 8.060 8.102 -0.042 25768 2440 1 3 . 1 1 136 136 SER N N 136 116.740 116.740 120.077 -3.337 25768 2441 1 3 . 1 1 136 136 SER C C 136 174.620 174.620 174.583 0.037 25768 2442 1 3 . 1 1 136 136 SER CA C 136 58.870 58.870 58.462 0.408 25768 2443 1 3 . 1 1 136 136 SER CB C 136 64.200 64.200 63.338 0.862 25768 2444 1 3 . 1 1 136 136 SER H H 136 8.160 8.160 8.514 -0.354 25768 2445 1 3 . 1 1 137 137 SER N N 137 117.650 117.650 122.226 -4.576 25768 2446 1 3 . 1 1 137 137 SER C C 137 174.410 174.410 174.582 -0.172 25768 2447 1 3 . 1 1 137 137 SER CA C 137 58.880 58.880 58.385 0.495 25768 2448 1 3 . 1 1 137 137 SER CB C 137 64.140 64.140 63.589 0.551 25768 2449 1 3 . 1 1 137 137 SER H H 137 8.140 8.140 9.000 -0.860 25768 2450 1 3 . 1 1 138 138 MET N N 138 121.980 121.980 119.660 2.320 25768 2451 1 3 . 1 1 138 138 MET C C 138 175.680 175.680 174.927 0.753 25768 2452 1 3 . 1 1 138 138 MET CA C 138 56.180 56.180 55.251 0.929 25768 2453 1 3 . 1 1 138 138 MET CB C 138 33.240 33.240 35.367 -2.127 25768 2454 1 3 . 1 1 138 138 MET H H 138 8.110 8.110 7.828 0.282 25768 2455 1 3 . 1 1 139 139 LYS N N 139 122.110 122.110 122.603 -0.493 25768 2456 1 3 . 1 1 139 139 LYS C C 139 176.220 176.220 175.317 0.903 25768 2457 1 3 . 1 1 139 139 LYS CA C 139 56.370 56.370 55.897 0.473 25768 2458 1 3 . 1 1 139 139 LYS CB C 139 33.220 33.220 31.889 1.331 25768 2459 1 3 . 1 1 139 139 LYS H H 139 8.140 8.140 8.400 -0.260 25768 2460 1 3 . 1 1 140 140 LEU N N 140 123.860 123.860 125.235 -1.375 25768 2461 1 3 . 1 1 140 140 LEU C C 140 177.100 177.100 175.820 1.280 25768 2462 1 3 . 1 1 140 140 LEU CA C 140 55.710 55.710 54.769 0.941 25768 2463 1 3 . 1 1 140 140 LEU CB C 140 42.460 42.460 42.419 0.041 25768 2464 1 3 . 1 1 140 140 LEU H H 140 8.140 8.140 8.677 -0.537 25768 2465 1 3 . 1 1 141 141 GLN N N 141 120.350 120.350 125.628 -5.278 25768 2466 1 3 . 1 1 141 141 GLN C C 141 175.170 175.170 174.848 0.322 25768 2467 1 3 . 1 1 141 141 GLN CA C 141 56.200 56.200 55.746 0.454 25768 2468 1 3 . 1 1 141 141 GLN CB C 141 29.950 29.950 30.857 -0.906 25768 2469 1 3 . 1 1 141 141 GLN H H 141 8.210 8.210 8.521 -0.311 25768 2470 1 3 . 1 1 142 142 ASP N N 142 120.950 120.950 123.858 -2.908 25768 2471 1 3 . 1 1 142 142 ASP C C 142 175.840 175.840 176.532 -0.692 25768 2472 1 3 . 1 1 142 142 ASP CA C 142 54.700 54.700 54.937 -0.237 25768 2473 1 3 . 1 1 142 142 ASP CB C 142 41.760 41.760 41.734 0.026 25768 2474 1 3 . 1 1 142 142 ASP H H 142 8.120 8.120 8.646 -0.526 25768 2475 1 3 . 1 1 143 143 SER N N 143 114.880 114.880 112.866 2.014 25768 2476 1 3 . 1 1 143 143 SER C C 143 173.290 173.290 172.828 0.462 25768 2477 1 3 . 1 1 143 143 SER CA C 143 58.450 58.450 57.958 0.492 25768 2478 1 3 . 1 1 143 143 SER CB C 143 64.760 64.760 64.154 0.606 25768 2479 1 3 . 1 1 143 143 SER H H 143 7.960 7.960 8.017 -0.057 25768 2480 1 3 . 1 1 144 144 TRP N N 144 123.110 123.110 123.132 -0.022 25768 2481 1 3 . 1 1 144 144 TRP C C 144 175.880 175.880 176.171 -0.291 25768 2482 1 3 . 1 1 144 144 TRP CA C 144 56.420 56.420 56.786 -0.366 25768 2483 1 3 . 1 1 144 144 TRP CB C 144 31.160 31.160 31.216 -0.056 25768 2484 1 3 . 1 1 144 144 TRP H H 144 8.080 8.080 8.416 -0.336 25768 2485 1 3 . 1 1 145 145 GLY N N 145 110.410 110.410 110.564 -0.154 25768 2486 1 3 . 1 1 145 145 GLY C C 145 172.870 172.870 173.019 -0.149 25768 2487 1 3 . 1 1 145 145 GLY CA C 145 45.130 45.130 44.424 0.706 25768 2488 1 3 . 1 1 145 145 GLY H H 145 8.660 8.660 7.783 0.877 25768 2489 1 3 . 1 1 148 148 GLY C C 148 171.800 171.800 172.207 -0.407 25768 2490 1 3 . 1 1 148 148 GLY CA C 148 44.140 44.140 45.453 -1.313 25768 2491 1 3 . 1 1 149 149 GLU N N 149 123.070 123.070 122.995 0.075 25768 2492 1 3 . 1 1 149 149 GLU C C 149 174.210 174.210 173.972 0.238 25768 2493 1 3 . 1 1 149 149 GLU CA C 149 55.120 55.120 54.636 0.484 25768 2494 1 3 . 1 1 149 149 GLU CB C 149 37.410 37.410 34.885 2.525 25768 2495 1 3 . 1 1 149 149 GLU H H 149 8.550 8.550 8.841 -0.291 25768 2496 1 3 . 1 1 150 150 LEU N N 150 126.130 126.130 123.676 2.454 25768 2497 1 3 . 1 1 150 150 LEU C C 150 174.410 174.410 175.139 -0.729 25768 2498 1 3 . 1 1 150 150 LEU CA C 150 54.260 54.260 53.265 0.995 25768 2499 1 3 . 1 1 150 150 LEU CB C 150 47.510 47.510 44.913 2.597 25768 2500 1 3 . 1 1 150 150 LEU H H 150 8.550 8.550 8.204 0.346 25768 2501 1 3 . 1 1 151 151 GLY N N 151 109.500 109.500 111.246 -1.746 25768 2502 1 3 . 1 1 151 151 GLY C C 151 170.610 170.610 172.185 -1.575 25768 2503 1 3 . 1 1 151 151 GLY CA C 151 45.980 45.980 43.660 2.320 25768 2504 1 3 . 1 1 151 151 GLY H H 151 8.090 8.090 8.617 -0.527 25768 2505 1 3 . 1 1 152 152 PHE N N 152 110.960 110.960 119.451 -8.491 25768 2506 1 3 . 1 1 152 152 PHE C C 152 171.510 171.510 174.188 -2.678 25768 2507 1 3 . 1 1 152 152 PHE CA C 152 58.170 58.170 57.472 0.698 25768 2508 1 3 . 1 1 152 152 PHE CB C 152 41.690 41.690 41.018 0.672 25768 2509 1 3 . 1 1 152 152 PHE H H 152 8.380 8.380 8.425 -0.045 25768 2510 1 3 . 1 1 153 153 ASP N N 153 118.880 118.880 124.490 -5.610 25768 2511 1 3 . 1 1 153 153 ASP C C 153 176.520 176.520 174.486 2.034 25768 2512 1 3 . 1 1 153 153 ASP CA C 153 52.940 52.940 54.567 -1.627 25768 2513 1 3 . 1 1 153 153 ASP CB C 153 44.540 44.540 43.140 1.400 25768 2514 1 3 . 1 1 153 153 ASP H H 153 7.970 7.970 8.926 -0.956 25768 2515 1 3 . 1 1 154 154 TYR N N 154 123.630 123.630 123.549 0.081 25768 2516 1 3 . 1 1 154 154 TYR C C 154 175.610 175.610 173.975 1.635 25768 2517 1 3 . 1 1 154 154 TYR CA C 154 57.310 57.310 57.642 -0.331 25768 2518 1 3 . 1 1 154 154 TYR CB C 154 42.040 42.040 42.038 0.002 25768 2519 1 3 . 1 1 154 154 TYR H H 154 9.730 9.730 8.396 1.334 25768 2520 1 3 . 1 1 155 155 MET N N 155 126.190 126.190 127.701 -1.511 25768 2521 1 3 . 1 1 155 155 MET C C 155 174.970 174.970 175.064 -0.094 25768 2522 1 3 . 1 1 155 155 MET CA C 155 54.720 54.720 56.965 -2.245 25768 2523 1 3 . 1 1 155 155 MET CB C 155 28.300 28.300 32.628 -4.328 25768 2524 1 3 . 1 1 155 155 MET H H 155 8.600 8.600 8.499 0.101 25768 2525 1 3 . 1 1 156 156 LEU N N 156 125.290 125.290 126.336 -1.046 25768 2526 1 3 . 1 1 156 156 LEU C C 156 177.680 177.680 177.098 0.582 25768 2527 1 3 . 1 1 156 156 LEU CA C 156 56.040 56.040 55.197 0.843 25768 2528 1 3 . 1 1 156 156 LEU CB C 156 43.040 43.040 43.459 -0.419 25768 2529 1 3 . 1 1 156 156 LEU H H 156 9.190 9.190 8.549 0.641 25768 2530 1 3 . 1 1 157 157 ASN N N 157 114.690 114.690 116.089 -1.399 25768 2531 1 3 . 1 1 157 157 ASN C C 157 173.640 173.640 177.277 -3.637 25768 2532 1 3 . 1 1 157 157 ASN CA C 157 52.650 52.650 56.321 -3.671 25768 2533 1 3 . 1 1 157 157 ASN CB C 157 37.270 37.270 36.099 1.171 25768 2534 1 3 . 1 1 157 157 ASN H H 157 8.060 8.060 8.079 -0.019 25768 2535 1 3 . 1 1 158 158 GLU N N 158 114.530 114.530 121.652 -7.122 25768 2536 1 3 . 1 1 158 158 GLU C C 158 176.090 176.090 176.767 -0.677 25768 2537 1 3 . 1 1 158 158 GLU CA C 158 60.010 60.010 59.004 1.006 25768 2538 1 3 . 1 1 158 158 GLU CB C 158 29.730 29.730 30.103 -0.373 25768 2539 1 3 . 1 1 158 158 GLU H H 158 8.560 8.560 8.274 0.286 25768 2540 1 3 . 1 1 159 159 HIS N N 159 110.480 110.480 115.090 -4.610 25768 2541 1 3 . 1 1 159 159 HIS C C 159 173.130 173.130 174.243 -1.113 25768 2542 1 3 . 1 1 159 159 HIS CA C 159 56.770 56.770 54.383 2.387 25768 2543 1 3 . 1 1 159 159 HIS CB C 159 32.630 32.630 29.266 3.364 25768 2544 1 3 . 1 1 159 159 HIS H H 159 8.190 8.190 7.902 0.288 25768 2545 1 3 . 1 1 160 160 ALA N N 160 122.890 122.890 121.138 1.752 25768 2546 1 3 . 1 1 160 160 ALA C C 160 176.200 176.200 175.577 0.623 25768 2547 1 3 . 1 1 160 160 ALA CA C 160 51.730 51.730 54.175 -2.445 25768 2548 1 3 . 1 1 160 160 ALA CB C 160 21.560 21.560 17.311 4.249 25768 2549 1 3 . 1 1 160 160 ALA H H 160 8.400 8.400 7.800 0.600 25768 2550 1 3 . 1 1 161 161 LEU N N 161 116.540 116.540 118.086 -1.546 25768 2551 1 3 . 1 1 161 161 LEU C C 161 174.930 174.930 175.173 -0.243 25768 2552 1 3 . 1 1 161 161 LEU CA C 161 54.280 54.280 54.040 0.240 25768 2553 1 3 . 1 1 161 161 LEU CB C 161 45.640 45.640 46.854 -1.214 25768 2554 1 3 . 1 1 161 161 LEU H H 161 8.590 8.590 7.833 0.757 25768 2555 1 3 . 1 1 162 162 PHE N N 162 121.780 121.780 122.866 -1.086 25768 2556 1 3 . 1 1 162 162 PHE C C 162 171.960 171.960 173.178 -1.218 25768 2557 1 3 . 1 1 162 162 PHE CA C 162 56.420 56.420 57.243 -0.824 25768 2558 1 3 . 1 1 162 162 PHE CB C 162 43.340 43.340 43.026 0.314 25768 2559 1 3 . 1 1 162 162 PHE H H 162 9.180 9.180 8.613 0.567 25768 2560 1 3 . 1 1 163 163 ASN N N 163 127.850 127.850 123.111 4.739 25768 2561 1 3 . 1 1 163 163 ASN C C 163 171.320 171.320 172.825 -1.505 25768 2562 1 3 . 1 1 163 163 ASN CA C 163 52.340 52.340 51.994 0.346 25768 2563 1 3 . 1 1 163 163 ASN CB C 163 46.410 46.410 42.399 4.011 25768 2564 1 3 . 1 1 163 163 ASN H H 163 7.700 7.700 8.324 -0.624 25768 2565 1 3 . 1 1 164 164 MET N N 164 119.950 119.950 118.077 1.873 25768 2566 1 3 . 1 1 164 164 MET C C 164 172.830 172.830 173.818 -0.988 25768 2567 1 3 . 1 1 164 164 MET CA C 164 55.180 55.180 54.254 0.926 25768 2568 1 3 . 1 1 164 164 MET CB C 164 37.770 37.770 37.606 0.164 25768 2569 1 3 . 1 1 164 164 MET H H 164 7.070 7.070 8.102 -1.032 25768 2570 1 3 . 1 1 165 165 ALA N N 165 120.600 120.600 123.760 -3.160 25768 2571 1 3 . 1 1 165 165 ALA C C 165 174.240 174.240 175.278 -1.038 25768 2572 1 3 . 1 1 165 165 ALA CA C 165 51.630 51.630 50.182 1.448 25768 2573 1 3 . 1 1 165 165 ALA CB C 165 22.330 22.330 22.313 0.017 25768 2574 1 3 . 1 1 165 165 ALA H H 165 8.290 8.290 8.703 -0.413 25768 2575 1 3 . 1 1 166 166 VAL N N 166 117.900 117.900 115.806 2.094 25768 2576 1 3 . 1 1 166 166 VAL C C 166 172.950 172.950 175.021 -2.071 25768 2577 1 3 . 1 1 166 166 VAL CA C 166 59.710 59.710 60.675 -0.965 25768 2578 1 3 . 1 1 166 166 VAL CB C 166 35.290 35.290 35.580 -0.290 25768 2579 1 3 . 1 1 166 166 VAL H H 166 8.720 8.720 8.110 0.610 25768 2580 1 3 . 1 1 171 171 ILE C C 171 175.750 175.750 174.625 1.125 25768 2581 1 3 . 1 1 171 171 ILE CA C 171 61.720 61.720 61.564 0.156 25768 2582 1 3 . 1 1 171 171 ILE CB C 171 39.300 39.300 37.627 1.673 25768 2583 1 3 . 1 1 172 172 ASP N N 172 124.070 124.070 120.004 4.066 25768 2584 1 3 . 1 1 172 172 ASP C C 172 176.590 176.590 175.680 0.910 25768 2585 1 3 . 1 1 172 172 ASP CA C 172 54.460 54.460 54.194 0.266 25768 2586 1 3 . 1 1 172 172 ASP CB C 172 41.410 41.410 41.842 -0.432 25768 2587 1 3 . 1 1 172 172 ASP H H 172 8.460 8.460 8.049 0.411 25768 2588 1 3 . 1 1 173 173 THR N N 173 115.570 115.570 114.183 1.387 25768 2589 1 3 . 1 1 173 173 THR C C 173 175.030 175.030 173.652 1.378 25768 2590 1 3 . 1 1 173 173 THR CA C 173 62.680 62.680 62.485 0.195 25768 2591 1 3 . 1 1 173 173 THR CB C 173 69.840 69.840 69.479 0.361 25768 2592 1 3 . 1 1 173 173 THR H H 173 8.080 8.080 7.654 0.426 25768 2593 1 3 . 1 1 174 174 LYS N N 174 122.680 122.680 121.719 0.961 25768 2594 1 3 . 1 1 174 174 LYS C C 174 176.340 176.340 176.991 -0.651 25768 2595 1 3 . 1 1 174 174 LYS CA C 174 56.820 56.820 56.572 0.248 25768 2596 1 3 . 1 1 174 174 LYS CB C 174 32.790 32.790 33.512 -0.722 25768 2597 1 3 . 1 1 174 174 LYS H H 174 8.180 8.180 8.274 -0.094 25768 2598 1 3 . 1 1 175 175 ALA N N 175 124.050 124.050 122.649 1.401 25768 2599 1 3 . 1 1 175 175 ALA C C 175 177.550 177.550 176.913 0.637 25768 2600 1 3 . 1 1 175 175 ALA CA C 175 52.840 52.840 51.512 1.328 25768 2601 1 3 . 1 1 175 175 ALA CB C 175 19.580 19.580 19.828 -0.248 25768 2602 1 3 . 1 1 175 175 ALA H H 175 8.050 8.050 7.781 0.269 25768 2603 1 3 . 1 1 176 176 SER N N 176 114.920 114.920 114.702 0.218 25768 2604 1 3 . 1 1 176 176 SER C C 176 174.240 174.240 175.217 -0.977 25768 2605 1 3 . 1 1 176 176 SER CA C 176 58.390 58.390 58.604 -0.214 25768 2606 1 3 . 1 1 176 176 SER CB C 176 64.370 64.370 63.276 1.095 25768 2607 1 3 . 1 1 176 176 SER H H 176 8.070 8.070 8.540 -0.470 25768 2608 1 3 . 1 1 177 177 ILE N N 177 121.650 121.650 121.685 -0.035 25768 2609 1 3 . 1 1 177 177 ILE C C 177 174.990 174.990 174.858 0.132 25768 2610 1 3 . 1 1 177 177 ILE CA C 177 61.570 61.570 61.001 0.569 25768 2611 1 3 . 1 1 177 177 ILE CB C 177 39.100 39.100 38.394 0.706 25768 2612 1 3 . 1 1 177 177 ILE H H 177 7.960 7.960 7.641 0.319 25768 2613 1 3 . 1 1 178 178 ASN N N 178 127.040 127.040 122.175 4.865 25768 2614 1 3 . 1 1 178 178 ASN C C 178 179.160 179.160 175.040 4.120 25768 2615 1 3 . 1 1 178 178 ASN CA C 178 55.100 55.100 53.420 1.680 25768 2616 1 3 . 1 1 178 178 ASN CB C 178 41.300 41.300 38.747 2.553 25768 2617 1 3 . 1 1 178 178 ASN H H 178 7.850 7.850 8.560 -0.710 25768 2618 1 3 . 1 1 180 180 PRO C C 180 177.520 177.520 176.312 1.208 25768 2619 1 3 . 1 1 180 180 PRO CA C 180 63.980 63.980 62.990 0.990 25768 2620 1 3 . 1 1 180 180 PRO CB C 180 32.190 32.190 31.921 0.269 25768 2621 1 3 . 1 1 181 181 SER N N 181 115.600 115.600 119.569 -3.969 25768 2622 1 3 . 1 1 181 181 SER C C 181 174.710 174.710 174.146 0.564 25768 2623 1 3 . 1 1 181 181 SER CA C 181 58.900 58.900 58.125 0.775 25768 2624 1 3 . 1 1 181 181 SER CB C 181 64.070 64.070 64.389 -0.319 25768 2625 1 3 . 1 1 181 181 SER H H 181 8.260 8.260 8.457 -0.197 25768 2626 1 3 . 1 1 182 182 ALA N N 182 125.880 125.880 125.177 0.703 25768 2627 1 3 . 1 1 182 182 ALA C C 182 177.560 177.560 176.374 1.186 25768 2628 1 3 . 1 1 182 182 ALA CA C 182 53.090 53.090 52.364 0.726 25768 2629 1 3 . 1 1 182 182 ALA CB C 182 19.310 19.310 17.909 1.401 25768 2630 1 3 . 1 1 182 182 ALA H H 182 8.130 8.130 8.275 -0.145 25768 2631 1 3 . 1 1 183 183 LEU N N 183 119.980 119.980 122.328 -2.348 25768 2632 1 3 . 1 1 183 183 LEU C C 183 177.850 177.850 178.197 -0.347 25768 2633 1 3 . 1 1 183 183 LEU CA C 183 55.650 55.650 54.669 0.981 25768 2634 1 3 . 1 1 183 183 LEU CB C 183 42.530 42.530 42.878 -0.348 25768 2635 1 3 . 1 1 183 183 LEU H H 183 7.940 7.940 7.953 -0.013 25768 2636 1 3 . 1 1 184 184 GLY N N 184 109.250 109.250 108.662 0.588 25768 2637 1 3 . 1 1 184 184 GLY C C 184 174.250 174.250 174.037 0.213 25768 2638 1 3 . 1 1 184 184 GLY CA C 184 45.830 45.830 45.211 0.619 25768 2639 1 3 . 1 1 184 184 GLY H H 184 8.150 8.150 8.315 -0.165 25768 2640 1 3 . 1 1 185 185 VAL N N 185 118.830 118.830 119.403 -0.573 25768 2641 1 3 . 1 1 185 185 VAL C C 185 175.890 175.890 175.583 0.307 25768 2642 1 3 . 1 1 185 185 VAL CA C 185 62.740 62.740 62.121 0.619 25768 2643 1 3 . 1 1 185 185 VAL CB C 185 32.770 32.770 32.474 0.296 25768 2644 1 3 . 1 1 185 185 VAL H H 185 7.760 7.760 8.225 -0.465 25768 2645 1 3 . 1 1 186 186 ASN N N 186 121.850 121.850 117.853 3.997 25768 2646 1 3 . 1 1 186 186 ASN C C 186 174.970 174.970 174.136 0.834 25768 2647 1 3 . 1 1 186 186 ASN CA C 186 53.590 53.590 54.105 -0.515 25768 2648 1 3 . 1 1 186 186 ASN CB C 186 39.160 39.160 38.668 0.492 25768 2649 1 3 . 1 1 186 186 ASN H H 186 8.380 8.380 8.169 0.211 25768 2650 1 3 . 1 1 187 187 LYS N N 187 122.120 122.120 120.064 2.056 25768 2651 1 3 . 1 1 187 187 LYS C C 187 176.490 176.490 175.077 1.413 25768 2652 1 3 . 1 1 187 187 LYS CA C 187 56.750 56.750 55.708 1.042 25768 2653 1 3 . 1 1 187 187 LYS CB C 187 33.250 33.250 33.593 -0.343 25768 2654 1 3 . 1 1 187 187 LYS H H 187 8.140 8.140 8.345 -0.205 25768 2655 1 3 . 1 1 188 188 THR N N 188 115.250 115.250 113.149 2.101 25768 2656 1 3 . 1 1 188 188 THR C C 188 174.250 174.250 173.354 0.896 25768 2657 1 3 . 1 1 188 188 THR CA C 188 62.360 62.360 63.218 -0.858 25768 2658 1 3 . 1 1 188 188 THR CB C 188 70.280 70.280 68.231 2.049 25768 2659 1 3 . 1 1 188 188 THR H H 188 8.100 8.100 8.700 -0.600 25768 2660 1 3 . 1 1 189 189 LYS N N 189 123.780 123.780 123.717 0.063 25768 2661 1 3 . 1 1 189 189 LYS C C 189 176.090 176.090 175.111 0.979 25768 2662 1 3 . 1 1 189 189 LYS CA C 189 56.590 56.590 55.679 0.911 25768 2663 1 3 . 1 1 189 189 LYS CB C 189 33.350 33.350 34.778 -1.427 25768 2664 1 3 . 1 1 189 189 LYS H H 189 8.110 8.110 8.102 0.008 25768 2665 1 3 . 1 1 190 190 VAL N N 190 120.920 120.920 117.777 3.143 25768 2666 1 3 . 1 1 190 190 VAL C C 190 175.590 175.590 175.018 0.572 25768 2667 1 3 . 1 1 190 190 VAL CA C 190 62.400 62.400 60.717 1.683 25768 2668 1 3 . 1 1 190 190 VAL CB C 190 32.990 32.990 33.528 -0.538 25768 2669 1 3 . 1 1 190 190 VAL H H 190 8.040 8.040 8.296 -0.256 25768 2670 1 3 . 1 1 191 191 ASP N N 191 123.790 123.790 120.363 3.427 25768 2671 1 3 . 1 1 191 191 ASP C C 191 175.750 175.750 176.544 -0.794 25768 2672 1 3 . 1 1 191 191 ASP CA C 191 54.650 54.650 55.480 -0.830 25768 2673 1 3 . 1 1 191 191 ASP CB C 191 41.450 41.450 42.002 -0.552 25768 2674 1 3 . 1 1 191 191 ASP H H 191 8.240 8.240 8.522 -0.282 25768 2675 1 3 . 1 1 192 192 VAL N N 192 118.850 118.850 118.604 0.246 25768 2676 1 3 . 1 1 192 192 VAL C C 192 175.380 175.380 176.015 -0.635 25768 2677 1 3 . 1 1 192 192 VAL CA C 192 62.110 62.110 63.078 -0.968 25768 2678 1 3 . 1 1 192 192 VAL CB C 192 33.290 33.290 32.837 0.453 25768 2679 1 3 . 1 1 192 192 VAL H H 192 7.860 7.860 8.058 -0.198 25768 2680 1 3 . 1 1 193 193 ASP N N 193 124.190 124.190 117.821 6.369 25768 2681 1 3 . 1 1 193 193 ASP C C 193 175.630 175.630 175.075 0.555 25768 2682 1 3 . 1 1 193 193 ASP CA C 193 54.540 54.540 54.731 -0.191 25768 2683 1 3 . 1 1 193 193 ASP CB C 193 41.410 41.410 43.398 -1.988 25768 2684 1 3 . 1 1 193 193 ASP H H 193 8.310 8.310 8.218 0.092 25768 2685 1 3 . 1 1 194 194 VAL N N 194 119.580 119.580 120.816 -1.236 25768 2686 1 3 . 1 1 194 194 VAL C C 194 174.950 174.950 173.798 1.152 25768 2687 1 3 . 1 1 194 194 VAL CA C 194 61.770 61.770 62.003 -0.233 25768 2688 1 3 . 1 1 194 194 VAL CB C 194 33.680 33.680 34.552 -0.872 25768 2689 1 3 . 1 1 194 194 VAL H H 194 7.890 7.890 7.866 0.024 25768 2690 1 3 . 1 1 195 195 ASP N N 195 125.660 125.660 127.749 -2.089 25768 2691 1 3 . 1 1 195 195 ASP C C 195 174.290 174.290 173.540 0.750 25768 2692 1 3 . 1 1 195 195 ASP CA C 195 51.940 51.940 52.639 -0.699 25768 2693 1 3 . 1 1 195 195 ASP CB C 195 40.950 40.950 41.712 -0.762 25768 2694 1 3 . 1 1 195 195 ASP H H 195 8.410 8.410 8.451 -0.041 25768 2695 1 3 . 1 1 198 198 VAL C C 198 173.940 173.940 174.953 -1.013 25768 2696 1 3 . 1 1 198 198 VAL CA C 198 61.270 61.270 61.503 -0.233 25768 2697 1 3 . 1 1 198 198 VAL CB C 198 35.910 35.910 32.609 3.301 25768 2698 1 3 . 1 1 199 199 TYR N N 199 123.780 123.780 126.373 -2.593 25768 2699 1 3 . 1 1 199 199 TYR C C 199 174.150 174.150 174.523 -0.373 25768 2700 1 3 . 1 1 199 199 TYR CA C 199 56.220 56.220 56.904 -0.684 25768 2701 1 3 . 1 1 199 199 TYR CB C 199 41.660 41.660 42.069 -0.409 25768 2702 1 3 . 1 1 199 199 TYR H H 199 8.540 8.540 8.419 0.121 25768 2703 1 3 . 1 1 200 200 MET N N 200 123.920 123.920 123.752 0.168 25768 2704 1 3 . 1 1 200 200 MET C C 200 173.810 173.810 174.650 -0.840 25768 2705 1 3 . 1 1 200 200 MET CA C 200 54.710 54.710 54.285 0.424 25768 2706 1 3 . 1 1 200 200 MET CB C 200 37.110 37.110 34.647 2.463 25768 2707 1 3 . 1 1 200 200 MET H H 200 9.130 9.130 8.269 0.861 25768 2708 1 3 . 1 1 201 201 ILE N N 201 123.670 123.670 120.694 2.976 25768 2709 1 3 . 1 1 201 201 ILE C C 201 174.030 174.030 174.222 -0.192 25768 2710 1 3 . 1 1 201 201 ILE CA C 201 59.820 59.820 58.813 1.007 25768 2711 1 3 . 1 1 201 201 ILE CB C 201 41.720 41.720 40.075 1.645 25768 2712 1 3 . 1 1 201 201 ILE H H 201 8.030 8.030 8.002 0.028 25768 2713 1 3 . 1 1 202 202 GLY N N 202 112.910 112.910 111.806 1.104 25768 2714 1 3 . 1 1 202 202 GLY C C 202 170.280 170.280 171.788 -1.508 25768 2715 1 3 . 1 1 202 202 GLY CA C 202 46.800 46.800 44.475 2.325 25768 2716 1 3 . 1 1 202 202 GLY H H 202 8.580 8.580 7.834 0.746 25768 2717 1 3 . 1 1 203 203 PHE N N 203 116.240 116.240 115.239 1.001 25768 2718 1 3 . 1 1 203 203 PHE C C 203 173.940 173.940 173.839 0.101 25768 2719 1 3 . 1 1 203 203 PHE CA C 203 55.890 55.890 54.352 1.538 25768 2720 1 3 . 1 1 203 203 PHE CB C 203 45.060 45.060 41.420 3.640 25768 2721 1 3 . 1 1 203 203 PHE H H 203 8.620 8.620 7.259 1.361 25768 2722 1 3 . 1 1 204 204 GLY N N 204 105.610 105.610 105.431 0.179 25768 2723 1 3 . 1 1 204 204 GLY C C 204 171.190 171.190 172.104 -0.914 25768 2724 1 3 . 1 1 204 204 GLY CA C 204 46.720 46.720 44.012 2.708 25768 2725 1 3 . 1 1 204 204 GLY H H 204 8.960 8.960 8.822 0.138 25768 2726 1 3 . 1 1 205 205 TYR N N 205 121.160 121.160 117.467 3.693 25768 2727 1 3 . 1 1 205 205 TYR C C 205 173.030 173.030 174.159 -1.129 25768 2728 1 3 . 1 1 205 205 TYR CA C 205 57.190 57.190 57.605 -0.415 25768 2729 1 3 . 1 1 205 205 TYR CB C 205 44.400 44.400 43.817 0.583 25768 2730 1 3 . 1 1 205 205 TYR H H 205 9.380 9.380 8.851 0.529 25768 2731 1 3 . 1 1 206 206 LYS N N 206 126.970 126.970 122.668 4.302 25768 2732 1 3 . 1 1 206 206 LYS C C 206 174.210 174.210 175.173 -0.963 25768 2733 1 3 . 1 1 206 206 LYS CA C 206 54.770 54.770 55.652 -0.882 25768 2734 1 3 . 1 1 206 206 LYS CB C 206 34.440 34.440 33.309 1.131 25768 2735 1 3 . 1 1 206 206 LYS H H 206 8.380 8.380 8.574 -0.194 25768 2736 1 3 . 1 1 207 207 PHE N N 207 126.330 126.330 126.245 0.085 25768 2737 1 3 . 1 1 207 207 PHE C C 207 175.020 175.020 174.861 0.159 25768 2738 1 3 . 1 1 207 207 PHE CA C 207 58.170 58.170 57.434 0.737 25768 2739 1 3 . 1 1 207 207 PHE CB C 207 40.920 40.920 41.187 -0.267 25768 2740 1 3 . 1 1 207 207 PHE H H 207 9.290 9.290 8.383 0.907 25768 2741 1 3 . 1 1 208 208 LEU N N 208 122.740 122.740 124.252 -1.512 25768 2742 1 3 . 1 1 208 208 LEU C C 208 176.510 176.510 176.850 -0.340 25768 2743 1 3 . 1 1 208 208 LEU CA C 208 54.910 54.910 55.091 -0.181 25768 2744 1 3 . 1 1 208 208 LEU CB C 208 43.830 43.830 42.890 0.940 25768 2745 1 3 . 1 1 208 208 LEU H H 208 8.310 8.310 8.219 0.091 25768 2746 1 4 . 1 1 2 2 HIS C C 2 175.310 175.310 173.862 1.448 25768 2747 1 4 . 1 1 3 3 LYS N N 3 122.080 122.080 121.460 0.620 25768 2748 1 4 . 1 1 3 3 LYS C C 3 173.490 173.490 174.747 -1.257 25768 2749 1 4 . 1 1 3 3 LYS CA C 3 55.050 55.050 55.874 -0.824 25768 2750 1 4 . 1 1 3 3 LYS CB C 3 35.380 35.380 35.480 -0.100 25768 2751 1 4 . 1 1 3 3 LYS H H 3 8.620 8.620 8.526 0.094 25768 2752 1 4 . 1 1 4 4 ALA N N 4 120.860 120.860 123.710 -2.850 25768 2753 1 4 . 1 1 4 4 ALA C C 4 178.190 178.190 177.687 0.503 25768 2754 1 4 . 1 1 4 4 ALA CA C 4 53.480 53.480 52.167 1.313 25768 2755 1 4 . 1 1 4 4 ALA CB C 4 18.140 18.140 18.901 -0.761 25768 2756 1 4 . 1 1 4 4 ALA H H 4 8.580 8.580 8.509 0.071 25768 2757 1 4 . 1 1 5 5 GLY N N 5 112.890 112.890 112.799 0.091 25768 2758 1 4 . 1 1 5 5 GLY C C 5 173.830 173.830 173.577 0.253 25768 2759 1 4 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.272 0.608 25768 2760 1 4 . 1 1 5 5 GLY H H 5 9.210 9.210 8.244 0.966 25768 2761 1 4 . 1 1 6 6 ASP N N 6 121.590 121.590 120.780 0.810 25768 2762 1 4 . 1 1 6 6 ASP C C 6 174.380 174.380 175.028 -0.648 25768 2763 1 4 . 1 1 6 6 ASP CA C 6 55.790 55.790 55.184 0.605 25768 2764 1 4 . 1 1 6 6 ASP CB C 6 41.760 41.760 42.200 -0.440 25768 2765 1 4 . 1 1 6 6 ASP H H 6 7.620 7.620 7.423 0.197 25768 2766 1 4 . 1 1 7 7 PHE N N 7 120.860 120.860 121.164 -0.304 25768 2767 1 4 . 1 1 7 7 PHE C C 7 174.050 174.050 174.475 -0.425 25768 2768 1 4 . 1 1 7 7 PHE CA C 7 56.110 56.110 58.091 -1.981 25768 2769 1 4 . 1 1 7 7 PHE CB C 7 42.550 42.550 39.985 2.565 25768 2770 1 4 . 1 1 7 7 PHE H H 7 8.250 8.250 8.858 -0.608 25768 2771 1 4 . 1 1 8 8 ILE N N 8 127.950 127.950 122.854 5.096 25768 2772 1 4 . 1 1 8 8 ILE C C 8 174.000 174.000 174.193 -0.193 25768 2773 1 4 . 1 1 8 8 ILE CA C 8 61.160 61.160 58.823 2.337 25768 2774 1 4 . 1 1 8 8 ILE CB C 8 42.660 42.660 39.796 2.864 25768 2775 1 4 . 1 1 8 8 ILE H H 8 9.230 9.230 7.664 1.566 25768 2776 1 4 . 1 1 9 9 ILE N N 9 125.380 125.380 126.502 -1.122 25768 2777 1 4 . 1 1 9 9 ILE C C 9 173.630 173.630 174.750 -1.120 25768 2778 1 4 . 1 1 9 9 ILE CA C 9 59.600 59.600 60.292 -0.692 25768 2779 1 4 . 1 1 9 9 ILE CB C 9 41.180 41.180 41.553 -0.373 25768 2780 1 4 . 1 1 9 9 ILE H H 9 8.580 8.580 8.091 0.489 25768 2781 1 4 . 1 1 10 10 ARG N N 10 124.950 124.950 124.509 0.441 25768 2782 1 4 . 1 1 10 10 ARG C C 10 175.030 175.030 173.946 1.084 25768 2783 1 4 . 1 1 10 10 ARG CA C 10 53.920 53.920 54.620 -0.700 25768 2784 1 4 . 1 1 10 10 ARG CB C 10 31.880 31.880 35.283 -3.403 25768 2785 1 4 . 1 1 10 10 ARG H H 10 9.230 9.230 8.825 0.405 25768 2786 1 4 . 1 1 11 11 GLY N N 11 105.650 105.650 108.542 -2.892 25768 2787 1 4 . 1 1 11 11 GLY C C 11 172.090 172.090 171.430 0.660 25768 2788 1 4 . 1 1 11 11 GLY CA C 11 44.460 44.460 45.421 -0.961 25768 2789 1 4 . 1 1 11 11 GLY H H 11 8.780 8.780 8.518 0.262 25768 2790 1 4 . 1 1 12 12 GLY N N 12 107.800 107.800 108.368 -0.568 25768 2791 1 4 . 1 1 12 12 GLY C C 12 171.460 171.460 171.255 0.205 25768 2792 1 4 . 1 1 12 12 GLY CA C 12 46.630 46.630 44.902 1.728 25768 2793 1 4 . 1 1 12 12 GLY H H 12 8.510 8.510 8.356 0.154 25768 2794 1 4 . 1 1 13 13 PHE N N 13 119.900 119.900 116.992 2.908 25768 2795 1 4 . 1 1 13 13 PHE C C 13 174.190 174.190 173.808 0.382 25768 2796 1 4 . 1 1 13 13 PHE CA C 13 56.340 56.340 56.657 -0.317 25768 2797 1 4 . 1 1 13 13 PHE CB C 13 41.090 41.090 43.843 -2.753 25768 2798 1 4 . 1 1 13 13 PHE H H 13 8.610 8.610 8.728 -0.118 25768 2799 1 4 . 1 1 14 14 ALA N N 14 128.030 128.030 122.504 5.526 25768 2800 1 4 . 1 1 14 14 ALA C C 14 176.560 176.560 176.999 -0.439 25768 2801 1 4 . 1 1 14 14 ALA CA C 14 49.940 49.940 50.761 -0.821 25768 2802 1 4 . 1 1 14 14 ALA CB C 14 20.360 20.360 21.226 -0.866 25768 2803 1 4 . 1 1 14 14 ALA H H 14 9.220 9.220 9.013 0.207 25768 2804 1 4 . 1 1 15 15 THR N N 15 118.620 118.620 121.692 -3.072 25768 2805 1 4 . 1 1 15 15 THR CA C 15 61.440 61.440 62.077 -0.637 25768 2806 1 4 . 1 1 15 15 THR CB C 15 71.370 71.370 69.462 1.908 25768 2807 1 4 . 1 1 15 15 THR H H 15 9.220 9.220 8.353 0.867 25768 2808 1 4 . 1 1 18 18 PRO C C 18 176.690 176.690 176.358 0.332 25768 2809 1 4 . 1 1 18 18 PRO CA C 18 63.610 63.610 63.885 -0.275 25768 2810 1 4 . 1 1 18 18 PRO CB C 18 32.440 32.440 32.238 0.202 25768 2811 1 4 . 1 1 19 19 ASP N N 19 120.320 120.320 116.217 4.103 25768 2812 1 4 . 1 1 19 19 ASP C C 19 175.950 175.950 175.263 0.687 25768 2813 1 4 . 1 1 19 19 ASP CA C 19 54.710 54.710 52.893 1.817 25768 2814 1 4 . 1 1 19 19 ASP CB C 19 41.450 41.450 43.668 -2.218 25768 2815 1 4 . 1 1 19 19 ASP H H 19 8.330 8.330 7.495 0.835 25768 2816 1 4 . 1 1 20 20 ASP N N 20 121.990 121.990 119.050 2.940 25768 2817 1 4 . 1 1 20 20 ASP C C 20 176.760 176.760 176.666 0.094 25768 2818 1 4 . 1 1 20 20 ASP CA C 20 54.470 54.470 55.880 -1.410 25768 2819 1 4 . 1 1 20 20 ASP CB C 20 41.310 41.310 41.309 0.001 25768 2820 1 4 . 1 1 20 20 ASP H H 20 8.240 8.240 8.368 -0.128 25768 2821 1 4 . 1 1 21 21 SER N N 21 117.050 117.050 111.799 5.251 25768 2822 1 4 . 1 1 21 21 SER C C 21 175.170 175.170 174.305 0.865 25768 2823 1 4 . 1 1 21 21 SER CA C 21 59.490 59.490 58.347 1.143 25768 2824 1 4 . 1 1 21 21 SER CB C 21 64.080 64.080 64.464 -0.384 25768 2825 1 4 . 1 1 21 21 SER H H 21 8.360 8.360 7.604 0.756 25768 2826 1 4 . 1 1 22 22 SER N N 22 117.820 117.820 117.201 0.619 25768 2827 1 4 . 1 1 22 22 SER C C 22 174.940 174.940 173.184 1.756 25768 2828 1 4 . 1 1 22 22 SER CA C 22 59.160 59.160 59.309 -0.149 25768 2829 1 4 . 1 1 22 22 SER CB C 22 64.110 64.110 62.708 1.402 25768 2830 1 4 . 1 1 22 22 SER H H 22 8.310 8.310 8.544 -0.234 25768 2831 1 4 . 1 1 23 23 SER N N 23 117.660 117.660 115.183 2.477 25768 2832 1 4 . 1 1 23 23 SER C C 23 174.340 174.340 172.675 1.665 25768 2833 1 4 . 1 1 23 23 SER CA C 23 59.050 59.050 57.560 1.490 25768 2834 1 4 . 1 1 23 23 SER CB C 23 64.210 64.210 65.239 -1.029 25768 2835 1 4 . 1 1 23 23 SER H H 23 8.120 8.120 7.721 0.399 25768 2836 1 4 . 1 1 24 24 ASP N N 24 122.590 122.590 121.094 1.496 25768 2837 1 4 . 1 1 24 24 ASP C C 24 176.250 176.250 175.634 0.616 25768 2838 1 4 . 1 1 24 24 ASP CA C 24 54.910 54.910 53.747 1.163 25768 2839 1 4 . 1 1 24 24 ASP CB C 24 41.270 41.270 41.697 -0.427 25768 2840 1 4 . 1 1 24 24 ASP H H 24 8.230 8.230 8.526 -0.296 25768 2841 1 4 . 1 1 25 25 ILE N N 25 120.650 120.650 122.225 -1.575 25768 2842 1 4 . 1 1 25 25 ILE C C 25 176.190 176.190 174.815 1.375 25768 2843 1 4 . 1 1 25 25 ILE CA C 25 61.880 61.880 60.914 0.966 25768 2844 1 4 . 1 1 25 25 ILE CB C 25 38.730 38.730 37.395 1.335 25768 2845 1 4 . 1 1 25 25 ILE H H 25 7.860 7.860 8.522 -0.662 25768 2846 1 4 . 1 1 26 26 LYS N N 26 124.420 124.420 121.012 3.408 25768 2847 1 4 . 1 1 26 26 LYS C C 26 176.640 176.640 175.420 1.220 25768 2848 1 4 . 1 1 26 26 LYS CA C 26 56.520 56.520 55.675 0.845 25768 2849 1 4 . 1 1 26 26 LYS CB C 26 32.890 32.890 34.786 -1.896 25768 2850 1 4 . 1 1 26 26 LYS H H 26 8.140 8.140 7.396 0.744 25768 2851 1 4 . 1 1 27 27 LEU N N 27 123.120 123.120 121.308 1.812 25768 2852 1 4 . 1 1 27 27 LEU C C 27 177.110 177.110 175.281 1.829 25768 2853 1 4 . 1 1 27 27 LEU CA C 27 55.590 55.590 56.310 -0.720 25768 2854 1 4 . 1 1 27 27 LEU CB C 27 42.500 42.500 42.125 0.375 25768 2855 1 4 . 1 1 27 27 LEU H H 27 8.080 8.080 8.486 -0.406 25768 2856 1 4 . 1 1 28 28 ASP N N 28 120.850 120.850 116.515 4.335 25768 2857 1 4 . 1 1 28 28 ASP C C 28 176.960 176.960 175.224 1.736 25768 2858 1 4 . 1 1 28 28 ASP CA C 28 54.800 54.800 55.209 -0.409 25768 2859 1 4 . 1 1 28 28 ASP CB C 28 41.380 41.380 40.729 0.651 25768 2860 1 4 . 1 1 28 28 ASP H H 28 8.180 8.180 8.366 -0.186 25768 2861 1 4 . 1 1 29 29 GLY N N 29 109.800 109.800 105.760 4.040 25768 2862 1 4 . 1 1 29 29 GLY C C 29 174.370 174.370 174.590 -0.220 25768 2863 1 4 . 1 1 29 29 GLY CA C 29 46.150 46.150 45.081 1.069 25768 2864 1 4 . 1 1 29 29 GLY H H 29 8.230 8.230 8.695 -0.465 25768 2865 1 4 . 1 1 30 30 ALA N N 30 123.880 123.880 122.390 1.490 25768 2866 1 4 . 1 1 30 30 ALA C C 30 178.040 178.040 176.971 1.069 25768 2867 1 4 . 1 1 30 30 ALA CA C 30 53.140 53.140 52.222 0.918 25768 2868 1 4 . 1 1 30 30 ALA CB C 30 19.350 19.350 17.155 2.195 25768 2869 1 4 . 1 1 30 30 ALA H H 30 8.040 8.040 8.093 -0.053 25768 2870 1 4 . 1 1 31 31 LYS N N 31 119.800 119.800 119.721 0.079 25768 2871 1 4 . 1 1 31 31 LYS C C 31 176.770 176.770 176.756 0.014 25768 2872 1 4 . 1 1 31 31 LYS CA C 31 56.870 56.870 55.913 0.957 25768 2873 1 4 . 1 1 31 31 LYS CB C 31 32.980 32.980 33.398 -0.418 25768 2874 1 4 . 1 1 31 31 LYS H H 31 8.060 8.060 7.872 0.188 25768 2875 1 4 . 1 1 32 32 GLN N N 32 120.930 120.930 120.715 0.215 25768 2876 1 4 . 1 1 32 32 GLN C C 32 176.000 176.000 175.798 0.202 25768 2877 1 4 . 1 1 32 32 GLN CA C 32 56.280 56.280 56.941 -0.661 25768 2878 1 4 . 1 1 32 32 GLN CB C 32 29.580 29.580 29.321 0.259 25768 2879 1 4 . 1 1 32 32 GLN H H 32 8.170 8.170 8.495 -0.325 25768 2880 1 4 . 1 1 33 33 ARG N N 33 122.370 122.370 121.555 0.815 25768 2881 1 4 . 1 1 33 33 ARG C C 33 176.820 176.820 174.780 2.040 25768 2882 1 4 . 1 1 33 33 ARG CA C 33 56.680 56.680 56.229 0.451 25768 2883 1 4 . 1 1 33 33 ARG CB C 33 31.040 31.040 30.006 1.034 25768 2884 1 4 . 1 1 33 33 ARG H H 33 8.270 8.270 8.696 -0.426 25768 2885 1 4 . 1 1 34 34 GLY N N 34 110.210 110.210 112.607 -2.397 25768 2886 1 4 . 1 1 34 34 GLY C C 34 174.280 174.280 173.702 0.578 25768 2887 1 4 . 1 1 34 34 GLY CA C 34 45.770 45.770 44.452 1.318 25768 2888 1 4 . 1 1 34 34 GLY H H 34 8.360 8.360 8.519 -0.159 25768 2889 1 4 . 1 1 35 35 THR N N 35 114.100 114.100 112.188 1.912 25768 2890 1 4 . 1 1 35 35 THR C C 35 174.550 174.550 173.837 0.713 25768 2891 1 4 . 1 1 35 35 THR CA C 35 62.140 62.140 63.051 -0.911 25768 2892 1 4 . 1 1 35 35 THR CB C 35 70.330 70.330 68.306 2.024 25768 2893 1 4 . 1 1 35 35 THR H H 35 7.970 7.970 8.139 -0.169 25768 2894 1 4 . 1 1 36 36 LYS N N 36 123.850 123.850 118.332 5.518 25768 2895 1 4 . 1 1 36 36 LYS C C 36 176.040 176.040 176.881 -0.841 25768 2896 1 4 . 1 1 36 36 LYS CA C 36 56.600 56.600 56.368 0.232 25768 2897 1 4 . 1 1 36 36 LYS CB C 36 33.280 33.280 33.209 0.071 25768 2898 1 4 . 1 1 36 36 LYS H H 36 8.230 8.230 7.895 0.335 25768 2899 1 4 . 1 1 37 37 ALA N N 37 125.650 125.650 127.138 -1.488 25768 2900 1 4 . 1 1 37 37 ALA C C 37 177.570 177.570 177.182 0.388 25768 2901 1 4 . 1 1 37 37 ALA CA C 37 52.860 52.860 53.092 -0.232 25768 2902 1 4 . 1 1 37 37 ALA CB C 37 19.610 19.610 18.862 0.748 25768 2903 1 4 . 1 1 37 37 ALA H H 37 8.290 8.290 8.508 -0.218 25768 2904 1 4 . 1 1 38 38 THR N N 38 113.350 113.350 111.639 1.711 25768 2905 1 4 . 1 1 38 38 THR C C 38 174.540 174.540 173.669 0.871 25768 2906 1 4 . 1 1 38 38 THR CA C 38 62.010 62.010 63.054 -1.044 25768 2907 1 4 . 1 1 38 38 THR CB C 38 70.350 70.350 68.013 2.337 25768 2908 1 4 . 1 1 38 38 THR H H 38 7.970 7.970 8.099 -0.129 25768 2909 1 4 . 1 1 39 39 VAL N N 39 120.790 120.790 121.939 -1.149 25768 2910 1 4 . 1 1 39 39 VAL C C 39 175.620 175.620 176.494 -0.874 25768 2911 1 4 . 1 1 39 39 VAL CA C 39 62.470 62.470 62.810 -0.340 25768 2912 1 4 . 1 1 39 39 VAL CB C 39 32.940 32.940 32.540 0.400 25768 2913 1 4 . 1 1 39 39 VAL H H 39 8.020 8.020 8.198 -0.178 25768 2914 1 4 . 1 1 40 40 ASP N N 40 123.690 123.690 120.538 3.152 25768 2915 1 4 . 1 1 40 40 ASP C C 40 176.190 176.190 176.158 0.032 25768 2916 1 4 . 1 1 40 40 ASP CA C 40 54.780 54.780 54.766 0.014 25768 2917 1 4 . 1 1 40 40 ASP CB C 40 41.590 41.590 40.649 0.941 25768 2918 1 4 . 1 1 40 40 ASP H H 40 8.310 8.310 8.517 -0.207 25768 2919 1 4 . 1 1 41 41 SER N N 41 115.470 115.470 115.142 0.328 25768 2920 1 4 . 1 1 41 41 SER C C 41 174.170 174.170 174.283 -0.113 25768 2921 1 4 . 1 1 41 41 SER CA C 41 59.000 59.000 58.436 0.564 25768 2922 1 4 . 1 1 41 41 SER CB C 41 64.420 64.420 64.107 0.313 25768 2923 1 4 . 1 1 41 41 SER H H 41 8.130 8.130 7.885 0.245 25768 2924 1 4 . 1 1 42 42 ASP N N 42 122.430 122.430 121.663 0.767 25768 2925 1 4 . 1 1 42 42 ASP C C 42 175.740 175.740 175.162 0.578 25768 2926 1 4 . 1 1 42 42 ASP CA C 42 54.780 54.780 53.925 0.855 25768 2927 1 4 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.444 -0.824 25768 2928 1 4 . 1 1 42 42 ASP H H 42 8.410 8.410 8.168 0.242 25768 2929 1 4 . 1 1 43 43 THR N N 43 117.580 117.580 116.566 1.014 25768 2930 1 4 . 1 1 43 43 THR C C 43 173.630 173.630 173.727 -0.097 25768 2931 1 4 . 1 1 43 43 THR CA C 43 63.120 63.120 61.241 1.879 25768 2932 1 4 . 1 1 43 43 THR CB C 43 70.650 70.650 70.400 0.250 25768 2933 1 4 . 1 1 43 43 THR H H 43 8.010 8.010 8.392 -0.382 25768 2934 1 4 . 1 1 44 44 GLN N N 44 125.420 125.420 124.444 0.976 25768 2935 1 4 . 1 1 44 44 GLN C C 44 174.080 174.080 175.021 -0.941 25768 2936 1 4 . 1 1 44 44 GLN CA C 44 55.110 55.110 55.008 0.102 25768 2937 1 4 . 1 1 44 44 GLN CB C 44 31.570 31.570 29.694 1.876 25768 2938 1 4 . 1 1 44 44 GLN H H 44 9.260 9.260 8.698 0.562 25768 2939 1 4 . 1 1 45 45 LEU N N 45 124.190 124.190 127.779 -3.589 25768 2940 1 4 . 1 1 45 45 LEU C C 45 175.970 175.970 176.195 -0.225 25768 2941 1 4 . 1 1 45 45 LEU CA C 45 54.690 54.690 55.524 -0.834 25768 2942 1 4 . 1 1 45 45 LEU CB C 45 42.270 42.270 43.041 -0.771 25768 2943 1 4 . 1 1 45 45 LEU H H 45 8.550 8.550 8.467 0.083 25768 2944 1 4 . 1 1 46 46 GLY N N 46 113.310 113.310 114.937 -1.627 25768 2945 1 4 . 1 1 46 46 GLY C C 46 171.180 171.180 172.622 -1.442 25768 2946 1 4 . 1 1 46 46 GLY CA C 46 44.400 44.400 43.886 0.514 25768 2947 1 4 . 1 1 46 46 GLY H H 46 8.810 8.810 8.657 0.153 25768 2948 1 4 . 1 1 47 47 LEU N N 47 123.890 123.890 128.065 -4.175 25768 2949 1 4 . 1 1 47 47 LEU C C 47 175.400 175.400 175.941 -0.541 25768 2950 1 4 . 1 1 47 47 LEU CA C 47 53.750 53.750 54.206 -0.457 25768 2951 1 4 . 1 1 47 47 LEU CB C 47 46.800 46.800 44.431 2.369 25768 2952 1 4 . 1 1 47 47 LEU H H 47 8.590 8.590 8.448 0.142 25768 2953 1 4 . 1 1 48 48 THR N N 48 111.210 111.210 118.453 -7.243 25768 2954 1 4 . 1 1 48 48 THR C C 48 172.520 172.520 172.890 -0.370 25768 2955 1 4 . 1 1 48 48 THR CA C 48 58.950 58.950 61.193 -2.243 25768 2956 1 4 . 1 1 48 48 THR CB C 48 72.360 72.360 71.647 0.713 25768 2957 1 4 . 1 1 48 48 THR H H 48 8.620 8.620 9.030 -0.410 25768 2958 1 4 . 1 1 49 49 PHE N N 49 118.810 118.810 126.753 -7.943 25768 2959 1 4 . 1 1 49 49 PHE C C 49 174.700 174.700 174.659 0.041 25768 2960 1 4 . 1 1 49 49 PHE CA C 49 55.080 55.080 56.520 -1.440 25768 2961 1 4 . 1 1 49 49 PHE CB C 49 42.360 42.360 42.429 -0.069 25768 2962 1 4 . 1 1 49 49 PHE H H 49 8.410 8.410 8.436 -0.026 25768 2963 1 4 . 1 1 50 50 THR N N 50 121.230 121.230 124.343 -3.113 25768 2964 1 4 . 1 1 50 50 THR C C 50 173.250 173.250 172.855 0.395 25768 2965 1 4 . 1 1 50 50 THR CA C 50 62.740 62.740 61.850 0.890 25768 2966 1 4 . 1 1 50 50 THR CB C 50 73.740 73.740 69.942 3.799 25768 2967 1 4 . 1 1 50 50 THR H H 50 9.330 9.330 8.287 1.043 25768 2968 1 4 . 1 1 51 51 TYR N N 51 126.010 126.010 127.301 -1.291 25768 2969 1 4 . 1 1 51 51 TYR C C 51 174.850 174.850 175.456 -0.606 25768 2970 1 4 . 1 1 51 51 TYR CA C 51 56.240 56.240 57.188 -0.948 25768 2971 1 4 . 1 1 51 51 TYR CB C 51 41.630 41.630 39.295 2.335 25768 2972 1 4 . 1 1 51 51 TYR H H 51 9.150 9.150 9.288 -0.138 25768 2973 1 4 . 1 1 52 52 MET N N 52 127.390 127.390 124.653 2.737 25768 2974 1 4 . 1 1 52 52 MET C C 52 174.490 174.490 174.462 0.028 25768 2975 1 4 . 1 1 52 52 MET CA C 52 52.450 52.450 56.234 -3.784 25768 2976 1 4 . 1 1 52 52 MET CB C 52 28.590 28.590 33.041 -4.451 25768 2977 1 4 . 1 1 52 52 MET H H 52 7.950 7.950 8.101 -0.151 25768 2978 1 4 . 1 1 53 53 PHE N N 53 123.830 123.830 126.861 -3.031 25768 2979 1 4 . 1 1 53 53 PHE C C 53 173.720 173.720 173.875 -0.155 25768 2980 1 4 . 1 1 53 53 PHE CA C 53 57.110 57.110 56.327 0.783 25768 2981 1 4 . 1 1 53 53 PHE CB C 53 39.420 39.420 41.220 -1.800 25768 2982 1 4 . 1 1 53 53 PHE H H 53 7.720 7.720 8.071 -0.351 25768 2983 1 4 . 1 1 54 54 ALA N N 54 125.650 125.650 128.327 -2.677 25768 2984 1 4 . 1 1 54 54 ALA C C 54 175.020 175.020 176.325 -1.305 25768 2985 1 4 . 1 1 54 54 ALA CA C 54 50.740 50.740 53.068 -2.328 25768 2986 1 4 . 1 1 54 54 ALA CB C 54 22.700 22.700 18.801 3.899 25768 2987 1 4 . 1 1 54 54 ALA H H 54 8.360 8.360 8.243 0.117 25768 2988 1 4 . 1 1 55 55 ASP N N 55 118.790 118.790 121.494 -2.704 25768 2989 1 4 . 1 1 55 55 ASP C C 55 174.780 174.780 175.689 -0.909 25768 2990 1 4 . 1 1 55 55 ASP CA C 55 58.590 58.590 54.291 4.299 25768 2991 1 4 . 1 1 55 55 ASP CB C 55 40.430 40.430 40.219 0.211 25768 2992 1 4 . 1 1 55 55 ASP H H 55 8.590 8.590 8.426 0.164 25768 2993 1 4 . 1 1 56 56 LYS N N 56 106.200 106.200 115.824 -9.624 25768 2994 1 4 . 1 1 56 56 LYS C C 56 174.940 174.940 175.334 -0.394 25768 2995 1 4 . 1 1 56 56 LYS CA C 56 55.260 55.260 56.275 -1.015 25768 2996 1 4 . 1 1 56 56 LYS CB C 56 34.510 34.510 34.527 -0.017 25768 2997 1 4 . 1 1 56 56 LYS H H 56 7.260 7.260 7.068 0.192 25768 2998 1 4 . 1 1 57 57 TRP N N 57 115.680 115.680 121.754 -6.074 25768 2999 1 4 . 1 1 57 57 TRP C C 57 173.940 173.940 175.595 -1.655 25768 3000 1 4 . 1 1 57 57 TRP CA C 57 55.410 55.410 57.268 -1.858 25768 3001 1 4 . 1 1 57 57 TRP CB C 57 34.470 34.470 31.248 3.222 25768 3002 1 4 . 1 1 57 57 TRP H H 57 6.570 6.570 8.015 -1.445 25768 3003 1 4 . 1 1 58 58 GLY N N 58 107.610 107.610 107.715 -0.105 25768 3004 1 4 . 1 1 58 58 GLY C C 58 172.730 172.730 171.735 0.995 25768 3005 1 4 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.736 -0.687 25768 3006 1 4 . 1 1 58 58 GLY H H 58 9.260 9.260 8.435 0.825 25768 3007 1 4 . 1 1 59 59 VAL N N 59 118.130 118.130 117.913 0.217 25768 3008 1 4 . 1 1 59 59 VAL C C 59 173.000 173.000 173.835 -0.835 25768 3009 1 4 . 1 1 59 59 VAL CA C 59 59.950 59.950 60.098 -0.148 25768 3010 1 4 . 1 1 59 59 VAL CB C 59 35.170 35.170 34.032 1.138 25768 3011 1 4 . 1 1 59 59 VAL H H 59 9.030 9.030 8.090 0.940 25768 3012 1 4 . 1 1 60 60 GLU N N 60 127.900 127.900 127.261 0.639 25768 3013 1 4 . 1 1 60 60 GLU C C 60 174.470 174.470 174.542 -0.072 25768 3014 1 4 . 1 1 60 60 GLU CA C 60 52.940 52.940 53.847 -0.908 25768 3015 1 4 . 1 1 60 60 GLU CB C 60 35.100 35.100 34.227 0.873 25768 3016 1 4 . 1 1 60 60 GLU H H 60 9.440 9.440 8.989 0.451 25768 3017 1 4 . 1 1 61 61 LEU N N 61 127.410 127.410 125.164 2.246 25768 3018 1 4 . 1 1 61 61 LEU C C 61 174.950 174.950 175.506 -0.556 25768 3019 1 4 . 1 1 61 61 LEU CA C 61 53.390 53.390 54.291 -0.901 25768 3020 1 4 . 1 1 61 61 LEU CB C 61 45.980 45.980 45.448 0.532 25768 3021 1 4 . 1 1 61 61 LEU H H 61 8.740 8.740 8.398 0.342 25768 3022 1 4 . 1 1 62 62 VAL N N 62 125.750 125.750 121.208 4.542 25768 3023 1 4 . 1 1 62 62 VAL C C 62 173.960 173.960 174.060 -0.100 25768 3024 1 4 . 1 1 62 62 VAL CA C 62 61.350 61.350 61.016 0.334 25768 3025 1 4 . 1 1 62 62 VAL CB C 62 34.740 34.740 33.616 1.124 25768 3026 1 4 . 1 1 62 62 VAL H H 62 8.790 8.790 8.501 0.289 25768 3027 1 4 . 1 1 63 63 ALA N N 63 127.230 127.230 127.918 -0.688 25768 3028 1 4 . 1 1 63 63 ALA C C 63 173.930 173.930 175.297 -1.367 25768 3029 1 4 . 1 1 63 63 ALA CA C 63 51.140 51.140 50.814 0.326 25768 3030 1 4 . 1 1 63 63 ALA CB C 63 22.500 22.500 22.639 -0.139 25768 3031 1 4 . 1 1 63 63 ALA H H 63 8.740 8.740 8.587 0.153 25768 3032 1 4 . 1 1 64 64 ALA N N 64 120.410 120.410 122.931 -2.521 25768 3033 1 4 . 1 1 64 64 ALA C C 64 176.770 176.770 177.100 -0.330 25768 3034 1 4 . 1 1 64 64 ALA CA C 64 51.420 51.420 50.345 1.075 25768 3035 1 4 . 1 1 64 64 ALA CB C 64 22.590 22.590 21.886 0.704 25768 3036 1 4 . 1 1 64 64 ALA H H 64 8.290 8.290 8.233 0.057 25768 3037 1 4 . 1 1 65 65 THR N N 65 116.130 116.130 114.629 1.501 25768 3038 1 4 . 1 1 65 65 THR C C 65 171.220 171.220 173.116 -1.896 25768 3039 1 4 . 1 1 65 65 THR CA C 65 58.860 58.860 60.386 -1.526 25768 3040 1 4 . 1 1 65 65 THR CB C 65 72.020 72.020 68.763 3.257 25768 3041 1 4 . 1 1 65 65 THR H H 65 8.760 8.760 8.351 0.409 25768 3042 1 4 . 1 1 66 66 PRO C C 66 176.720 176.720 175.401 1.319 25768 3043 1 4 . 1 1 66 66 PRO CA C 66 63.610 63.610 62.770 0.840 25768 3044 1 4 . 1 1 66 66 PRO CB C 66 32.550 32.550 32.576 -0.026 25768 3045 1 4 . 1 1 67 67 PHE N N 67 120.360 120.360 116.324 4.036 25768 3046 1 4 . 1 1 67 67 PHE C C 67 175.480 175.480 174.825 0.655 25768 3047 1 4 . 1 1 67 67 PHE CA C 67 58.840 58.840 57.630 1.210 25768 3048 1 4 . 1 1 67 67 PHE CB C 67 40.170 40.170 39.856 0.314 25768 3049 1 4 . 1 1 67 67 PHE H H 67 8.590 8.590 8.429 0.161 25768 3050 1 4 . 1 1 68 68 ASN N N 68 119.030 119.030 119.803 -0.773 25768 3051 1 4 . 1 1 68 68 ASN C C 68 174.740 174.740 175.700 -0.960 25768 3052 1 4 . 1 1 68 68 ASN CA C 68 53.430 53.430 53.688 -0.258 25768 3053 1 4 . 1 1 68 68 ASN CB C 68 39.420 39.420 39.184 0.236 25768 3054 1 4 . 1 1 68 68 ASN H H 68 8.340 8.340 8.314 0.026 25768 3055 1 4 . 1 1 69 69 HIS N N 69 119.590 119.590 118.788 0.802 25768 3056 1 4 . 1 1 69 69 HIS C C 69 174.370 174.370 175.017 -0.647 25768 3057 1 4 . 1 1 69 69 HIS CA C 69 55.950 55.950 56.430 -0.480 25768 3058 1 4 . 1 1 69 69 HIS CB C 69 29.960 29.960 30.893 -0.933 25768 3059 1 4 . 1 1 69 69 HIS H H 69 8.350 8.350 8.862 -0.512 25768 3060 1 4 . 1 1 70 70 GLN N N 70 121.980 121.980 119.335 2.645 25768 3061 1 4 . 1 1 70 70 GLN C C 70 175.740 175.740 174.149 1.591 25768 3062 1 4 . 1 1 70 70 GLN CA C 70 56.340 56.340 55.592 0.748 25768 3063 1 4 . 1 1 70 70 GLN CB C 70 29.660 29.660 31.154 -1.494 25768 3064 1 4 . 1 1 70 70 GLN H H 70 8.350 8.350 8.183 0.167 25768 3065 1 4 . 1 1 71 71 VAL N N 71 120.530 120.530 123.506 -2.976 25768 3066 1 4 . 1 1 71 71 VAL C C 71 175.500 175.500 173.727 1.773 25768 3067 1 4 . 1 1 71 71 VAL CA C 71 62.540 62.540 62.141 0.400 25768 3068 1 4 . 1 1 71 71 VAL CB C 71 33.090 33.090 32.746 0.344 25768 3069 1 4 . 1 1 71 71 VAL H H 71 8.020 8.020 8.359 -0.339 25768 3070 1 4 . 1 1 72 72 ASP N N 72 123.910 123.910 126.902 -2.992 25768 3071 1 4 . 1 1 72 72 ASP C C 72 176.300 176.300 175.900 0.400 25768 3072 1 4 . 1 1 72 72 ASP CA C 72 54.340 54.340 53.486 0.854 25768 3073 1 4 . 1 1 72 72 ASP CB C 72 41.480 41.480 42.077 -0.597 25768 3074 1 4 . 1 1 72 72 ASP H H 72 8.280 8.280 8.223 0.057 25768 3075 1 4 . 1 1 73 73 VAL N N 73 120.580 120.580 117.469 3.111 25768 3076 1 4 . 1 1 73 73 VAL C C 73 176.350 176.350 176.610 -0.260 25768 3077 1 4 . 1 1 73 73 VAL CA C 73 62.970 62.970 63.330 -0.360 25768 3078 1 4 . 1 1 73 73 VAL CB C 73 32.550 32.550 31.517 1.033 25768 3079 1 4 . 1 1 73 73 VAL H H 73 7.960 7.960 8.245 -0.285 25768 3080 1 4 . 1 1 74 74 LYS N N 74 123.620 123.620 122.779 0.841 25768 3081 1 4 . 1 1 74 74 LYS C C 74 177.130 177.130 176.466 0.664 25768 3082 1 4 . 1 1 74 74 LYS CA C 74 57.060 57.060 56.465 0.596 25768 3083 1 4 . 1 1 74 74 LYS CB C 74 32.860 32.860 32.433 0.427 25768 3084 1 4 . 1 1 74 74 LYS H H 74 8.230 8.230 7.907 0.323 25768 3085 1 4 . 1 1 75 75 GLY N N 75 109.370 109.370 111.690 -2.320 25768 3086 1 4 . 1 1 75 75 GLY C C 75 174.030 174.030 173.552 0.478 25768 3087 1 4 . 1 1 75 75 GLY CA C 75 45.800 45.800 45.335 0.465 25768 3088 1 4 . 1 1 75 75 GLY H H 75 8.160 8.160 8.729 -0.569 25768 3089 1 4 . 1 1 76 76 LEU N N 76 121.660 121.660 122.417 -0.757 25768 3090 1 4 . 1 1 76 76 LEU C C 76 177.410 177.410 176.203 1.207 25768 3091 1 4 . 1 1 76 76 LEU CA C 76 55.410 55.410 55.279 0.132 25768 3092 1 4 . 1 1 76 76 LEU CB C 76 42.790 42.790 42.562 0.228 25768 3093 1 4 . 1 1 76 76 LEU H H 76 8.030 8.030 8.159 -0.129 25768 3094 1 4 . 1 1 77 77 GLY N N 77 109.330 109.330 112.511 -3.181 25768 3095 1 4 . 1 1 77 77 GLY C C 77 171.800 171.800 171.782 0.018 25768 3096 1 4 . 1 1 77 77 GLY CA C 77 44.990 44.990 44.772 0.218 25768 3097 1 4 . 1 1 77 77 GLY H H 77 8.100 8.100 8.258 -0.158 25768 3098 1 4 . 1 1 78 78 PRO C C 78 177.740 177.740 177.300 0.440 25768 3099 1 4 . 1 1 78 78 PRO CA C 78 63.890 63.890 63.195 0.695 25768 3100 1 4 . 1 1 78 78 PRO CB C 78 32.170 32.170 32.022 0.148 25768 3101 1 4 . 1 1 79 79 GLY N N 79 109.530 109.530 112.094 -2.564 25768 3102 1 4 . 1 1 79 79 GLY C C 79 174.460 174.460 173.221 1.239 25768 3103 1 4 . 1 1 79 79 GLY CA C 79 45.780 45.780 44.473 1.307 25768 3104 1 4 . 1 1 79 79 GLY H H 79 8.410 8.410 8.260 0.150 25768 3105 1 4 . 1 1 80 80 LEU N N 80 121.880 121.880 119.614 2.266 25768 3106 1 4 . 1 1 80 80 LEU C C 80 177.100 177.100 175.335 1.765 25768 3107 1 4 . 1 1 80 80 LEU CA C 80 55.720 55.720 54.083 1.637 25768 3108 1 4 . 1 1 80 80 LEU CB C 80 42.580 42.580 43.050 -0.470 25768 3109 1 4 . 1 1 80 80 LEU H H 80 8.010 8.010 7.911 0.099 25768 3110 1 4 . 1 1 81 81 ASP N N 81 119.990 119.990 122.437 -2.447 25768 3111 1 4 . 1 1 81 81 ASP C C 81 176.880 176.880 176.388 0.492 25768 3112 1 4 . 1 1 81 81 ASP CA C 81 54.770 54.770 53.819 0.951 25768 3113 1 4 . 1 1 81 81 ASP CB C 81 41.390 41.390 42.025 -0.635 25768 3114 1 4 . 1 1 81 81 ASP H H 81 8.220 8.220 8.438 -0.218 25768 3115 1 4 . 1 1 82 82 GLY N N 82 109.270 109.270 109.458 -0.188 25768 3116 1 4 . 1 1 82 82 GLY C C 82 174.190 174.190 173.601 0.589 25768 3117 1 4 . 1 1 82 82 GLY CA C 82 45.990 45.990 44.424 1.566 25768 3118 1 4 . 1 1 82 82 GLY H H 82 8.170 8.170 8.260 -0.090 25768 3119 1 4 . 1 1 83 83 LYS N N 83 121.000 121.000 120.368 0.632 25768 3120 1 4 . 1 1 83 83 LYS C C 83 176.610 176.610 176.646 -0.036 25768 3121 1 4 . 1 1 83 83 LYS CA C 83 56.620 56.620 55.477 1.143 25768 3122 1 4 . 1 1 83 83 LYS CB C 83 33.020 33.020 33.950 -0.930 25768 3123 1 4 . 1 1 83 83 LYS H H 83 7.970 7.970 8.355 -0.385 25768 3124 1 4 . 1 1 84 84 LEU N N 84 123.120 123.120 120.039 3.081 25768 3125 1 4 . 1 1 84 84 LEU C C 84 176.920 176.920 175.253 1.667 25768 3126 1 4 . 1 1 84 84 LEU CA C 84 55.550 55.550 55.681 -0.131 25768 3127 1 4 . 1 1 84 84 LEU CB C 84 42.430 42.430 42.100 0.330 25768 3128 1 4 . 1 1 84 84 LEU H H 84 8.130 8.130 8.226 -0.096 25768 3129 1 4 . 1 1 85 85 ALA N N 85 123.930 123.930 121.326 2.604 25768 3130 1 4 . 1 1 85 85 ALA C C 85 177.060 177.060 175.624 1.436 25768 3131 1 4 . 1 1 85 85 ALA CA C 85 52.790 52.790 51.608 1.181 25768 3132 1 4 . 1 1 85 85 ALA CB C 85 19.670 19.670 20.323 -0.653 25768 3133 1 4 . 1 1 85 85 ALA H H 85 8.040 8.040 7.982 0.058 25768 3134 1 4 . 1 1 86 86 ASP N N 86 119.760 119.760 119.040 0.720 25768 3135 1 4 . 1 1 86 86 ASP C C 86 175.820 175.820 174.846 0.974 25768 3136 1 4 . 1 1 86 86 ASP CA C 86 54.520 54.520 54.660 -0.140 25768 3137 1 4 . 1 1 86 86 ASP CB C 86 41.390 41.390 40.862 0.528 25768 3138 1 4 . 1 1 86 86 ASP H H 86 8.110 8.110 8.383 -0.273 25768 3139 1 4 . 1 1 87 87 ILE N N 87 120.620 120.620 117.815 2.805 25768 3140 1 4 . 1 1 87 87 ILE C C 87 175.740 175.740 175.549 0.191 25768 3141 1 4 . 1 1 87 87 ILE CA C 87 61.160 61.160 60.690 0.470 25768 3142 1 4 . 1 1 87 87 ILE CB C 87 39.260 39.260 39.208 0.052 25768 3143 1 4 . 1 1 87 87 ILE H H 87 7.800 7.800 7.821 -0.021 25768 3144 1 4 . 1 1 88 88 LYS N N 88 125.820 125.820 122.549 3.271 25768 3145 1 4 . 1 1 88 88 LYS C C 88 175.340 175.340 174.858 0.482 25768 3146 1 4 . 1 1 88 88 LYS CA C 88 56.300 56.300 56.913 -0.613 25768 3147 1 4 . 1 1 88 88 LYS CB C 88 32.900 32.900 32.332 0.568 25768 3148 1 4 . 1 1 88 88 LYS H H 88 8.250 8.250 8.475 -0.225 25768 3149 1 4 . 1 1 89 89 GLN N N 89 121.750 121.750 120.851 0.899 25768 3150 1 4 . 1 1 89 89 GLN C C 89 175.000 175.000 174.720 0.280 25768 3151 1 4 . 1 1 89 89 GLN CA C 89 55.210 55.210 54.932 0.278 25768 3152 1 4 . 1 1 89 89 GLN CB C 89 30.570 30.570 30.345 0.225 25768 3153 1 4 . 1 1 89 89 GLN H H 89 8.000 8.000 8.035 -0.035 25768 3154 1 4 . 1 1 90 90 LEU N N 90 126.660 126.660 122.571 4.089 25768 3155 1 4 . 1 1 90 90 LEU C C 90 174.240 174.240 174.531 -0.291 25768 3156 1 4 . 1 1 90 90 LEU CA C 90 52.720 52.720 53.200 -0.480 25768 3157 1 4 . 1 1 90 90 LEU CB C 90 42.350 42.350 42.481 -0.131 25768 3158 1 4 . 1 1 90 90 LEU H H 90 8.630 8.630 8.462 0.168 25768 3159 1 4 . 1 1 92 92 PRO C C 92 173.900 173.900 176.631 -2.731 25768 3160 1 4 . 1 1 92 92 PRO CA C 92 63.320 63.320 62.758 0.562 25768 3161 1 4 . 1 1 92 92 PRO CB C 92 31.920 31.920 32.580 -0.660 25768 3162 1 4 . 1 1 93 93 THR N N 93 119.770 119.770 119.605 0.165 25768 3163 1 4 . 1 1 93 93 THR C C 93 171.360 171.360 173.096 -1.736 25768 3164 1 4 . 1 1 93 93 THR CA C 93 62.610 62.610 62.211 0.399 25768 3165 1 4 . 1 1 93 93 THR CB C 93 72.680 72.680 70.177 2.502 25768 3166 1 4 . 1 1 93 93 THR H H 93 8.290 8.290 8.434 -0.144 25768 3167 1 4 . 1 1 94 94 LEU N N 94 128.880 128.880 129.398 -0.518 25768 3168 1 4 . 1 1 94 94 LEU C C 94 175.130 175.130 174.338 0.792 25768 3169 1 4 . 1 1 94 94 LEU CA C 94 53.520 53.520 54.447 -0.927 25768 3170 1 4 . 1 1 94 94 LEU CB C 94 46.140 46.140 44.667 1.473 25768 3171 1 4 . 1 1 94 94 LEU H H 94 8.680 8.680 8.816 -0.136 25768 3172 1 4 . 1 1 95 95 LEU N N 95 123.630 123.630 127.177 -3.547 25768 3173 1 4 . 1 1 95 95 LEU C C 95 175.540 175.540 174.615 0.925 25768 3174 1 4 . 1 1 95 95 LEU CA C 95 55.190 55.190 53.625 1.565 25768 3175 1 4 . 1 1 95 95 LEU CB C 95 45.300 45.300 45.805 -0.505 25768 3176 1 4 . 1 1 95 95 LEU H H 95 9.580 9.580 8.968 0.612 25768 3177 1 4 . 1 1 96 96 LEU N N 96 123.150 123.150 126.666 -3.516 25768 3178 1 4 . 1 1 96 96 LEU C C 96 174.960 174.960 175.133 -0.173 25768 3179 1 4 . 1 1 96 96 LEU CA C 96 54.420 54.420 55.360 -0.940 25768 3180 1 4 . 1 1 96 96 LEU CB C 96 44.560 44.560 44.089 0.471 25768 3181 1 4 . 1 1 96 96 LEU H H 96 8.770 8.770 8.860 -0.090 25768 3182 1 4 . 1 1 97 97 GLN N N 97 121.290 121.290 121.150 0.140 25768 3183 1 4 . 1 1 97 97 GLN C C 97 174.380 174.380 174.343 0.037 25768 3184 1 4 . 1 1 97 97 GLN CA C 97 54.740 54.740 53.892 0.848 25768 3185 1 4 . 1 1 97 97 GLN CB C 97 36.600 36.600 32.358 4.242 25768 3186 1 4 . 1 1 97 97 GLN H H 97 9.480 9.480 8.980 0.500 25768 3187 1 4 . 1 1 98 98 TYR N N 98 122.250 122.250 122.517 -0.267 25768 3188 1 4 . 1 1 98 98 TYR C C 98 173.460 173.460 174.426 -0.966 25768 3189 1 4 . 1 1 98 98 TYR CA C 98 55.160 55.160 56.409 -1.249 25768 3190 1 4 . 1 1 98 98 TYR CB C 98 42.420 42.420 43.250 -0.830 25768 3191 1 4 . 1 1 98 98 TYR H H 98 9.010 9.010 8.388 0.622 25768 3192 1 4 . 1 1 99 99 TYR N N 99 126.860 126.860 123.148 3.712 25768 3193 1 4 . 1 1 99 99 TYR C C 99 175.380 175.380 175.147 0.233 25768 3194 1 4 . 1 1 99 99 TYR CA C 99 54.220 54.220 54.226 -0.006 25768 3195 1 4 . 1 1 99 99 TYR CB C 99 38.890 38.890 37.237 1.653 25768 3196 1 4 . 1 1 99 99 TYR H H 99 8.300 8.300 7.701 0.599 25768 3197 1 4 . 1 1 100 100 PRO C C 100 178.330 178.330 176.868 1.462 25768 3198 1 4 . 1 1 100 100 PRO CA C 100 64.750 64.750 65.050 -0.300 25768 3199 1 4 . 1 1 100 100 PRO CB C 100 32.130 32.130 32.290 -0.160 25768 3200 1 4 . 1 1 101 101 MET N N 101 114.520 114.520 115.046 -0.526 25768 3201 1 4 . 1 1 101 101 MET C C 101 178.240 178.240 175.253 2.987 25768 3202 1 4 . 1 1 101 101 MET CA C 101 53.500 53.500 54.145 -0.645 25768 3203 1 4 . 1 1 101 101 MET CB C 101 30.160 30.160 32.901 -2.741 25768 3204 1 4 . 1 1 101 101 MET H H 101 9.390 9.390 8.010 1.380 25768 3205 1 4 . 1 1 102 102 GLY N N 102 117.500 117.500 108.479 9.021 25768 3206 1 4 . 1 1 102 102 GLY C C 102 175.690 175.690 174.474 1.216 25768 3207 1 4 . 1 1 102 102 GLY CA C 102 46.760 46.760 44.853 1.907 25768 3208 1 4 . 1 1 102 102 GLY H H 102 8.640 8.640 7.589 1.051 25768 3209 1 4 . 1 1 103 103 GLY N N 103 111.030 111.030 111.939 -0.909 25768 3210 1 4 . 1 1 103 103 GLY C C 103 174.070 174.070 173.410 0.660 25768 3211 1 4 . 1 1 103 103 GLY CA C 103 46.140 46.140 45.335 0.805 25768 3212 1 4 . 1 1 103 103 GLY H H 103 9.390 9.390 8.650 0.740 25768 3213 1 4 . 1 1 104 104 THR N N 104 109.290 109.290 112.396 -3.106 25768 3214 1 4 . 1 1 104 104 THR C C 104 174.290 174.290 174.063 0.227 25768 3215 1 4 . 1 1 104 104 THR CA C 104 60.900 60.900 60.533 0.367 25768 3216 1 4 . 1 1 104 104 THR CB C 104 72.070 72.070 69.924 2.146 25768 3217 1 4 . 1 1 104 104 THR H H 104 7.290 7.290 7.734 -0.444 25768 3218 1 4 . 1 1 105 105 ASN C C 105 175.050 175.050 175.306 -0.256 25768 3219 1 4 . 1 1 105 105 ASN CA C 105 52.880 52.880 52.762 0.118 25768 3220 1 4 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.799 -0.539 25768 3221 1 4 . 1 1 106 106 SER N N 106 113.000 113.000 116.293 -3.293 25768 3222 1 4 . 1 1 106 106 SER C C 106 176.000 176.000 175.031 0.969 25768 3223 1 4 . 1 1 106 106 SER CA C 106 58.700 58.700 58.535 0.166 25768 3224 1 4 . 1 1 106 106 SER CB C 106 64.540 64.540 64.317 0.223 25768 3225 1 4 . 1 1 106 106 SER H H 106 7.450 7.450 7.720 -0.270 25768 3226 1 4 . 1 1 107 107 ALA N N 107 132.220 132.220 124.895 7.325 25768 3227 1 4 . 1 1 107 107 ALA C C 107 176.610 176.610 176.283 0.327 25768 3228 1 4 . 1 1 107 107 ALA CA C 107 54.380 54.380 53.850 0.530 25768 3229 1 4 . 1 1 107 107 ALA CB C 107 18.690 18.690 19.077 -0.387 25768 3230 1 4 . 1 1 107 107 ALA H H 107 8.870 8.870 8.626 0.244 25768 3231 1 4 . 1 1 108 108 PHE N N 108 116.050 116.050 114.717 1.333 25768 3232 1 4 . 1 1 108 108 PHE C C 108 174.270 174.270 174.765 -0.495 25768 3233 1 4 . 1 1 108 108 PHE CA C 108 56.140 56.140 56.590 -0.450 25768 3234 1 4 . 1 1 108 108 PHE CB C 108 40.520 40.520 41.610 -1.090 25768 3235 1 4 . 1 1 108 108 PHE H H 108 7.550 7.550 7.667 -0.117 25768 3236 1 4 . 1 1 109 109 GLN N N 109 128.260 128.260 123.935 4.325 25768 3237 1 4 . 1 1 109 109 GLN C C 109 172.300 172.300 173.771 -1.471 25768 3238 1 4 . 1 1 109 109 GLN CA C 109 52.310 52.310 53.166 -0.856 25768 3239 1 4 . 1 1 109 109 GLN CB C 109 29.050 29.050 28.933 0.117 25768 3240 1 4 . 1 1 109 109 GLN H H 109 9.060 9.060 8.548 0.512 25768 3241 1 4 . 1 1 110 110 PRO C C 110 175.020 175.020 175.602 -0.582 25768 3242 1 4 . 1 1 110 110 PRO CA C 110 61.550 61.550 61.825 -0.276 25768 3243 1 4 . 1 1 110 110 PRO CB C 110 33.280 33.280 32.042 1.238 25768 3244 1 4 . 1 1 111 111 TYR N N 111 115.730 115.730 121.394 -5.664 25768 3245 1 4 . 1 1 111 111 TYR C C 111 173.850 173.850 176.397 -2.547 25768 3246 1 4 . 1 1 111 111 TYR CA C 111 56.470 56.470 56.322 0.148 25768 3247 1 4 . 1 1 111 111 TYR CB C 111 38.650 38.650 41.099 -2.449 25768 3248 1 4 . 1 1 111 111 TYR H H 111 8.500 8.500 7.560 0.940 25768 3249 1 4 . 1 1 112 112 GLY N N 112 103.570 103.570 109.646 -6.076 25768 3250 1 4 . 1 1 112 112 GLY C C 112 172.020 172.020 173.075 -1.055 25768 3251 1 4 . 1 1 112 112 GLY CA C 112 43.950 43.950 45.458 -1.508 25768 3252 1 4 . 1 1 112 112 GLY H H 112 8.110 8.110 8.816 -0.706 25768 3253 1 4 . 1 1 113 113 GLY N N 113 108.510 108.510 109.376 -0.866 25768 3254 1 4 . 1 1 113 113 GLY C C 113 171.540 171.540 172.617 -1.077 25768 3255 1 4 . 1 1 113 113 GLY CA C 113 46.120 46.120 44.563 1.557 25768 3256 1 4 . 1 1 113 113 GLY H H 113 9.080 9.080 7.996 1.084 25768 3257 1 4 . 1 1 114 114 LEU N N 114 120.270 120.270 126.526 -6.256 25768 3258 1 4 . 1 1 114 114 LEU C C 114 175.810 175.810 176.233 -0.423 25768 3259 1 4 . 1 1 114 114 LEU CA C 114 53.920 53.920 53.527 0.393 25768 3260 1 4 . 1 1 114 114 LEU CB C 114 47.940 47.940 46.518 1.422 25768 3261 1 4 . 1 1 114 114 LEU H H 114 8.620 8.620 8.044 0.576 25768 3262 1 4 . 1 1 115 115 GLY N N 115 110.620 110.620 111.721 -1.101 25768 3263 1 4 . 1 1 115 115 GLY C C 115 171.560 171.560 173.586 -2.026 25768 3264 1 4 . 1 1 115 115 GLY CA C 115 46.940 46.940 45.250 1.690 25768 3265 1 4 . 1 1 115 115 GLY H H 115 9.000 9.000 8.095 0.905 25768 3266 1 4 . 1 1 116 116 VAL N N 116 113.600 113.600 125.240 -11.640 25768 3267 1 4 . 1 1 116 116 VAL C C 116 174.120 174.120 173.344 0.776 25768 3268 1 4 . 1 1 116 116 VAL CA C 116 58.970 58.970 60.900 -1.930 25768 3269 1 4 . 1 1 116 116 VAL CB C 116 36.600 36.600 34.660 1.940 25768 3270 1 4 . 1 1 116 116 VAL H H 116 8.680 8.680 7.982 0.698 25768 3271 1 4 . 1 1 117 117 ASN N N 117 120.020 120.020 125.147 -5.127 25768 3272 1 4 . 1 1 117 117 ASN CA C 117 52.190 52.190 52.438 -0.248 25768 3273 1 4 . 1 1 117 117 ASN CB C 117 42.450 42.450 40.635 1.815 25768 3274 1 4 . 1 1 117 117 ASN H H 117 8.840 8.840 8.583 0.257 25768 3275 1 4 . 1 1 119 119 THR C C 119 174.350 174.350 174.148 0.202 25768 3276 1 4 . 1 1 119 119 THR CA C 119 63.140 63.140 62.331 0.809 25768 3277 1 4 . 1 1 119 119 THR CB C 119 70.170 70.170 69.324 0.846 25768 3278 1 4 . 1 1 120 120 THR N N 120 114.120 114.120 116.832 -2.712 25768 3279 1 4 . 1 1 120 120 THR C C 120 174.220 174.220 173.760 0.460 25768 3280 1 4 . 1 1 120 120 THR CA C 120 61.900 61.900 61.809 0.090 25768 3281 1 4 . 1 1 120 120 THR CB C 120 70.140 70.140 69.282 0.858 25768 3282 1 4 . 1 1 120 120 THR H H 120 7.570 7.570 8.067 -0.497 25768 3283 1 4 . 1 1 121 121 PHE N N 121 121.230 121.230 127.885 -6.655 25768 3284 1 4 . 1 1 121 121 PHE C C 121 174.910 174.910 174.173 0.737 25768 3285 1 4 . 1 1 121 121 PHE CA C 121 58.720 58.720 58.143 0.577 25768 3286 1 4 . 1 1 121 121 PHE CB C 121 40.470 40.470 40.169 0.301 25768 3287 1 4 . 1 1 121 121 PHE H H 121 7.830 7.830 9.045 -1.215 25768 3288 1 4 . 1 1 122 122 PHE C C 122 175.070 175.070 174.849 0.221 25768 3289 1 4 . 1 1 122 122 PHE CA C 122 57.890 57.890 58.140 -0.250 25768 3290 1 4 . 1 1 122 122 PHE CB C 122 39.870 39.870 40.003 -0.133 25768 3291 1 4 . 1 1 123 123 ASP N N 123 122.170 122.170 118.478 3.692 25768 3292 1 4 . 1 1 123 123 ASP C C 123 176.150 176.150 176.691 -0.541 25768 3293 1 4 . 1 1 123 123 ASP CA C 123 54.530 54.530 55.344 -0.814 25768 3294 1 4 . 1 1 123 123 ASP CB C 123 41.830 41.830 41.009 0.821 25768 3295 1 4 . 1 1 123 123 ASP H H 123 7.950 7.950 8.310 -0.360 25768 3296 1 4 . 1 1 124 124 GLU N N 124 122.690 122.690 117.946 4.744 25768 3297 1 4 . 1 1 124 124 GLU C C 124 176.630 176.630 177.978 -1.348 25768 3298 1 4 . 1 1 124 124 GLU CA C 124 57.620 57.620 57.972 -0.352 25768 3299 1 4 . 1 1 124 124 GLU CB C 124 30.450 30.450 30.052 0.399 25768 3300 1 4 . 1 1 124 124 GLU H H 124 8.340 8.340 8.347 -0.007 25768 3301 1 4 . 1 1 125 125 ASP N N 125 121.280 121.280 120.039 1.241 25768 3302 1 4 . 1 1 125 125 ASP C C 125 176.940 176.940 177.919 -0.979 25768 3303 1 4 . 1 1 125 125 ASP CA C 125 55.180 55.180 56.217 -1.037 25768 3304 1 4 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.699 0.521 25768 3305 1 4 . 1 1 125 125 ASP H H 125 8.310 8.310 8.302 0.008 25768 3306 1 4 . 1 1 126 126 LEU N N 126 122.830 122.830 118.414 4.416 25768 3307 1 4 . 1 1 126 126 LEU C C 126 178.020 178.020 178.555 -0.535 25768 3308 1 4 . 1 1 126 126 LEU CA C 126 56.450 56.450 56.566 -0.116 25768 3309 1 4 . 1 1 126 126 LEU CB C 126 42.150 42.150 41.974 0.176 25768 3310 1 4 . 1 1 126 126 LEU H H 126 8.010 8.010 7.906 0.104 25768 3311 1 4 . 1 1 127 127 ALA N N 127 122.660 122.660 120.798 1.862 25768 3312 1 4 . 1 1 127 127 ALA C C 127 178.600 178.600 178.062 0.538 25768 3313 1 4 . 1 1 127 127 ALA CA C 127 53.780 53.780 53.489 0.291 25768 3314 1 4 . 1 1 127 127 ALA CB C 127 19.000 19.000 19.068 -0.068 25768 3315 1 4 . 1 1 127 127 ALA H H 127 8.100 8.100 8.121 -0.021 25768 3316 1 4 . 1 1 128 128 SER N N 128 113.740 113.740 113.068 0.672 25768 3317 1 4 . 1 1 128 128 SER C C 128 175.010 175.010 172.441 2.569 25768 3318 1 4 . 1 1 128 128 SER CA C 128 59.580 59.580 57.630 1.950 25768 3319 1 4 . 1 1 128 128 SER CB C 128 63.800 63.800 64.944 -1.144 25768 3320 1 4 . 1 1 128 128 SER H H 128 7.920 7.920 7.665 0.255 25768 3321 1 4 . 1 1 129 129 ASN N N 129 120.300 120.300 117.918 2.382 25768 3322 1 4 . 1 1 129 129 ASN C C 129 175.590 175.590 174.279 1.311 25768 3323 1 4 . 1 1 129 129 ASN CA C 129 54.180 54.180 53.397 0.783 25768 3324 1 4 . 1 1 129 129 ASN CB C 129 38.900 38.900 39.830 -0.929 25768 3325 1 4 . 1 1 129 129 ASN H H 129 8.120 8.120 8.452 -0.332 25768 3326 1 4 . 1 1 130 130 ARG N N 130 120.630 120.630 123.032 -2.402 25768 3327 1 4 . 1 1 130 130 ARG C C 130 176.720 176.720 175.578 1.142 25768 3328 1 4 . 1 1 130 130 ARG CA C 130 57.240 57.240 56.303 0.937 25768 3329 1 4 . 1 1 130 130 ARG CB C 130 30.500 30.500 32.047 -1.547 25768 3330 1 4 . 1 1 130 130 ARG H H 130 8.050 8.050 8.496 -0.446 25768 3331 1 4 . 1 1 131 131 LYS N N 131 121.150 121.150 122.506 -1.356 25768 3332 1 4 . 1 1 131 131 LYS C C 131 176.750 176.750 175.108 1.642 25768 3333 1 4 . 1 1 131 131 LYS CA C 131 57.050 57.050 56.233 0.817 25768 3334 1 4 . 1 1 131 131 LYS CB C 131 32.870 32.870 33.720 -0.850 25768 3335 1 4 . 1 1 131 131 LYS H H 131 8.020 8.020 8.705 -0.685 25768 3336 1 4 . 1 1 132 132 ALA N N 132 124.110 124.110 123.194 0.916 25768 3337 1 4 . 1 1 132 132 ALA C C 132 177.680 177.680 177.103 0.577 25768 3338 1 4 . 1 1 132 132 ALA CA C 132 53.070 53.070 51.643 1.427 25768 3339 1 4 . 1 1 132 132 ALA CB C 132 19.250 19.250 19.479 -0.229 25768 3340 1 4 . 1 1 132 132 ALA H H 132 8.010 8.010 7.704 0.306 25768 3341 1 4 . 1 1 133 133 GLN N N 133 118.830 118.830 122.545 -3.715 25768 3342 1 4 . 1 1 133 133 GLN C C 133 176.380 176.380 175.983 0.397 25768 3343 1 4 . 1 1 133 133 GLN CA C 133 56.400 56.400 55.599 0.801 25768 3344 1 4 . 1 1 133 133 GLN CB C 133 29.670 29.670 30.125 -0.455 25768 3345 1 4 . 1 1 133 133 GLN H H 133 8.070 8.070 8.702 -0.632 25768 3346 1 4 . 1 1 134 134 GLY N N 134 109.400 109.400 109.981 -0.581 25768 3347 1 4 . 1 1 134 134 GLY C C 134 174.060 174.060 174.043 0.017 25768 3348 1 4 . 1 1 134 134 GLY CA C 134 45.690 45.690 45.235 0.455 25768 3349 1 4 . 1 1 134 134 GLY H H 134 8.150 8.150 8.563 -0.413 25768 3350 1 4 . 1 1 135 135 PHE N N 135 120.480 120.480 118.708 1.772 25768 3351 1 4 . 1 1 135 135 PHE C C 135 176.000 176.000 174.995 1.005 25768 3352 1 4 . 1 1 135 135 PHE CA C 135 58.370 58.370 58.059 0.311 25768 3353 1 4 . 1 1 135 135 PHE CB C 135 39.710 39.710 39.236 0.474 25768 3354 1 4 . 1 1 135 135 PHE H H 135 8.060 8.060 8.077 -0.017 25768 3355 1 4 . 1 1 136 136 SER N N 136 116.740 116.740 114.813 1.927 25768 3356 1 4 . 1 1 136 136 SER C C 136 174.620 174.620 173.666 0.954 25768 3357 1 4 . 1 1 136 136 SER CA C 136 58.870 58.870 58.340 0.530 25768 3358 1 4 . 1 1 136 136 SER CB C 136 64.200 64.200 64.157 0.043 25768 3359 1 4 . 1 1 136 136 SER H H 136 8.160 8.160 8.541 -0.381 25768 3360 1 4 . 1 1 137 137 SER N N 137 117.650 117.650 119.071 -1.421 25768 3361 1 4 . 1 1 137 137 SER C C 137 174.410 174.410 173.908 0.502 25768 3362 1 4 . 1 1 137 137 SER CA C 137 58.880 58.880 58.685 0.195 25768 3363 1 4 . 1 1 137 137 SER CB C 137 64.140 64.140 63.849 0.291 25768 3364 1 4 . 1 1 137 137 SER H H 137 8.140 8.140 8.114 0.026 25768 3365 1 4 . 1 1 138 138 MET N N 138 121.980 121.980 124.244 -2.264 25768 3366 1 4 . 1 1 138 138 MET C C 138 175.680 175.680 175.465 0.215 25768 3367 1 4 . 1 1 138 138 MET CA C 138 56.180 56.180 55.388 0.792 25768 3368 1 4 . 1 1 138 138 MET CB C 138 33.240 33.240 32.887 0.353 25768 3369 1 4 . 1 1 138 138 MET H H 138 8.110 8.110 8.325 -0.215 25768 3370 1 4 . 1 1 139 139 LYS N N 139 122.110 122.110 119.686 2.424 25768 3371 1 4 . 1 1 139 139 LYS C C 139 176.220 176.220 174.889 1.331 25768 3372 1 4 . 1 1 139 139 LYS CA C 139 56.370 56.370 56.560 -0.190 25768 3373 1 4 . 1 1 139 139 LYS CB C 139 33.220 33.220 32.146 1.074 25768 3374 1 4 . 1 1 139 139 LYS H H 139 8.140 8.140 8.371 -0.231 25768 3375 1 4 . 1 1 140 140 LEU N N 140 123.860 123.860 122.592 1.268 25768 3376 1 4 . 1 1 140 140 LEU C C 140 177.100 177.100 176.922 0.178 25768 3377 1 4 . 1 1 140 140 LEU CA C 140 55.710 55.710 56.428 -0.718 25768 3378 1 4 . 1 1 140 140 LEU CB C 140 42.460 42.460 42.133 0.327 25768 3379 1 4 . 1 1 140 140 LEU H H 140 8.140 8.140 8.181 -0.041 25768 3380 1 4 . 1 1 141 141 GLN N N 141 120.350 120.350 120.569 -0.219 25768 3381 1 4 . 1 1 141 141 GLN C C 141 175.170 175.170 174.991 0.179 25768 3382 1 4 . 1 1 141 141 GLN CA C 141 56.200 56.200 56.508 -0.308 25768 3383 1 4 . 1 1 141 141 GLN CB C 141 29.950 29.950 27.408 2.542 25768 3384 1 4 . 1 1 141 141 GLN H H 141 8.210 8.210 8.291 -0.081 25768 3385 1 4 . 1 1 142 142 ASP N N 142 120.950 120.950 119.150 1.800 25768 3386 1 4 . 1 1 142 142 ASP C C 142 175.840 175.840 174.981 0.859 25768 3387 1 4 . 1 1 142 142 ASP CA C 142 54.700 54.700 54.516 0.184 25768 3388 1 4 . 1 1 142 142 ASP CB C 142 41.760 41.760 41.799 -0.039 25768 3389 1 4 . 1 1 142 142 ASP H H 142 8.120 8.120 7.976 0.144 25768 3390 1 4 . 1 1 143 143 SER N N 143 114.880 114.880 115.959 -1.079 25768 3391 1 4 . 1 1 143 143 SER C C 143 173.290 173.290 173.634 -0.344 25768 3392 1 4 . 1 1 143 143 SER CA C 143 58.450 58.450 58.210 0.240 25768 3393 1 4 . 1 1 143 143 SER CB C 143 64.760 64.760 64.112 0.648 25768 3394 1 4 . 1 1 143 143 SER H H 143 7.960 7.960 7.918 0.042 25768 3395 1 4 . 1 1 144 144 TRP N N 144 123.110 123.110 125.476 -2.366 25768 3396 1 4 . 1 1 144 144 TRP C C 144 175.880 175.880 177.223 -1.343 25768 3397 1 4 . 1 1 144 144 TRP CA C 144 56.420 56.420 56.857 -0.437 25768 3398 1 4 . 1 1 144 144 TRP CB C 144 31.160 31.160 31.481 -0.321 25768 3399 1 4 . 1 1 144 144 TRP H H 144 8.080 8.080 8.299 -0.219 25768 3400 1 4 . 1 1 145 145 GLY N N 145 110.410 110.410 109.153 1.257 25768 3401 1 4 . 1 1 145 145 GLY C C 145 172.870 172.870 174.029 -1.159 25768 3402 1 4 . 1 1 145 145 GLY CA C 145 45.130 45.130 45.800 -0.669 25768 3403 1 4 . 1 1 145 145 GLY H H 145 8.660 8.660 8.827 -0.167 25768 3404 1 4 . 1 1 148 148 GLY C C 148 171.800 171.800 172.342 -0.542 25768 3405 1 4 . 1 1 148 148 GLY CA C 148 44.140 44.140 45.783 -1.643 25768 3406 1 4 . 1 1 149 149 GLU N N 149 123.070 123.070 120.221 2.849 25768 3407 1 4 . 1 1 149 149 GLU C C 149 174.210 174.210 173.939 0.271 25768 3408 1 4 . 1 1 149 149 GLU CA C 149 55.120 55.120 56.123 -1.003 25768 3409 1 4 . 1 1 149 149 GLU CB C 149 37.410 37.410 34.518 2.892 25768 3410 1 4 . 1 1 149 149 GLU H H 149 8.550 8.550 8.511 0.039 25768 3411 1 4 . 1 1 150 150 LEU N N 150 126.130 126.130 123.404 2.726 25768 3412 1 4 . 1 1 150 150 LEU C C 150 174.410 174.410 175.212 -0.802 25768 3413 1 4 . 1 1 150 150 LEU CA C 150 54.260 54.260 53.023 1.237 25768 3414 1 4 . 1 1 150 150 LEU CB C 150 47.510 47.510 45.578 1.932 25768 3415 1 4 . 1 1 150 150 LEU H H 150 8.550 8.550 8.070 0.480 25768 3416 1 4 . 1 1 151 151 GLY N N 151 109.500 109.500 111.018 -1.518 25768 3417 1 4 . 1 1 151 151 GLY C C 151 170.610 170.610 172.291 -1.681 25768 3418 1 4 . 1 1 151 151 GLY CA C 151 45.980 45.980 43.740 2.240 25768 3419 1 4 . 1 1 151 151 GLY H H 151 8.090 8.090 8.573 -0.483 25768 3420 1 4 . 1 1 152 152 PHE N N 152 110.960 110.960 119.883 -8.923 25768 3421 1 4 . 1 1 152 152 PHE C C 152 171.510 171.510 174.073 -2.563 25768 3422 1 4 . 1 1 152 152 PHE CA C 152 58.170 58.170 56.329 1.841 25768 3423 1 4 . 1 1 152 152 PHE CB C 152 41.690 41.690 41.583 0.107 25768 3424 1 4 . 1 1 152 152 PHE H H 152 8.380 8.380 8.552 -0.172 25768 3425 1 4 . 1 1 153 153 ASP N N 153 118.880 118.880 126.554 -7.674 25768 3426 1 4 . 1 1 153 153 ASP C C 153 176.520 176.520 174.724 1.796 25768 3427 1 4 . 1 1 153 153 ASP CA C 153 52.940 52.940 53.018 -0.078 25768 3428 1 4 . 1 1 153 153 ASP CB C 153 44.540 44.540 44.231 0.309 25768 3429 1 4 . 1 1 153 153 ASP H H 153 7.970 7.970 8.311 -0.341 25768 3430 1 4 . 1 1 154 154 TYR N N 154 123.630 123.630 126.882 -3.252 25768 3431 1 4 . 1 1 154 154 TYR C C 154 175.610 175.610 173.886 1.724 25768 3432 1 4 . 1 1 154 154 TYR CA C 154 57.310 57.310 57.521 -0.211 25768 3433 1 4 . 1 1 154 154 TYR CB C 154 42.040 42.040 42.243 -0.203 25768 3434 1 4 . 1 1 154 154 TYR H H 154 9.730 9.730 9.271 0.459 25768 3435 1 4 . 1 1 155 155 MET N N 155 126.190 126.190 127.559 -1.369 25768 3436 1 4 . 1 1 155 155 MET C C 155 174.970 174.970 175.423 -0.453 25768 3437 1 4 . 1 1 155 155 MET CA C 155 54.720 54.720 56.718 -1.998 25768 3438 1 4 . 1 1 155 155 MET CB C 155 28.300 28.300 32.745 -4.445 25768 3439 1 4 . 1 1 155 155 MET H H 155 8.600 8.600 8.736 -0.136 25768 3440 1 4 . 1 1 156 156 LEU N N 156 125.290 125.290 127.407 -2.117 25768 3441 1 4 . 1 1 156 156 LEU C C 156 177.680 177.680 177.026 0.654 25768 3442 1 4 . 1 1 156 156 LEU CA C 156 56.040 56.040 54.490 1.550 25768 3443 1 4 . 1 1 156 156 LEU CB C 156 43.040 43.040 42.824 0.216 25768 3444 1 4 . 1 1 156 156 LEU H H 156 9.190 9.190 8.579 0.611 25768 3445 1 4 . 1 1 157 157 ASN N N 157 114.690 114.690 117.204 -2.514 25768 3446 1 4 . 1 1 157 157 ASN C C 157 173.640 173.640 177.440 -3.800 25768 3447 1 4 . 1 1 157 157 ASN CA C 157 52.650 52.650 56.481 -3.831 25768 3448 1 4 . 1 1 157 157 ASN CB C 157 37.270 37.270 36.511 0.759 25768 3449 1 4 . 1 1 157 157 ASN H H 157 8.060 8.060 8.014 0.046 25768 3450 1 4 . 1 1 158 158 GLU N N 158 114.530 114.530 121.000 -6.470 25768 3451 1 4 . 1 1 158 158 GLU C C 158 176.090 176.090 177.327 -1.237 25768 3452 1 4 . 1 1 158 158 GLU CA C 158 60.010 60.010 58.576 1.434 25768 3453 1 4 . 1 1 158 158 GLU CB C 158 29.730 29.730 29.830 -0.100 25768 3454 1 4 . 1 1 158 158 GLU H H 158 8.560 8.560 8.321 0.239 25768 3455 1 4 . 1 1 159 159 HIS N N 159 110.480 110.480 116.942 -6.462 25768 3456 1 4 . 1 1 159 159 HIS C C 159 173.130 173.130 173.980 -0.850 25768 3457 1 4 . 1 1 159 159 HIS CA C 159 56.770 56.770 54.596 2.174 25768 3458 1 4 . 1 1 159 159 HIS CB C 159 32.630 32.630 29.229 3.401 25768 3459 1 4 . 1 1 159 159 HIS H H 159 8.190 8.190 7.771 0.419 25768 3460 1 4 . 1 1 160 160 ALA N N 160 122.890 122.890 121.010 1.880 25768 3461 1 4 . 1 1 160 160 ALA C C 160 176.200 176.200 175.803 0.397 25768 3462 1 4 . 1 1 160 160 ALA CA C 160 51.730 51.730 54.453 -2.723 25768 3463 1 4 . 1 1 160 160 ALA CB C 160 21.560 21.560 17.356 4.204 25768 3464 1 4 . 1 1 160 160 ALA H H 160 8.400 8.400 7.789 0.611 25768 3465 1 4 . 1 1 161 161 LEU N N 161 116.540 116.540 116.717 -0.177 25768 3466 1 4 . 1 1 161 161 LEU C C 161 174.930 174.930 175.149 -0.219 25768 3467 1 4 . 1 1 161 161 LEU CA C 161 54.280 54.280 54.655 -0.375 25768 3468 1 4 . 1 1 161 161 LEU CB C 161 45.640 45.640 47.142 -1.502 25768 3469 1 4 . 1 1 161 161 LEU H H 161 8.590 8.590 7.919 0.671 25768 3470 1 4 . 1 1 162 162 PHE N N 162 121.780 121.780 120.285 1.495 25768 3471 1 4 . 1 1 162 162 PHE C C 162 171.960 171.960 173.904 -1.944 25768 3472 1 4 . 1 1 162 162 PHE CA C 162 56.420 56.420 56.867 -0.447 25768 3473 1 4 . 1 1 162 162 PHE CB C 162 43.340 43.340 43.638 -0.298 25768 3474 1 4 . 1 1 162 162 PHE H H 162 9.180 9.180 9.063 0.117 25768 3475 1 4 . 1 1 163 163 ASN N N 163 127.850 127.850 123.366 4.484 25768 3476 1 4 . 1 1 163 163 ASN C C 163 171.320 171.320 173.810 -2.490 25768 3477 1 4 . 1 1 163 163 ASN CA C 163 52.340 52.340 52.531 -0.191 25768 3478 1 4 . 1 1 163 163 ASN CB C 163 46.410 46.410 42.827 3.583 25768 3479 1 4 . 1 1 163 163 ASN H H 163 7.700 7.700 8.386 -0.686 25768 3480 1 4 . 1 1 164 164 MET N N 164 119.950 119.950 120.364 -0.414 25768 3481 1 4 . 1 1 164 164 MET C C 164 172.830 172.830 173.970 -1.140 25768 3482 1 4 . 1 1 164 164 MET CA C 164 55.180 55.180 54.691 0.489 25768 3483 1 4 . 1 1 164 164 MET CB C 164 37.770 37.770 38.224 -0.454 25768 3484 1 4 . 1 1 164 164 MET H H 164 7.070 7.070 8.412 -1.342 25768 3485 1 4 . 1 1 165 165 ALA N N 165 120.600 120.600 123.815 -3.215 25768 3486 1 4 . 1 1 165 165 ALA C C 165 174.240 174.240 175.760 -1.520 25768 3487 1 4 . 1 1 165 165 ALA CA C 165 51.630 51.630 50.130 1.500 25768 3488 1 4 . 1 1 165 165 ALA CB C 165 22.330 22.330 22.285 0.045 25768 3489 1 4 . 1 1 165 165 ALA H H 165 8.290 8.290 8.848 -0.558 25768 3490 1 4 . 1 1 166 166 VAL N N 166 117.900 117.900 116.416 1.484 25768 3491 1 4 . 1 1 166 166 VAL C C 166 172.950 172.950 174.099 -1.149 25768 3492 1 4 . 1 1 166 166 VAL CA C 166 59.710 59.710 60.186 -0.476 25768 3493 1 4 . 1 1 166 166 VAL CB C 166 35.290 35.290 35.952 -0.662 25768 3494 1 4 . 1 1 166 166 VAL H H 166 8.720 8.720 8.007 0.713 25768 3495 1 4 . 1 1 171 171 ILE C C 171 175.750 175.750 174.708 1.042 25768 3496 1 4 . 1 1 171 171 ILE CA C 171 61.720 61.720 61.984 -0.264 25768 3497 1 4 . 1 1 171 171 ILE CB C 171 39.300 39.300 38.042 1.258 25768 3498 1 4 . 1 1 172 172 ASP N N 172 124.070 124.070 124.791 -0.721 25768 3499 1 4 . 1 1 172 172 ASP C C 172 176.590 176.590 176.098 0.492 25768 3500 1 4 . 1 1 172 172 ASP CA C 172 54.460 54.460 53.912 0.548 25768 3501 1 4 . 1 1 172 172 ASP CB C 172 41.410 41.410 41.804 -0.394 25768 3502 1 4 . 1 1 172 172 ASP H H 172 8.460 8.460 8.402 0.058 25768 3503 1 4 . 1 1 173 173 THR N N 173 115.570 115.570 118.924 -3.354 25768 3504 1 4 . 1 1 173 173 THR C C 173 175.030 175.030 175.100 -0.070 25768 3505 1 4 . 1 1 173 173 THR CA C 173 62.680 62.680 63.066 -0.386 25768 3506 1 4 . 1 1 173 173 THR CB C 173 69.840 69.840 69.065 0.775 25768 3507 1 4 . 1 1 173 173 THR H H 173 8.080 8.080 8.194 -0.114 25768 3508 1 4 . 1 1 174 174 LYS N N 174 122.680 122.680 121.155 1.525 25768 3509 1 4 . 1 1 174 174 LYS C C 174 176.340 176.340 174.877 1.463 25768 3510 1 4 . 1 1 174 174 LYS CA C 174 56.820 56.820 56.328 0.492 25768 3511 1 4 . 1 1 174 174 LYS CB C 174 32.790 32.790 31.744 1.046 25768 3512 1 4 . 1 1 174 174 LYS H H 174 8.180 8.180 8.095 0.085 25768 3513 1 4 . 1 1 175 175 ALA N N 175 124.050 124.050 122.488 1.562 25768 3514 1 4 . 1 1 175 175 ALA C C 175 177.550 177.550 176.752 0.798 25768 3515 1 4 . 1 1 175 175 ALA CA C 175 52.840 52.840 52.410 0.430 25768 3516 1 4 . 1 1 175 175 ALA CB C 175 19.580 19.580 18.630 0.950 25768 3517 1 4 . 1 1 175 175 ALA H H 175 8.050 8.050 7.969 0.081 25768 3518 1 4 . 1 1 176 176 SER N N 176 114.920 114.920 115.882 -0.962 25768 3519 1 4 . 1 1 176 176 SER C C 176 174.240 174.240 174.066 0.174 25768 3520 1 4 . 1 1 176 176 SER CA C 176 58.390 58.390 58.077 0.313 25768 3521 1 4 . 1 1 176 176 SER CB C 176 64.370 64.370 63.999 0.371 25768 3522 1 4 . 1 1 176 176 SER H H 176 8.070 8.070 8.234 -0.164 25768 3523 1 4 . 1 1 177 177 ILE N N 177 121.650 121.650 122.835 -1.185 25768 3524 1 4 . 1 1 177 177 ILE C C 177 174.990 174.990 174.992 -0.002 25768 3525 1 4 . 1 1 177 177 ILE CA C 177 61.570 61.570 61.125 0.445 25768 3526 1 4 . 1 1 177 177 ILE CB C 177 39.100 39.100 38.806 0.294 25768 3527 1 4 . 1 1 177 177 ILE H H 177 7.960 7.960 8.067 -0.107 25768 3528 1 4 . 1 1 178 178 ASN N N 178 127.040 127.040 123.903 3.137 25768 3529 1 4 . 1 1 178 178 ASN C C 178 179.160 179.160 175.325 3.835 25768 3530 1 4 . 1 1 178 178 ASN CA C 178 55.100 55.100 52.791 2.309 25768 3531 1 4 . 1 1 178 178 ASN CB C 178 41.300 41.300 39.655 1.645 25768 3532 1 4 . 1 1 178 178 ASN H H 178 7.850 7.850 8.461 -0.611 25768 3533 1 4 . 1 1 180 180 PRO C C 180 177.520 177.520 175.804 1.716 25768 3534 1 4 . 1 1 180 180 PRO CA C 180 63.980 63.980 63.864 0.117 25768 3535 1 4 . 1 1 180 180 PRO CB C 180 32.190 32.190 30.046 2.144 25768 3536 1 4 . 1 1 181 181 SER N N 181 115.600 115.600 115.000 0.600 25768 3537 1 4 . 1 1 181 181 SER C C 181 174.710 174.710 173.156 1.554 25768 3538 1 4 . 1 1 181 181 SER CA C 181 58.900 58.900 58.688 0.212 25768 3539 1 4 . 1 1 181 181 SER CB C 181 64.070 64.070 64.556 -0.487 25768 3540 1 4 . 1 1 181 181 SER H H 181 8.260 8.260 8.755 -0.495 25768 3541 1 4 . 1 1 182 182 ALA N N 182 125.880 125.880 125.308 0.572 25768 3542 1 4 . 1 1 182 182 ALA C C 182 177.560 177.560 175.791 1.769 25768 3543 1 4 . 1 1 182 182 ALA CA C 182 53.090 53.090 51.706 1.384 25768 3544 1 4 . 1 1 182 182 ALA CB C 182 19.310 19.310 20.611 -1.301 25768 3545 1 4 . 1 1 182 182 ALA H H 182 8.130 8.130 7.801 0.329 25768 3546 1 4 . 1 1 183 183 LEU N N 183 119.980 119.980 122.600 -2.620 25768 3547 1 4 . 1 1 183 183 LEU C C 183 177.850 177.850 178.269 -0.419 25768 3548 1 4 . 1 1 183 183 LEU CA C 183 55.650 55.650 54.862 0.788 25768 3549 1 4 . 1 1 183 183 LEU CB C 183 42.530 42.530 42.392 0.138 25768 3550 1 4 . 1 1 183 183 LEU H H 183 7.940 7.940 8.467 -0.527 25768 3551 1 4 . 1 1 184 184 GLY N N 184 109.250 109.250 108.235 1.015 25768 3552 1 4 . 1 1 184 184 GLY C C 184 174.250 174.250 173.224 1.026 25768 3553 1 4 . 1 1 184 184 GLY CA C 184 45.830 45.830 44.060 1.770 25768 3554 1 4 . 1 1 184 184 GLY H H 184 8.150 8.150 8.134 0.016 25768 3555 1 4 . 1 1 185 185 VAL N N 185 118.830 118.830 120.966 -2.136 25768 3556 1 4 . 1 1 185 185 VAL C C 185 175.890 175.890 175.447 0.443 25768 3557 1 4 . 1 1 185 185 VAL CA C 185 62.740 62.740 61.081 1.659 25768 3558 1 4 . 1 1 185 185 VAL CB C 185 32.770 32.770 32.437 0.333 25768 3559 1 4 . 1 1 185 185 VAL H H 185 7.760 7.760 8.171 -0.411 25768 3560 1 4 . 1 1 186 186 ASN N N 186 121.850 121.850 125.128 -3.278 25768 3561 1 4 . 1 1 186 186 ASN C C 186 174.970 174.970 175.071 -0.101 25768 3562 1 4 . 1 1 186 186 ASN CA C 186 53.590 53.590 53.787 -0.197 25768 3563 1 4 . 1 1 186 186 ASN CB C 186 39.160 39.160 38.139 1.021 25768 3564 1 4 . 1 1 186 186 ASN H H 186 8.380 8.380 8.837 -0.457 25768 3565 1 4 . 1 1 187 187 LYS N N 187 122.120 122.120 123.256 -1.136 25768 3566 1 4 . 1 1 187 187 LYS C C 187 176.490 176.490 176.140 0.350 25768 3567 1 4 . 1 1 187 187 LYS CA C 187 56.750 56.750 56.607 0.143 25768 3568 1 4 . 1 1 187 187 LYS CB C 187 33.250 33.250 33.180 0.070 25768 3569 1 4 . 1 1 187 187 LYS H H 187 8.140 8.140 8.318 -0.178 25768 3570 1 4 . 1 1 188 188 THR N N 188 115.250 115.250 113.095 2.155 25768 3571 1 4 . 1 1 188 188 THR C C 188 174.250 174.250 173.977 0.273 25768 3572 1 4 . 1 1 188 188 THR CA C 188 62.360 62.360 63.258 -0.898 25768 3573 1 4 . 1 1 188 188 THR CB C 188 70.280 70.280 68.800 1.480 25768 3574 1 4 . 1 1 188 188 THR H H 188 8.100 8.100 8.073 0.027 25768 3575 1 4 . 1 1 189 189 LYS N N 189 123.780 123.780 122.885 0.895 25768 3576 1 4 . 1 1 189 189 LYS C C 189 176.090 176.090 176.295 -0.205 25768 3577 1 4 . 1 1 189 189 LYS CA C 189 56.590 56.590 56.546 0.044 25768 3578 1 4 . 1 1 189 189 LYS CB C 189 33.350 33.350 33.845 -0.495 25768 3579 1 4 . 1 1 189 189 LYS H H 189 8.110 8.110 8.116 -0.006 25768 3580 1 4 . 1 1 190 190 VAL N N 190 120.920 120.920 120.627 0.293 25768 3581 1 4 . 1 1 190 190 VAL C C 190 175.590 175.590 175.344 0.246 25768 3582 1 4 . 1 1 190 190 VAL CA C 190 62.400 62.400 61.337 1.063 25768 3583 1 4 . 1 1 190 190 VAL CB C 190 32.990 32.990 33.224 -0.234 25768 3584 1 4 . 1 1 190 190 VAL H H 190 8.040 8.040 7.663 0.377 25768 3585 1 4 . 1 1 191 191 ASP N N 191 123.790 123.790 125.999 -2.209 25768 3586 1 4 . 1 1 191 191 ASP C C 191 175.750 175.750 176.783 -1.033 25768 3587 1 4 . 1 1 191 191 ASP CA C 191 54.650 54.650 55.817 -1.167 25768 3588 1 4 . 1 1 191 191 ASP CB C 191 41.450 41.450 41.752 -0.302 25768 3589 1 4 . 1 1 191 191 ASP H H 191 8.240 8.240 8.721 -0.481 25768 3590 1 4 . 1 1 192 192 VAL N N 192 118.850 118.850 116.744 2.106 25768 3591 1 4 . 1 1 192 192 VAL C C 192 175.380 175.380 175.397 -0.017 25768 3592 1 4 . 1 1 192 192 VAL CA C 192 62.110 62.110 62.617 -0.507 25768 3593 1 4 . 1 1 192 192 VAL CB C 192 33.290 33.290 33.418 -0.128 25768 3594 1 4 . 1 1 192 192 VAL H H 192 7.860 7.860 7.785 0.075 25768 3595 1 4 . 1 1 193 193 ASP N N 193 124.190 124.190 118.291 5.899 25768 3596 1 4 . 1 1 193 193 ASP C C 193 175.630 175.630 175.369 0.261 25768 3597 1 4 . 1 1 193 193 ASP CA C 193 54.540 54.540 54.346 0.194 25768 3598 1 4 . 1 1 193 193 ASP CB C 193 41.410 41.410 43.256 -1.846 25768 3599 1 4 . 1 1 193 193 ASP H H 193 8.310 8.310 8.331 -0.021 25768 3600 1 4 . 1 1 194 194 VAL N N 194 119.580 119.580 119.273 0.307 25768 3601 1 4 . 1 1 194 194 VAL C C 194 174.950 174.950 174.436 0.514 25768 3602 1 4 . 1 1 194 194 VAL CA C 194 61.770 61.770 61.906 -0.136 25768 3603 1 4 . 1 1 194 194 VAL CB C 194 33.680 33.680 33.392 0.288 25768 3604 1 4 . 1 1 194 194 VAL H H 194 7.890 7.890 7.701 0.189 25768 3605 1 4 . 1 1 195 195 ASP N N 195 125.660 125.660 126.846 -1.186 25768 3606 1 4 . 1 1 195 195 ASP C C 195 174.290 174.290 173.874 0.416 25768 3607 1 4 . 1 1 195 195 ASP CA C 195 51.940 51.940 51.138 0.802 25768 3608 1 4 . 1 1 195 195 ASP CB C 195 40.950 40.950 41.132 -0.182 25768 3609 1 4 . 1 1 195 195 ASP H H 195 8.410 8.410 8.094 0.316 25768 3610 1 4 . 1 1 198 198 VAL C C 198 173.940 173.940 174.927 -0.987 25768 3611 1 4 . 1 1 198 198 VAL CA C 198 61.270 61.270 60.817 0.453 25768 3612 1 4 . 1 1 198 198 VAL CB C 198 35.910 35.910 33.239 2.671 25768 3613 1 4 . 1 1 199 199 TYR N N 199 123.780 123.780 121.720 2.060 25768 3614 1 4 . 1 1 199 199 TYR C C 199 174.150 174.150 174.517 -0.367 25768 3615 1 4 . 1 1 199 199 TYR CA C 199 56.220 56.220 56.457 -0.237 25768 3616 1 4 . 1 1 199 199 TYR CB C 199 41.660 41.660 42.484 -0.824 25768 3617 1 4 . 1 1 199 199 TYR H H 199 8.540 8.540 7.827 0.713 25768 3618 1 4 . 1 1 200 200 MET N N 200 123.920 123.920 118.170 5.750 25768 3619 1 4 . 1 1 200 200 MET C C 200 173.810 173.810 175.055 -1.245 25768 3620 1 4 . 1 1 200 200 MET CA C 200 54.710 54.710 55.014 -0.304 25768 3621 1 4 . 1 1 200 200 MET CB C 200 37.110 37.110 35.943 1.167 25768 3622 1 4 . 1 1 200 200 MET H H 200 9.130 9.130 8.511 0.619 25768 3623 1 4 . 1 1 201 201 ILE N N 201 123.670 123.670 116.834 6.836 25768 3624 1 4 . 1 1 201 201 ILE C C 201 174.030 174.030 174.039 -0.009 25768 3625 1 4 . 1 1 201 201 ILE CA C 201 59.820 59.820 60.071 -0.251 25768 3626 1 4 . 1 1 201 201 ILE CB C 201 41.720 41.720 41.746 -0.026 25768 3627 1 4 . 1 1 201 201 ILE H H 201 8.030 8.030 8.407 -0.377 25768 3628 1 4 . 1 1 202 202 GLY N N 202 112.910 112.910 111.065 1.845 25768 3629 1 4 . 1 1 202 202 GLY C C 202 170.280 170.280 171.433 -1.153 25768 3630 1 4 . 1 1 202 202 GLY CA C 202 46.800 46.800 45.549 1.251 25768 3631 1 4 . 1 1 202 202 GLY H H 202 8.580 8.580 7.957 0.623 25768 3632 1 4 . 1 1 203 203 PHE N N 203 116.240 116.240 115.496 0.744 25768 3633 1 4 . 1 1 203 203 PHE C C 203 173.940 173.940 173.982 -0.042 25768 3634 1 4 . 1 1 203 203 PHE CA C 203 55.890 55.890 54.368 1.522 25768 3635 1 4 . 1 1 203 203 PHE CB C 203 45.060 45.060 41.687 3.373 25768 3636 1 4 . 1 1 203 203 PHE H H 203 8.620 8.620 7.938 0.682 25768 3637 1 4 . 1 1 204 204 GLY N N 204 105.610 105.610 106.400 -0.790 25768 3638 1 4 . 1 1 204 204 GLY C C 204 171.190 171.190 171.947 -0.757 25768 3639 1 4 . 1 1 204 204 GLY CA C 204 46.720 46.720 44.354 2.366 25768 3640 1 4 . 1 1 204 204 GLY H H 204 8.960 8.960 8.675 0.285 25768 3641 1 4 . 1 1 205 205 TYR N N 205 121.160 121.160 118.117 3.043 25768 3642 1 4 . 1 1 205 205 TYR C C 205 173.030 173.030 173.994 -0.964 25768 3643 1 4 . 1 1 205 205 TYR CA C 205 57.190 57.190 57.366 -0.176 25768 3644 1 4 . 1 1 205 205 TYR CB C 205 44.400 44.400 42.974 1.426 25768 3645 1 4 . 1 1 205 205 TYR H H 205 9.380 9.380 8.631 0.749 25768 3646 1 4 . 1 1 206 206 LYS N N 206 126.970 126.970 127.785 -0.815 25768 3647 1 4 . 1 1 206 206 LYS C C 206 174.210 174.210 175.537 -1.327 25768 3648 1 4 . 1 1 206 206 LYS CA C 206 54.770 54.770 55.467 -0.697 25768 3649 1 4 . 1 1 206 206 LYS CB C 206 34.440 34.440 33.690 0.750 25768 3650 1 4 . 1 1 206 206 LYS H H 206 8.380 8.380 8.380 -0.000 25768 3651 1 4 . 1 1 207 207 PHE N N 207 126.330 126.330 127.283 -0.953 25768 3652 1 4 . 1 1 207 207 PHE C C 207 175.020 175.020 174.239 0.781 25768 3653 1 4 . 1 1 207 207 PHE CA C 207 58.170 58.170 58.424 -0.254 25768 3654 1 4 . 1 1 207 207 PHE CB C 207 40.920 40.920 40.694 0.226 25768 3655 1 4 . 1 1 207 207 PHE H H 207 9.290 9.290 8.093 1.197 25768 3656 1 4 . 1 1 208 208 LEU N N 208 122.740 122.740 124.832 -2.092 25768 3657 1 4 . 1 1 208 208 LEU C C 208 176.510 176.510 176.095 0.415 25768 3658 1 4 . 1 1 208 208 LEU CA C 208 54.910 54.910 54.090 0.820 25768 3659 1 4 . 1 1 208 208 LEU CB C 208 43.830 43.830 45.254 -1.424 25768 3660 1 4 . 1 1 208 208 LEU H H 208 8.310 8.310 7.698 0.612 25768 3661 1 5 . 1 1 2 2 HIS C C 2 175.310 175.310 173.739 1.571 25768 3662 1 5 . 1 1 3 3 LYS N N 3 122.080 122.080 121.037 1.043 25768 3663 1 5 . 1 1 3 3 LYS C C 3 173.490 173.490 175.364 -1.874 25768 3664 1 5 . 1 1 3 3 LYS CA C 3 55.050 55.050 55.066 -0.016 25768 3665 1 5 . 1 1 3 3 LYS CB C 3 35.380 35.380 34.855 0.525 25768 3666 1 5 . 1 1 3 3 LYS H H 3 8.620 8.620 8.367 0.253 25768 3667 1 5 . 1 1 4 4 ALA N N 4 120.860 120.860 122.315 -1.455 25768 3668 1 5 . 1 1 4 4 ALA C C 4 178.190 178.190 177.381 0.809 25768 3669 1 5 . 1 1 4 4 ALA CA C 4 53.480 53.480 52.839 0.641 25768 3670 1 5 . 1 1 4 4 ALA CB C 4 18.140 18.140 17.220 0.920 25768 3671 1 5 . 1 1 4 4 ALA H H 4 8.580 8.580 8.271 0.309 25768 3672 1 5 . 1 1 5 5 GLY N N 5 112.890 112.890 112.965 -0.075 25768 3673 1 5 . 1 1 5 5 GLY C C 5 173.830 173.830 173.786 0.044 25768 3674 1 5 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.462 0.417 25768 3675 1 5 . 1 1 5 5 GLY H H 5 9.210 9.210 8.269 0.941 25768 3676 1 5 . 1 1 6 6 ASP N N 6 121.590 121.590 120.723 0.867 25768 3677 1 5 . 1 1 6 6 ASP C C 6 174.380 174.380 174.814 -0.434 25768 3678 1 5 . 1 1 6 6 ASP CA C 6 55.790 55.790 55.028 0.763 25768 3679 1 5 . 1 1 6 6 ASP CB C 6 41.760 41.760 41.821 -0.061 25768 3680 1 5 . 1 1 6 6 ASP H H 6 7.620 7.620 7.562 0.058 25768 3681 1 5 . 1 1 7 7 PHE N N 7 120.860 120.860 126.352 -5.492 25768 3682 1 5 . 1 1 7 7 PHE C C 7 174.050 174.050 173.893 0.157 25768 3683 1 5 . 1 1 7 7 PHE CA C 7 56.110 56.110 56.568 -0.458 25768 3684 1 5 . 1 1 7 7 PHE CB C 7 42.550 42.550 42.553 -0.003 25768 3685 1 5 . 1 1 7 7 PHE H H 7 8.250 8.250 8.424 -0.174 25768 3686 1 5 . 1 1 8 8 ILE N N 8 127.950 127.950 123.910 4.040 25768 3687 1 5 . 1 1 8 8 ILE C C 8 174.000 174.000 174.680 -0.680 25768 3688 1 5 . 1 1 8 8 ILE CA C 8 61.160 61.160 58.062 3.099 25768 3689 1 5 . 1 1 8 8 ILE CB C 8 42.660 42.660 42.150 0.510 25768 3690 1 5 . 1 1 8 8 ILE H H 8 9.230 9.230 8.076 1.154 25768 3691 1 5 . 1 1 9 9 ILE N N 9 125.380 125.380 125.143 0.237 25768 3692 1 5 . 1 1 9 9 ILE C C 9 173.630 173.630 175.069 -1.439 25768 3693 1 5 . 1 1 9 9 ILE CA C 9 59.600 59.600 60.972 -1.372 25768 3694 1 5 . 1 1 9 9 ILE CB C 9 41.180 41.180 39.061 2.119 25768 3695 1 5 . 1 1 9 9 ILE H H 9 8.580 8.580 8.870 -0.290 25768 3696 1 5 . 1 1 10 10 ARG N N 10 124.950 124.950 127.747 -2.797 25768 3697 1 5 . 1 1 10 10 ARG C C 10 175.030 175.030 175.885 -0.855 25768 3698 1 5 . 1 1 10 10 ARG CA C 10 53.920 53.920 54.077 -0.157 25768 3699 1 5 . 1 1 10 10 ARG CB C 10 31.880 31.880 33.391 -1.511 25768 3700 1 5 . 1 1 10 10 ARG H H 10 9.230 9.230 8.641 0.589 25768 3701 1 5 . 1 1 11 11 GLY N N 11 105.650 105.650 112.996 -7.346 25768 3702 1 5 . 1 1 11 11 GLY C C 11 172.090 172.090 172.598 -0.508 25768 3703 1 5 . 1 1 11 11 GLY CA C 11 44.460 44.460 45.091 -0.631 25768 3704 1 5 . 1 1 11 11 GLY H H 11 8.780 8.780 8.062 0.718 25768 3705 1 5 . 1 1 12 12 GLY N N 12 107.800 107.800 112.097 -4.297 25768 3706 1 5 . 1 1 12 12 GLY C C 12 171.460 171.460 171.505 -0.045 25768 3707 1 5 . 1 1 12 12 GLY CA C 12 46.630 46.630 45.432 1.198 25768 3708 1 5 . 1 1 12 12 GLY H H 12 8.510 8.510 8.448 0.062 25768 3709 1 5 . 1 1 13 13 PHE N N 13 119.900 119.900 117.989 1.911 25768 3710 1 5 . 1 1 13 13 PHE C C 13 174.190 174.190 173.676 0.514 25768 3711 1 5 . 1 1 13 13 PHE CA C 13 56.340 56.340 56.702 -0.362 25768 3712 1 5 . 1 1 13 13 PHE CB C 13 41.090 41.090 43.790 -2.700 25768 3713 1 5 . 1 1 13 13 PHE H H 13 8.610 8.610 8.975 -0.365 25768 3714 1 5 . 1 1 14 14 ALA N N 14 128.030 128.030 124.294 3.736 25768 3715 1 5 . 1 1 14 14 ALA C C 14 176.560 176.560 176.649 -0.089 25768 3716 1 5 . 1 1 14 14 ALA CA C 14 49.940 49.940 51.159 -1.219 25768 3717 1 5 . 1 1 14 14 ALA CB C 14 20.360 20.360 22.025 -1.665 25768 3718 1 5 . 1 1 14 14 ALA H H 14 9.220 9.220 8.799 0.421 25768 3719 1 5 . 1 1 15 15 THR N N 15 118.620 118.620 116.940 1.680 25768 3720 1 5 . 1 1 15 15 THR CA C 15 61.440 61.440 61.298 0.142 25768 3721 1 5 . 1 1 15 15 THR CB C 15 71.370 71.370 69.360 2.010 25768 3722 1 5 . 1 1 15 15 THR H H 15 9.220 9.220 7.837 1.383 25768 3723 1 5 . 1 1 18 18 PRO C C 18 176.690 176.690 176.509 0.181 25768 3724 1 5 . 1 1 18 18 PRO CA C 18 63.610 63.610 63.545 0.065 25768 3725 1 5 . 1 1 18 18 PRO CB C 18 32.440 32.440 32.097 0.343 25768 3726 1 5 . 1 1 19 19 ASP N N 19 120.320 120.320 121.424 -1.104 25768 3727 1 5 . 1 1 19 19 ASP C C 19 175.950 175.950 176.595 -0.645 25768 3728 1 5 . 1 1 19 19 ASP CA C 19 54.710 54.710 54.517 0.193 25768 3729 1 5 . 1 1 19 19 ASP CB C 19 41.450 41.450 40.955 0.495 25768 3730 1 5 . 1 1 19 19 ASP H H 19 8.330 8.330 8.443 -0.113 25768 3731 1 5 . 1 1 20 20 ASP N N 20 121.990 121.990 120.812 1.178 25768 3732 1 5 . 1 1 20 20 ASP C C 20 176.760 176.760 176.252 0.508 25768 3733 1 5 . 1 1 20 20 ASP CA C 20 54.470 54.470 55.502 -1.032 25768 3734 1 5 . 1 1 20 20 ASP CB C 20 41.310 41.310 41.202 0.108 25768 3735 1 5 . 1 1 20 20 ASP H H 20 8.240 8.240 8.555 -0.315 25768 3736 1 5 . 1 1 21 21 SER N N 21 117.050 117.050 113.743 3.307 25768 3737 1 5 . 1 1 21 21 SER C C 21 175.170 175.170 173.327 1.843 25768 3738 1 5 . 1 1 21 21 SER CA C 21 59.490 59.490 57.691 1.799 25768 3739 1 5 . 1 1 21 21 SER CB C 21 64.080 64.080 62.928 1.153 25768 3740 1 5 . 1 1 21 21 SER H H 21 8.360 8.360 7.716 0.644 25768 3741 1 5 . 1 1 22 22 SER N N 22 117.820 117.820 120.718 -2.898 25768 3742 1 5 . 1 1 22 22 SER C C 22 174.940 174.940 174.131 0.809 25768 3743 1 5 . 1 1 22 22 SER CA C 22 59.160 59.160 58.735 0.425 25768 3744 1 5 . 1 1 22 22 SER CB C 22 64.110 64.110 63.787 0.323 25768 3745 1 5 . 1 1 22 22 SER H H 22 8.310 8.310 8.486 -0.176 25768 3746 1 5 . 1 1 23 23 SER N N 23 117.660 117.660 119.103 -1.443 25768 3747 1 5 . 1 1 23 23 SER C C 23 174.340 174.340 174.510 -0.170 25768 3748 1 5 . 1 1 23 23 SER CA C 23 59.050 59.050 59.303 -0.253 25768 3749 1 5 . 1 1 23 23 SER CB C 23 64.210 64.210 63.476 0.734 25768 3750 1 5 . 1 1 23 23 SER H H 23 8.120 8.120 8.521 -0.401 25768 3751 1 5 . 1 1 24 24 ASP N N 24 122.590 122.590 119.008 3.582 25768 3752 1 5 . 1 1 24 24 ASP C C 24 176.250 176.250 174.818 1.432 25768 3753 1 5 . 1 1 24 24 ASP CA C 24 54.910 54.910 53.346 1.564 25768 3754 1 5 . 1 1 24 24 ASP CB C 24 41.270 41.270 44.012 -2.742 25768 3755 1 5 . 1 1 24 24 ASP H H 24 8.230 8.230 7.730 0.500 25768 3756 1 5 . 1 1 25 25 ILE N N 25 120.650 120.650 119.378 1.272 25768 3757 1 5 . 1 1 25 25 ILE C C 25 176.190 176.190 175.695 0.495 25768 3758 1 5 . 1 1 25 25 ILE CA C 25 61.880 61.880 62.086 -0.206 25768 3759 1 5 . 1 1 25 25 ILE CB C 25 38.730 38.730 37.380 1.350 25768 3760 1 5 . 1 1 25 25 ILE H H 25 7.860 7.860 8.392 -0.532 25768 3761 1 5 . 1 1 26 26 LYS N N 26 124.420 124.420 127.167 -2.747 25768 3762 1 5 . 1 1 26 26 LYS C C 26 176.640 176.640 175.967 0.673 25768 3763 1 5 . 1 1 26 26 LYS CA C 26 56.520 56.520 55.042 1.478 25768 3764 1 5 . 1 1 26 26 LYS CB C 26 32.890 32.890 34.427 -1.537 25768 3765 1 5 . 1 1 26 26 LYS H H 26 8.140 8.140 8.402 -0.262 25768 3766 1 5 . 1 1 27 27 LEU N N 27 123.120 123.120 123.133 -0.013 25768 3767 1 5 . 1 1 27 27 LEU C C 27 177.110 177.110 177.286 -0.176 25768 3768 1 5 . 1 1 27 27 LEU CA C 27 55.590 55.590 54.792 0.798 25768 3769 1 5 . 1 1 27 27 LEU CB C 27 42.500 42.500 42.113 0.387 25768 3770 1 5 . 1 1 27 27 LEU H H 27 8.080 8.080 8.304 -0.224 25768 3771 1 5 . 1 1 28 28 ASP N N 28 120.850 120.850 121.203 -0.353 25768 3772 1 5 . 1 1 28 28 ASP C C 28 176.960 176.960 176.478 0.482 25768 3773 1 5 . 1 1 28 28 ASP CA C 28 54.800 54.800 54.901 -0.101 25768 3774 1 5 . 1 1 28 28 ASP CB C 28 41.380 41.380 41.635 -0.255 25768 3775 1 5 . 1 1 28 28 ASP H H 28 8.180 8.180 8.349 -0.169 25768 3776 1 5 . 1 1 29 29 GLY N N 29 109.800 109.800 108.027 1.773 25768 3777 1 5 . 1 1 29 29 GLY C C 29 174.370 174.370 173.513 0.857 25768 3778 1 5 . 1 1 29 29 GLY CA C 29 46.150 46.150 45.219 0.931 25768 3779 1 5 . 1 1 29 29 GLY H H 29 8.230 8.230 8.415 -0.185 25768 3780 1 5 . 1 1 30 30 ALA N N 30 123.880 123.880 126.606 -2.726 25768 3781 1 5 . 1 1 30 30 ALA C C 30 178.040 178.040 176.518 1.522 25768 3782 1 5 . 1 1 30 30 ALA CA C 30 53.140 53.140 51.830 1.310 25768 3783 1 5 . 1 1 30 30 ALA CB C 30 19.350 19.350 19.008 0.342 25768 3784 1 5 . 1 1 30 30 ALA H H 30 8.040 8.040 8.289 -0.249 25768 3785 1 5 . 1 1 31 31 LYS N N 31 119.800 119.800 119.475 0.325 25768 3786 1 5 . 1 1 31 31 LYS C C 31 176.770 176.770 175.567 1.203 25768 3787 1 5 . 1 1 31 31 LYS CA C 31 56.870 56.870 55.693 1.177 25768 3788 1 5 . 1 1 31 31 LYS CB C 31 32.980 32.980 33.351 -0.371 25768 3789 1 5 . 1 1 31 31 LYS H H 31 8.060 8.060 7.662 0.398 25768 3790 1 5 . 1 1 32 32 GLN N N 32 120.930 120.930 121.849 -0.919 25768 3791 1 5 . 1 1 32 32 GLN C C 32 176.000 176.000 175.769 0.231 25768 3792 1 5 . 1 1 32 32 GLN CA C 32 56.280 56.280 55.712 0.568 25768 3793 1 5 . 1 1 32 32 GLN CB C 32 29.580 29.580 30.958 -1.378 25768 3794 1 5 . 1 1 32 32 GLN H H 32 8.170 8.170 8.552 -0.382 25768 3795 1 5 . 1 1 33 33 ARG N N 33 122.370 122.370 123.477 -1.107 25768 3796 1 5 . 1 1 33 33 ARG C C 33 176.820 176.820 176.687 0.133 25768 3797 1 5 . 1 1 33 33 ARG CA C 33 56.680 56.680 56.760 -0.080 25768 3798 1 5 . 1 1 33 33 ARG CB C 33 31.040 31.040 30.669 0.371 25768 3799 1 5 . 1 1 33 33 ARG H H 33 8.270 8.270 8.767 -0.497 25768 3800 1 5 . 1 1 34 34 GLY N N 34 110.210 110.210 108.200 2.010 25768 3801 1 5 . 1 1 34 34 GLY C C 34 174.280 174.280 173.523 0.757 25768 3802 1 5 . 1 1 34 34 GLY CA C 34 45.770 45.770 44.974 0.796 25768 3803 1 5 . 1 1 34 34 GLY H H 34 8.360 8.360 7.858 0.502 25768 3804 1 5 . 1 1 35 35 THR N N 35 114.100 114.100 112.933 1.167 25768 3805 1 5 . 1 1 35 35 THR C C 35 174.550 174.550 173.482 1.068 25768 3806 1 5 . 1 1 35 35 THR CA C 35 62.140 62.140 62.190 -0.050 25768 3807 1 5 . 1 1 35 35 THR CB C 35 70.330 70.330 68.822 1.508 25768 3808 1 5 . 1 1 35 35 THR H H 35 7.970 7.970 8.329 -0.359 25768 3809 1 5 . 1 1 36 36 LYS N N 36 123.850 123.850 124.205 -0.355 25768 3810 1 5 . 1 1 36 36 LYS C C 36 176.040 176.040 174.386 1.654 25768 3811 1 5 . 1 1 36 36 LYS CA C 36 56.600 56.600 56.698 -0.098 25768 3812 1 5 . 1 1 36 36 LYS CB C 36 33.280 33.280 34.118 -0.839 25768 3813 1 5 . 1 1 36 36 LYS H H 36 8.230 8.230 8.021 0.209 25768 3814 1 5 . 1 1 37 37 ALA N N 37 125.650 125.650 124.423 1.227 25768 3815 1 5 . 1 1 37 37 ALA C C 37 177.570 177.570 176.478 1.092 25768 3816 1 5 . 1 1 37 37 ALA CA C 37 52.860 52.860 52.297 0.563 25768 3817 1 5 . 1 1 37 37 ALA CB C 37 19.610 19.610 19.812 -0.202 25768 3818 1 5 . 1 1 37 37 ALA H H 37 8.290 8.290 8.336 -0.046 25768 3819 1 5 . 1 1 38 38 THR N N 38 113.350 113.350 115.547 -2.197 25768 3820 1 5 . 1 1 38 38 THR C C 38 174.540 174.540 174.922 -0.382 25768 3821 1 5 . 1 1 38 38 THR CA C 38 62.010 62.010 62.404 -0.394 25768 3822 1 5 . 1 1 38 38 THR CB C 38 70.350 70.350 68.700 1.650 25768 3823 1 5 . 1 1 38 38 THR H H 38 7.970 7.970 8.167 -0.197 25768 3824 1 5 . 1 1 39 39 VAL N N 39 120.790 120.790 122.539 -1.749 25768 3825 1 5 . 1 1 39 39 VAL C C 39 175.620 175.620 176.127 -0.507 25768 3826 1 5 . 1 1 39 39 VAL CA C 39 62.470 62.470 63.588 -1.118 25768 3827 1 5 . 1 1 39 39 VAL CB C 39 32.940 32.940 31.911 1.029 25768 3828 1 5 . 1 1 39 39 VAL H H 39 8.020 8.020 8.067 -0.047 25768 3829 1 5 . 1 1 40 40 ASP N N 40 123.690 123.690 118.874 4.816 25768 3830 1 5 . 1 1 40 40 ASP C C 40 176.190 176.190 176.257 -0.067 25768 3831 1 5 . 1 1 40 40 ASP CA C 40 54.780 54.780 54.319 0.461 25768 3832 1 5 . 1 1 40 40 ASP CB C 40 41.590 41.590 40.719 0.871 25768 3833 1 5 . 1 1 40 40 ASP H H 40 8.310 8.310 8.190 0.120 25768 3834 1 5 . 1 1 41 41 SER N N 41 115.470 115.470 116.130 -0.660 25768 3835 1 5 . 1 1 41 41 SER C C 41 174.170 174.170 174.420 -0.250 25768 3836 1 5 . 1 1 41 41 SER CA C 41 59.000 59.000 59.728 -0.729 25768 3837 1 5 . 1 1 41 41 SER CB C 41 64.420 64.420 63.713 0.707 25768 3838 1 5 . 1 1 41 41 SER H H 41 8.130 8.130 8.275 -0.145 25768 3839 1 5 . 1 1 42 42 ASP N N 42 122.430 122.430 122.381 0.049 25768 3840 1 5 . 1 1 42 42 ASP C C 42 175.740 175.740 175.211 0.529 25768 3841 1 5 . 1 1 42 42 ASP CA C 42 54.780 54.780 54.711 0.069 25768 3842 1 5 . 1 1 42 42 ASP CB C 42 41.620 41.620 41.434 0.186 25768 3843 1 5 . 1 1 42 42 ASP H H 42 8.410 8.410 8.290 0.120 25768 3844 1 5 . 1 1 43 43 THR N N 43 117.580 117.580 114.726 2.854 25768 3845 1 5 . 1 1 43 43 THR C C 43 173.630 173.630 173.911 -0.281 25768 3846 1 5 . 1 1 43 43 THR CA C 43 63.120 63.120 60.583 2.537 25768 3847 1 5 . 1 1 43 43 THR CB C 43 70.650 70.650 70.677 -0.027 25768 3848 1 5 . 1 1 43 43 THR H H 43 8.010 8.010 8.368 -0.358 25768 3849 1 5 . 1 1 44 44 GLN N N 44 125.420 125.420 119.755 5.665 25768 3850 1 5 . 1 1 44 44 GLN C C 44 174.080 174.080 175.026 -0.946 25768 3851 1 5 . 1 1 44 44 GLN CA C 44 55.110 55.110 54.995 0.115 25768 3852 1 5 . 1 1 44 44 GLN CB C 44 31.570 31.570 31.961 -0.391 25768 3853 1 5 . 1 1 44 44 GLN H H 44 9.260 9.260 8.560 0.700 25768 3854 1 5 . 1 1 45 45 LEU N N 45 124.190 124.190 123.635 0.555 25768 3855 1 5 . 1 1 45 45 LEU C C 45 175.970 175.970 176.774 -0.804 25768 3856 1 5 . 1 1 45 45 LEU CA C 45 54.690 54.690 54.522 0.168 25768 3857 1 5 . 1 1 45 45 LEU CB C 45 42.270 42.270 42.052 0.218 25768 3858 1 5 . 1 1 45 45 LEU H H 45 8.550 8.550 8.935 -0.385 25768 3859 1 5 . 1 1 46 46 GLY N N 46 113.310 113.310 113.587 -0.277 25768 3860 1 5 . 1 1 46 46 GLY C C 46 171.180 171.180 172.841 -1.661 25768 3861 1 5 . 1 1 46 46 GLY CA C 46 44.400 44.400 45.059 -0.659 25768 3862 1 5 . 1 1 46 46 GLY H H 46 8.810 8.810 8.730 0.080 25768 3863 1 5 . 1 1 47 47 LEU N N 47 123.890 123.890 129.278 -5.388 25768 3864 1 5 . 1 1 47 47 LEU C C 47 175.400 175.400 175.599 -0.199 25768 3865 1 5 . 1 1 47 47 LEU CA C 47 53.750 53.750 54.122 -0.372 25768 3866 1 5 . 1 1 47 47 LEU CB C 47 46.800 46.800 44.661 2.139 25768 3867 1 5 . 1 1 47 47 LEU H H 47 8.590 8.590 8.280 0.310 25768 3868 1 5 . 1 1 48 48 THR N N 48 111.210 111.210 118.073 -6.863 25768 3869 1 5 . 1 1 48 48 THR C C 48 172.520 172.520 172.647 -0.127 25768 3870 1 5 . 1 1 48 48 THR CA C 48 58.950 58.950 60.991 -2.041 25768 3871 1 5 . 1 1 48 48 THR CB C 48 72.360 72.360 71.959 0.401 25768 3872 1 5 . 1 1 48 48 THR H H 48 8.620 8.620 7.776 0.844 25768 3873 1 5 . 1 1 49 49 PHE N N 49 118.810 118.810 123.071 -4.261 25768 3874 1 5 . 1 1 49 49 PHE C C 49 174.700 174.700 175.663 -0.963 25768 3875 1 5 . 1 1 49 49 PHE CA C 49 55.080 55.080 55.975 -0.895 25768 3876 1 5 . 1 1 49 49 PHE CB C 49 42.360 42.360 40.949 1.411 25768 3877 1 5 . 1 1 49 49 PHE H H 49 8.410 8.410 8.899 -0.489 25768 3878 1 5 . 1 1 50 50 THR N N 50 121.230 121.230 120.481 0.749 25768 3879 1 5 . 1 1 50 50 THR C C 50 173.250 173.250 173.037 0.213 25768 3880 1 5 . 1 1 50 50 THR CA C 50 62.740 62.740 62.526 0.214 25768 3881 1 5 . 1 1 50 50 THR CB C 50 73.740 73.740 69.261 4.479 25768 3882 1 5 . 1 1 50 50 THR H H 50 9.330 9.330 8.721 0.609 25768 3883 1 5 . 1 1 51 51 TYR N N 51 126.010 126.010 129.828 -3.818 25768 3884 1 5 . 1 1 51 51 TYR C C 51 174.850 174.850 173.817 1.033 25768 3885 1 5 . 1 1 51 51 TYR CA C 51 56.240 56.240 56.496 -0.256 25768 3886 1 5 . 1 1 51 51 TYR CB C 51 41.630 41.630 41.163 0.468 25768 3887 1 5 . 1 1 51 51 TYR H H 51 9.150 9.150 9.399 -0.249 25768 3888 1 5 . 1 1 52 52 MET N N 52 127.390 127.390 122.854 4.536 25768 3889 1 5 . 1 1 52 52 MET C C 52 174.490 174.490 173.981 0.509 25768 3890 1 5 . 1 1 52 52 MET CA C 52 52.450 52.450 54.072 -1.622 25768 3891 1 5 . 1 1 52 52 MET CB C 52 28.590 28.590 36.061 -7.471 25768 3892 1 5 . 1 1 52 52 MET H H 52 7.950 7.950 7.886 0.064 25768 3893 1 5 . 1 1 53 53 PHE N N 53 123.830 123.830 123.057 0.773 25768 3894 1 5 . 1 1 53 53 PHE C C 53 173.720 173.720 174.926 -1.206 25768 3895 1 5 . 1 1 53 53 PHE CA C 53 57.110 57.110 56.861 0.249 25768 3896 1 5 . 1 1 53 53 PHE CB C 53 39.420 39.420 39.605 -0.185 25768 3897 1 5 . 1 1 53 53 PHE H H 53 7.720 7.720 8.786 -1.066 25768 3898 1 5 . 1 1 54 54 ALA N N 54 125.650 125.650 129.155 -3.505 25768 3899 1 5 . 1 1 54 54 ALA C C 54 175.020 175.020 176.331 -1.311 25768 3900 1 5 . 1 1 54 54 ALA CA C 54 50.740 50.740 52.994 -2.254 25768 3901 1 5 . 1 1 54 54 ALA CB C 54 22.700 22.700 18.812 3.888 25768 3902 1 5 . 1 1 54 54 ALA H H 54 8.360 8.360 7.621 0.739 25768 3903 1 5 . 1 1 55 55 ASP N N 55 118.790 118.790 119.358 -0.568 25768 3904 1 5 . 1 1 55 55 ASP C C 55 174.780 174.780 175.461 -0.681 25768 3905 1 5 . 1 1 55 55 ASP CA C 55 58.590 58.590 53.837 4.753 25768 3906 1 5 . 1 1 55 55 ASP CB C 55 40.430 40.430 39.615 0.815 25768 3907 1 5 . 1 1 55 55 ASP H H 55 8.590 8.590 8.718 -0.128 25768 3908 1 5 . 1 1 56 56 LYS N N 56 106.200 106.200 116.811 -10.611 25768 3909 1 5 . 1 1 56 56 LYS C C 56 174.940 174.940 174.731 0.209 25768 3910 1 5 . 1 1 56 56 LYS CA C 56 55.260 55.260 56.178 -0.919 25768 3911 1 5 . 1 1 56 56 LYS CB C 56 34.510 34.510 34.236 0.274 25768 3912 1 5 . 1 1 56 56 LYS H H 56 7.260 7.260 7.553 -0.293 25768 3913 1 5 . 1 1 57 57 TRP N N 57 115.680 115.680 120.361 -4.681 25768 3914 1 5 . 1 1 57 57 TRP C C 57 173.940 173.940 175.736 -1.796 25768 3915 1 5 . 1 1 57 57 TRP CA C 57 55.410 55.410 57.719 -2.309 25768 3916 1 5 . 1 1 57 57 TRP CB C 57 34.470 34.470 31.964 2.506 25768 3917 1 5 . 1 1 57 57 TRP H H 57 6.570 6.570 7.827 -1.257 25768 3918 1 5 . 1 1 58 58 GLY N N 58 107.610 107.610 105.871 1.739 25768 3919 1 5 . 1 1 58 58 GLY C C 58 172.730 172.730 172.555 0.175 25768 3920 1 5 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.462 -0.412 25768 3921 1 5 . 1 1 58 58 GLY H H 58 9.260 9.260 8.567 0.693 25768 3922 1 5 . 1 1 59 59 VAL N N 59 118.130 118.130 122.322 -4.192 25768 3923 1 5 . 1 1 59 59 VAL C C 59 173.000 173.000 173.658 -0.658 25768 3924 1 5 . 1 1 59 59 VAL CA C 59 59.950 59.950 60.431 -0.481 25768 3925 1 5 . 1 1 59 59 VAL CB C 59 35.170 35.170 36.325 -1.155 25768 3926 1 5 . 1 1 59 59 VAL H H 59 9.030 9.030 8.538 0.492 25768 3927 1 5 . 1 1 60 60 GLU N N 60 127.900 127.900 124.431 3.469 25768 3928 1 5 . 1 1 60 60 GLU C C 60 174.470 174.470 174.173 0.297 25768 3929 1 5 . 1 1 60 60 GLU CA C 60 52.940 52.940 54.516 -1.576 25768 3930 1 5 . 1 1 60 60 GLU CB C 60 35.100 35.100 34.751 0.349 25768 3931 1 5 . 1 1 60 60 GLU H H 60 9.440 9.440 9.062 0.378 25768 3932 1 5 . 1 1 61 61 LEU N N 61 127.410 127.410 124.387 3.023 25768 3933 1 5 . 1 1 61 61 LEU C C 61 174.950 174.950 175.388 -0.438 25768 3934 1 5 . 1 1 61 61 LEU CA C 61 53.390 53.390 54.252 -0.862 25768 3935 1 5 . 1 1 61 61 LEU CB C 61 45.980 45.980 45.742 0.238 25768 3936 1 5 . 1 1 61 61 LEU H H 61 8.740 8.740 8.488 0.252 25768 3937 1 5 . 1 1 62 62 VAL N N 62 125.750 125.750 122.857 2.893 25768 3938 1 5 . 1 1 62 62 VAL C C 62 173.960 173.960 174.522 -0.562 25768 3939 1 5 . 1 1 62 62 VAL CA C 62 61.350 61.350 60.882 0.468 25768 3940 1 5 . 1 1 62 62 VAL CB C 62 34.740 34.740 33.841 0.899 25768 3941 1 5 . 1 1 62 62 VAL H H 62 8.790 8.790 8.964 -0.174 25768 3942 1 5 . 1 1 63 63 ALA N N 63 127.230 127.230 124.915 2.315 25768 3943 1 5 . 1 1 63 63 ALA C C 63 173.930 173.930 174.564 -0.634 25768 3944 1 5 . 1 1 63 63 ALA CA C 63 51.140 51.140 52.050 -0.910 25768 3945 1 5 . 1 1 63 63 ALA CB C 63 22.500 22.500 21.642 0.858 25768 3946 1 5 . 1 1 63 63 ALA H H 63 8.740 8.740 8.613 0.127 25768 3947 1 5 . 1 1 64 64 ALA N N 64 120.410 120.410 124.799 -4.389 25768 3948 1 5 . 1 1 64 64 ALA C C 64 176.770 176.770 176.874 -0.104 25768 3949 1 5 . 1 1 64 64 ALA CA C 64 51.420 51.420 50.285 1.135 25768 3950 1 5 . 1 1 64 64 ALA CB C 64 22.590 22.590 20.811 1.779 25768 3951 1 5 . 1 1 64 64 ALA H H 64 8.290 8.290 8.291 -0.001 25768 3952 1 5 . 1 1 65 65 THR N N 65 116.130 116.130 116.586 -0.456 25768 3953 1 5 . 1 1 65 65 THR C C 65 171.220 171.220 172.138 -0.918 25768 3954 1 5 . 1 1 65 65 THR CA C 65 58.860 58.860 59.785 -0.925 25768 3955 1 5 . 1 1 65 65 THR CB C 65 72.020 72.020 68.861 3.159 25768 3956 1 5 . 1 1 65 65 THR H H 65 8.760 8.760 8.213 0.547 25768 3957 1 5 . 1 1 66 66 PRO C C 66 176.720 176.720 175.622 1.098 25768 3958 1 5 . 1 1 66 66 PRO CA C 66 63.610 63.610 63.086 0.524 25768 3959 1 5 . 1 1 66 66 PRO CB C 66 32.550 32.550 32.229 0.321 25768 3960 1 5 . 1 1 67 67 PHE N N 67 120.360 120.360 121.249 -0.889 25768 3961 1 5 . 1 1 67 67 PHE C C 67 175.480 175.480 175.231 0.249 25768 3962 1 5 . 1 1 67 67 PHE CA C 67 58.840 58.840 58.048 0.792 25768 3963 1 5 . 1 1 67 67 PHE CB C 67 40.170 40.170 39.923 0.247 25768 3964 1 5 . 1 1 67 67 PHE H H 67 8.590 8.590 8.398 0.192 25768 3965 1 5 . 1 1 68 68 ASN N N 68 119.030 119.030 118.835 0.195 25768 3966 1 5 . 1 1 68 68 ASN C C 68 174.740 174.740 173.945 0.795 25768 3967 1 5 . 1 1 68 68 ASN CA C 68 53.430 53.430 52.340 1.090 25768 3968 1 5 . 1 1 68 68 ASN CB C 68 39.420 39.420 39.825 -0.406 25768 3969 1 5 . 1 1 68 68 ASN H H 68 8.340 8.340 8.055 0.285 25768 3970 1 5 . 1 1 69 69 HIS N N 69 119.590 119.590 119.843 -0.253 25768 3971 1 5 . 1 1 69 69 HIS C C 69 174.370 174.370 175.691 -1.321 25768 3972 1 5 . 1 1 69 69 HIS CA C 69 55.950 55.950 56.042 -0.092 25768 3973 1 5 . 1 1 69 69 HIS CB C 69 29.960 29.960 31.130 -1.170 25768 3974 1 5 . 1 1 69 69 HIS H H 69 8.350 8.350 8.565 -0.215 25768 3975 1 5 . 1 1 70 70 GLN N N 70 121.980 121.980 123.209 -1.229 25768 3976 1 5 . 1 1 70 70 GLN C C 70 175.740 175.740 175.391 0.349 25768 3977 1 5 . 1 1 70 70 GLN CA C 70 56.340 56.340 57.509 -1.169 25768 3978 1 5 . 1 1 70 70 GLN CB C 70 29.660 29.660 29.125 0.535 25768 3979 1 5 . 1 1 70 70 GLN H H 70 8.350 8.350 8.875 -0.525 25768 3980 1 5 . 1 1 71 71 VAL N N 71 120.530 120.530 115.765 4.765 25768 3981 1 5 . 1 1 71 71 VAL C C 71 175.500 175.500 174.442 1.058 25768 3982 1 5 . 1 1 71 71 VAL CA C 71 62.540 62.540 61.909 0.631 25768 3983 1 5 . 1 1 71 71 VAL CB C 71 33.090 33.090 31.436 1.654 25768 3984 1 5 . 1 1 71 71 VAL H H 71 8.020 8.020 7.898 0.122 25768 3985 1 5 . 1 1 72 72 ASP N N 72 123.910 123.910 121.666 2.244 25768 3986 1 5 . 1 1 72 72 ASP C C 72 176.300 176.300 176.114 0.186 25768 3987 1 5 . 1 1 72 72 ASP CA C 72 54.340 54.340 53.520 0.820 25768 3988 1 5 . 1 1 72 72 ASP CB C 72 41.480 41.480 41.503 -0.023 25768 3989 1 5 . 1 1 72 72 ASP H H 72 8.280 8.280 7.911 0.369 25768 3990 1 5 . 1 1 73 73 VAL N N 73 120.580 120.580 118.475 2.105 25768 3991 1 5 . 1 1 73 73 VAL C C 73 176.350 176.350 176.294 0.056 25768 3992 1 5 . 1 1 73 73 VAL CA C 73 62.970 62.970 63.808 -0.838 25768 3993 1 5 . 1 1 73 73 VAL CB C 73 32.550 32.550 31.952 0.598 25768 3994 1 5 . 1 1 73 73 VAL H H 73 7.960 7.960 8.349 -0.389 25768 3995 1 5 . 1 1 74 74 LYS N N 74 123.620 123.620 117.942 5.678 25768 3996 1 5 . 1 1 74 74 LYS C C 74 177.130 177.130 175.559 1.571 25768 3997 1 5 . 1 1 74 74 LYS CA C 74 57.060 57.060 57.342 -0.282 25768 3998 1 5 . 1 1 74 74 LYS CB C 74 32.860 32.860 34.669 -1.809 25768 3999 1 5 . 1 1 74 74 LYS H H 74 8.230 8.230 8.098 0.132 25768 4000 1 5 . 1 1 75 75 GLY N N 75 109.370 109.370 108.791 0.579 25768 4001 1 5 . 1 1 75 75 GLY C C 75 174.030 174.030 173.525 0.505 25768 4002 1 5 . 1 1 75 75 GLY CA C 75 45.800 45.800 44.840 0.960 25768 4003 1 5 . 1 1 75 75 GLY H H 75 8.160 8.160 7.884 0.276 25768 4004 1 5 . 1 1 76 76 LEU N N 76 121.660 121.660 120.699 0.961 25768 4005 1 5 . 1 1 76 76 LEU C C 76 177.410 177.410 177.190 0.220 25768 4006 1 5 . 1 1 76 76 LEU CA C 76 55.410 55.410 54.811 0.599 25768 4007 1 5 . 1 1 76 76 LEU CB C 76 42.790 42.790 41.726 1.064 25768 4008 1 5 . 1 1 76 76 LEU H H 76 8.030 8.030 7.903 0.127 25768 4009 1 5 . 1 1 77 77 GLY N N 77 109.330 109.330 110.490 -1.160 25768 4010 1 5 . 1 1 77 77 GLY C C 77 171.800 171.800 173.223 -1.423 25768 4011 1 5 . 1 1 77 77 GLY CA C 77 44.990 44.990 44.051 0.939 25768 4012 1 5 . 1 1 77 77 GLY H H 77 8.100 8.100 8.398 -0.298 25768 4013 1 5 . 1 1 78 78 PRO C C 78 177.740 177.740 177.293 0.447 25768 4014 1 5 . 1 1 78 78 PRO CA C 78 63.890 63.890 63.624 0.266 25768 4015 1 5 . 1 1 78 78 PRO CB C 78 32.170 32.170 32.303 -0.133 25768 4016 1 5 . 1 1 79 79 GLY N N 79 109.530 109.530 105.927 3.603 25768 4017 1 5 . 1 1 79 79 GLY C C 79 174.460 174.460 174.028 0.432 25768 4018 1 5 . 1 1 79 79 GLY CA C 79 45.780 45.780 44.683 1.097 25768 4019 1 5 . 1 1 79 79 GLY H H 79 8.410 8.410 8.325 0.085 25768 4020 1 5 . 1 1 80 80 LEU N N 80 121.880 121.880 118.971 2.909 25768 4021 1 5 . 1 1 80 80 LEU C C 80 177.100 177.100 176.538 0.562 25768 4022 1 5 . 1 1 80 80 LEU CA C 80 55.720 55.720 55.080 0.640 25768 4023 1 5 . 1 1 80 80 LEU CB C 80 42.580 42.580 43.184 -0.604 25768 4024 1 5 . 1 1 80 80 LEU H H 80 8.010 8.010 7.908 0.102 25768 4025 1 5 . 1 1 81 81 ASP N N 81 119.990 119.990 121.334 -1.344 25768 4026 1 5 . 1 1 81 81 ASP C C 81 176.880 176.880 176.242 0.638 25768 4027 1 5 . 1 1 81 81 ASP CA C 81 54.770 54.770 53.885 0.885 25768 4028 1 5 . 1 1 81 81 ASP CB C 81 41.390 41.390 41.760 -0.370 25768 4029 1 5 . 1 1 81 81 ASP H H 81 8.220 8.220 8.003 0.217 25768 4030 1 5 . 1 1 82 82 GLY N N 82 109.270 109.270 109.328 -0.058 25768 4031 1 5 . 1 1 82 82 GLY C C 82 174.190 174.190 173.713 0.477 25768 4032 1 5 . 1 1 82 82 GLY CA C 82 45.990 45.990 44.539 1.451 25768 4033 1 5 . 1 1 82 82 GLY H H 82 8.170 8.170 8.246 -0.076 25768 4034 1 5 . 1 1 83 83 LYS N N 83 121.000 121.000 120.799 0.201 25768 4035 1 5 . 1 1 83 83 LYS C C 83 176.610 176.610 176.530 0.080 25768 4036 1 5 . 1 1 83 83 LYS CA C 83 56.620 56.620 55.702 0.918 25768 4037 1 5 . 1 1 83 83 LYS CB C 83 33.020 33.020 33.390 -0.370 25768 4038 1 5 . 1 1 83 83 LYS H H 83 7.970 7.970 8.359 -0.389 25768 4039 1 5 . 1 1 84 84 LEU N N 84 123.120 123.120 122.685 0.435 25768 4040 1 5 . 1 1 84 84 LEU C C 84 176.920 176.920 176.176 0.744 25768 4041 1 5 . 1 1 84 84 LEU CA C 84 55.550 55.550 54.704 0.846 25768 4042 1 5 . 1 1 84 84 LEU CB C 84 42.430 42.430 42.599 -0.169 25768 4043 1 5 . 1 1 84 84 LEU H H 84 8.130 8.130 8.462 -0.332 25768 4044 1 5 . 1 1 85 85 ALA N N 85 123.930 123.930 122.565 1.365 25768 4045 1 5 . 1 1 85 85 ALA C C 85 177.060 177.060 176.706 0.354 25768 4046 1 5 . 1 1 85 85 ALA CA C 85 52.790 52.790 51.992 0.798 25768 4047 1 5 . 1 1 85 85 ALA CB C 85 19.670 19.670 19.348 0.322 25768 4048 1 5 . 1 1 85 85 ALA H H 85 8.040 8.040 8.062 -0.022 25768 4049 1 5 . 1 1 86 86 ASP N N 86 119.760 119.760 119.379 0.381 25768 4050 1 5 . 1 1 86 86 ASP C C 86 175.820 175.820 176.316 -0.496 25768 4051 1 5 . 1 1 86 86 ASP CA C 86 54.520 54.520 54.601 -0.081 25768 4052 1 5 . 1 1 86 86 ASP CB C 86 41.390 41.390 41.221 0.169 25768 4053 1 5 . 1 1 86 86 ASP H H 86 8.110 8.110 8.327 -0.217 25768 4054 1 5 . 1 1 87 87 ILE N N 87 120.620 120.620 126.050 -5.430 25768 4055 1 5 . 1 1 87 87 ILE C C 87 175.740 175.740 176.119 -0.379 25768 4056 1 5 . 1 1 87 87 ILE CA C 87 61.160 61.160 62.911 -1.751 25768 4057 1 5 . 1 1 87 87 ILE CB C 87 39.260 39.260 37.069 2.191 25768 4058 1 5 . 1 1 87 87 ILE H H 87 7.800 7.800 8.621 -0.821 25768 4059 1 5 . 1 1 88 88 LYS N N 88 125.820 125.820 125.670 0.150 25768 4060 1 5 . 1 1 88 88 LYS C C 88 175.340 175.340 175.871 -0.531 25768 4061 1 5 . 1 1 88 88 LYS CA C 88 56.300 56.300 56.507 -0.207 25768 4062 1 5 . 1 1 88 88 LYS CB C 88 32.900 32.900 34.005 -1.105 25768 4063 1 5 . 1 1 88 88 LYS H H 88 8.250 8.250 8.440 -0.190 25768 4064 1 5 . 1 1 89 89 GLN N N 89 121.750 121.750 120.790 0.960 25768 4065 1 5 . 1 1 89 89 GLN C C 89 175.000 175.000 174.843 0.157 25768 4066 1 5 . 1 1 89 89 GLN CA C 89 55.210 55.210 55.234 -0.024 25768 4067 1 5 . 1 1 89 89 GLN CB C 89 30.570 30.570 29.948 0.622 25768 4068 1 5 . 1 1 89 89 GLN H H 89 8.000 8.000 8.043 -0.042 25768 4069 1 5 . 1 1 90 90 LEU N N 90 126.660 126.660 128.678 -2.018 25768 4070 1 5 . 1 1 90 90 LEU C C 90 174.240 174.240 174.849 -0.609 25768 4071 1 5 . 1 1 90 90 LEU CA C 90 52.720 52.720 52.347 0.373 25768 4072 1 5 . 1 1 90 90 LEU CB C 90 42.350 42.350 43.024 -0.674 25768 4073 1 5 . 1 1 90 90 LEU H H 90 8.630 8.630 8.491 0.139 25768 4074 1 5 . 1 1 92 92 PRO C C 92 173.900 173.900 176.765 -2.865 25768 4075 1 5 . 1 1 92 92 PRO CA C 92 63.320 63.320 62.902 0.418 25768 4076 1 5 . 1 1 92 92 PRO CB C 92 31.920 31.920 32.559 -0.639 25768 4077 1 5 . 1 1 93 93 THR N N 93 119.770 119.770 114.431 5.339 25768 4078 1 5 . 1 1 93 93 THR C C 93 171.360 171.360 174.162 -2.802 25768 4079 1 5 . 1 1 93 93 THR CA C 93 62.610 62.610 61.437 1.173 25768 4080 1 5 . 1 1 93 93 THR CB C 93 72.680 72.680 70.161 2.519 25768 4081 1 5 . 1 1 93 93 THR H H 93 8.290 8.290 8.420 -0.130 25768 4082 1 5 . 1 1 94 94 LEU N N 94 128.880 128.880 123.113 5.767 25768 4083 1 5 . 1 1 94 94 LEU C C 94 175.130 175.130 174.655 0.475 25768 4084 1 5 . 1 1 94 94 LEU CA C 94 53.520 53.520 53.816 -0.296 25768 4085 1 5 . 1 1 94 94 LEU CB C 94 46.140 46.140 42.950 3.191 25768 4086 1 5 . 1 1 94 94 LEU H H 94 8.680 8.680 8.835 -0.155 25768 4087 1 5 . 1 1 95 95 LEU N N 95 123.630 123.630 123.964 -0.334 25768 4088 1 5 . 1 1 95 95 LEU C C 95 175.540 175.540 175.108 0.432 25768 4089 1 5 . 1 1 95 95 LEU CA C 95 55.190 55.190 53.379 1.811 25768 4090 1 5 . 1 1 95 95 LEU CB C 95 45.300 45.300 46.421 -1.121 25768 4091 1 5 . 1 1 95 95 LEU H H 95 9.580 9.580 9.111 0.469 25768 4092 1 5 . 1 1 96 96 LEU N N 96 123.150 123.150 126.303 -3.153 25768 4093 1 5 . 1 1 96 96 LEU C C 96 174.960 174.960 175.186 -0.226 25768 4094 1 5 . 1 1 96 96 LEU CA C 96 54.420 54.420 54.543 -0.123 25768 4095 1 5 . 1 1 96 96 LEU CB C 96 44.560 44.560 43.646 0.914 25768 4096 1 5 . 1 1 96 96 LEU H H 96 8.770 8.770 9.057 -0.287 25768 4097 1 5 . 1 1 97 97 GLN N N 97 121.290 121.290 124.589 -3.299 25768 4098 1 5 . 1 1 97 97 GLN C C 97 174.380 174.380 174.428 -0.048 25768 4099 1 5 . 1 1 97 97 GLN CA C 97 54.740 54.740 54.436 0.304 25768 4100 1 5 . 1 1 97 97 GLN CB C 97 36.600 36.600 31.799 4.801 25768 4101 1 5 . 1 1 97 97 GLN H H 97 9.480 9.480 8.969 0.511 25768 4102 1 5 . 1 1 98 98 TYR N N 98 122.250 122.250 122.211 0.039 25768 4103 1 5 . 1 1 98 98 TYR C C 98 173.460 173.460 173.961 -0.501 25768 4104 1 5 . 1 1 98 98 TYR CA C 98 55.160 55.160 57.276 -2.116 25768 4105 1 5 . 1 1 98 98 TYR CB C 98 42.420 42.420 42.945 -0.525 25768 4106 1 5 . 1 1 98 98 TYR H H 98 9.010 9.010 8.300 0.710 25768 4107 1 5 . 1 1 99 99 TYR N N 99 126.860 126.860 122.308 4.552 25768 4108 1 5 . 1 1 99 99 TYR C C 99 175.380 175.380 173.769 1.611 25768 4109 1 5 . 1 1 99 99 TYR CA C 99 54.220 54.220 54.375 -0.155 25768 4110 1 5 . 1 1 99 99 TYR CB C 99 38.890 38.890 38.044 0.846 25768 4111 1 5 . 1 1 99 99 TYR H H 99 8.300 8.300 7.539 0.761 25768 4112 1 5 . 1 1 100 100 PRO C C 100 178.330 178.330 177.157 1.173 25768 4113 1 5 . 1 1 100 100 PRO CA C 100 64.750 64.750 64.654 0.095 25768 4114 1 5 . 1 1 100 100 PRO CB C 100 32.130 32.130 32.199 -0.069 25768 4115 1 5 . 1 1 101 101 MET N N 101 114.520 114.520 115.246 -0.726 25768 4116 1 5 . 1 1 101 101 MET C C 101 178.240 178.240 175.475 2.765 25768 4117 1 5 . 1 1 101 101 MET CA C 101 53.500 53.500 54.474 -0.974 25768 4118 1 5 . 1 1 101 101 MET CB C 101 30.160 30.160 32.910 -2.750 25768 4119 1 5 . 1 1 101 101 MET H H 101 9.390 9.390 7.913 1.477 25768 4120 1 5 . 1 1 102 102 GLY N N 102 117.500 117.500 108.045 9.455 25768 4121 1 5 . 1 1 102 102 GLY C C 102 175.690 175.690 174.248 1.442 25768 4122 1 5 . 1 1 102 102 GLY CA C 102 46.760 46.760 44.990 1.770 25768 4123 1 5 . 1 1 102 102 GLY H H 102 8.640 8.640 7.540 1.100 25768 4124 1 5 . 1 1 103 103 GLY N N 103 111.030 111.030 111.665 -0.635 25768 4125 1 5 . 1 1 103 103 GLY C C 103 174.070 174.070 174.400 -0.330 25768 4126 1 5 . 1 1 103 103 GLY CA C 103 46.140 46.140 44.731 1.409 25768 4127 1 5 . 1 1 103 103 GLY H H 103 9.390 9.390 8.308 1.082 25768 4128 1 5 . 1 1 104 104 THR N N 104 109.290 109.290 113.282 -3.992 25768 4129 1 5 . 1 1 104 104 THR C C 104 174.290 174.290 174.677 -0.387 25768 4130 1 5 . 1 1 104 104 THR CA C 104 60.900 60.900 60.102 0.798 25768 4131 1 5 . 1 1 104 104 THR CB C 104 72.070 72.070 70.227 1.843 25768 4132 1 5 . 1 1 104 104 THR H H 104 7.290 7.290 7.723 -0.433 25768 4133 1 5 . 1 1 105 105 ASN C C 105 175.050 175.050 174.990 0.060 25768 4134 1 5 . 1 1 105 105 ASN CA C 105 52.880 52.880 52.943 -0.063 25768 4135 1 5 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.737 -0.477 25768 4136 1 5 . 1 1 106 106 SER N N 106 113.000 113.000 116.898 -3.898 25768 4137 1 5 . 1 1 106 106 SER C C 106 176.000 176.000 174.227 1.773 25768 4138 1 5 . 1 1 106 106 SER CA C 106 58.700 58.700 57.873 0.827 25768 4139 1 5 . 1 1 106 106 SER CB C 106 64.540 64.540 64.386 0.154 25768 4140 1 5 . 1 1 106 106 SER H H 106 7.450 7.450 7.529 -0.079 25768 4141 1 5 . 1 1 107 107 ALA N N 107 132.220 132.220 124.902 7.318 25768 4142 1 5 . 1 1 107 107 ALA C C 107 176.610 176.610 177.235 -0.625 25768 4143 1 5 . 1 1 107 107 ALA CA C 107 54.380 54.380 53.337 1.043 25768 4144 1 5 . 1 1 107 107 ALA CB C 107 18.690 18.690 19.050 -0.360 25768 4145 1 5 . 1 1 107 107 ALA H H 107 8.870 8.870 8.441 0.429 25768 4146 1 5 . 1 1 108 108 PHE N N 108 116.050 116.050 118.942 -2.892 25768 4147 1 5 . 1 1 108 108 PHE C C 108 174.270 174.270 175.437 -1.167 25768 4148 1 5 . 1 1 108 108 PHE CA C 108 56.140 56.140 58.657 -2.517 25768 4149 1 5 . 1 1 108 108 PHE CB C 108 40.520 40.520 39.290 1.230 25768 4150 1 5 . 1 1 108 108 PHE H H 108 7.550 7.550 8.039 -0.489 25768 4151 1 5 . 1 1 109 109 GLN N N 109 128.260 128.260 125.684 2.576 25768 4152 1 5 . 1 1 109 109 GLN C C 109 172.300 172.300 173.669 -1.369 25768 4153 1 5 . 1 1 109 109 GLN CA C 109 52.310 52.310 52.381 -0.071 25768 4154 1 5 . 1 1 109 109 GLN CB C 109 29.050 29.050 29.786 -0.736 25768 4155 1 5 . 1 1 109 109 GLN H H 109 9.060 9.060 8.390 0.670 25768 4156 1 5 . 1 1 110 110 PRO C C 110 175.020 175.020 175.050 -0.030 25768 4157 1 5 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.616 -1.066 25768 4158 1 5 . 1 1 110 110 PRO CB C 110 33.280 33.280 32.215 1.065 25768 4159 1 5 . 1 1 111 111 TYR N N 111 115.730 115.730 121.011 -5.281 25768 4160 1 5 . 1 1 111 111 TYR C C 111 173.850 173.850 175.310 -1.460 25768 4161 1 5 . 1 1 111 111 TYR CA C 111 56.470 56.470 57.057 -0.587 25768 4162 1 5 . 1 1 111 111 TYR CB C 111 38.650 38.650 41.716 -3.066 25768 4163 1 5 . 1 1 111 111 TYR H H 111 8.500 8.500 8.295 0.205 25768 4164 1 5 . 1 1 112 112 GLY N N 112 103.570 103.570 110.405 -6.835 25768 4165 1 5 . 1 1 112 112 GLY C C 112 172.020 172.020 173.152 -1.132 25768 4166 1 5 . 1 1 112 112 GLY CA C 112 43.950 43.950 44.638 -0.688 25768 4167 1 5 . 1 1 112 112 GLY H H 112 8.110 8.110 8.430 -0.320 25768 4168 1 5 . 1 1 113 113 GLY N N 113 108.510 108.510 107.144 1.366 25768 4169 1 5 . 1 1 113 113 GLY C C 113 171.540 171.540 172.363 -0.823 25768 4170 1 5 . 1 1 113 113 GLY CA C 113 46.120 46.120 44.510 1.610 25768 4171 1 5 . 1 1 113 113 GLY H H 113 9.080 9.080 8.131 0.949 25768 4172 1 5 . 1 1 114 114 LEU N N 114 120.270 120.270 122.029 -1.759 25768 4173 1 5 . 1 1 114 114 LEU C C 114 175.810 175.810 174.877 0.933 25768 4174 1 5 . 1 1 114 114 LEU CA C 114 53.920 53.920 54.175 -0.255 25768 4175 1 5 . 1 1 114 114 LEU CB C 114 47.940 47.940 46.727 1.213 25768 4176 1 5 . 1 1 114 114 LEU H H 114 8.620 8.620 8.579 0.041 25768 4177 1 5 . 1 1 115 115 GLY N N 115 110.620 110.620 112.177 -1.557 25768 4178 1 5 . 1 1 115 115 GLY C C 115 171.560 171.560 172.680 -1.120 25768 4179 1 5 . 1 1 115 115 GLY CA C 115 46.940 46.940 44.296 2.644 25768 4180 1 5 . 1 1 115 115 GLY H H 115 9.000 9.000 8.652 0.348 25768 4181 1 5 . 1 1 116 116 VAL N N 116 113.600 113.600 123.830 -10.230 25768 4182 1 5 . 1 1 116 116 VAL C C 116 174.120 174.120 174.449 -0.329 25768 4183 1 5 . 1 1 116 116 VAL CA C 116 58.970 58.970 61.041 -2.071 25768 4184 1 5 . 1 1 116 116 VAL CB C 116 36.600 36.600 34.444 2.156 25768 4185 1 5 . 1 1 116 116 VAL H H 116 8.680 8.680 7.704 0.976 25768 4186 1 5 . 1 1 117 117 ASN N N 117 120.020 120.020 122.046 -2.026 25768 4187 1 5 . 1 1 117 117 ASN CA C 117 52.190 52.190 52.595 -0.405 25768 4188 1 5 . 1 1 117 117 ASN CB C 117 42.450 42.450 41.776 0.674 25768 4189 1 5 . 1 1 117 117 ASN H H 117 8.840 8.840 8.626 0.214 25768 4190 1 5 . 1 1 119 119 THR C C 119 174.350 174.350 173.502 0.848 25768 4191 1 5 . 1 1 119 119 THR CA C 119 63.140 63.140 60.632 2.508 25768 4192 1 5 . 1 1 119 119 THR CB C 119 70.170 70.170 70.925 -0.755 25768 4193 1 5 . 1 1 120 120 THR N N 120 114.120 114.120 113.975 0.145 25768 4194 1 5 . 1 1 120 120 THR C C 120 174.220 174.220 172.872 1.348 25768 4195 1 5 . 1 1 120 120 THR CA C 120 61.900 61.900 61.543 0.357 25768 4196 1 5 . 1 1 120 120 THR CB C 120 70.140 70.140 69.835 0.305 25768 4197 1 5 . 1 1 120 120 THR H H 120 7.570 7.570 7.614 -0.044 25768 4198 1 5 . 1 1 121 121 PHE N N 121 121.230 121.230 123.504 -2.274 25768 4199 1 5 . 1 1 121 121 PHE C C 121 174.910 174.910 174.186 0.724 25768 4200 1 5 . 1 1 121 121 PHE CA C 121 58.720 58.720 56.736 1.984 25768 4201 1 5 . 1 1 121 121 PHE CB C 121 40.470 40.470 40.944 -0.474 25768 4202 1 5 . 1 1 121 121 PHE H H 121 7.830 7.830 8.223 -0.393 25768 4203 1 5 . 1 1 122 122 PHE C C 122 175.070 175.070 174.632 0.438 25768 4204 1 5 . 1 1 122 122 PHE CA C 122 57.890 57.890 58.591 -0.701 25768 4205 1 5 . 1 1 122 122 PHE CB C 122 39.870 39.870 39.499 0.371 25768 4206 1 5 . 1 1 123 123 ASP N N 123 122.170 122.170 121.691 0.479 25768 4207 1 5 . 1 1 123 123 ASP C C 123 176.150 176.150 177.638 -1.488 25768 4208 1 5 . 1 1 123 123 ASP CA C 123 54.530 54.530 55.028 -0.498 25768 4209 1 5 . 1 1 123 123 ASP CB C 123 41.830 41.830 41.398 0.432 25768 4210 1 5 . 1 1 123 123 ASP H H 123 7.950 7.950 8.339 -0.389 25768 4211 1 5 . 1 1 124 124 GLU N N 124 122.690 122.690 119.656 3.034 25768 4212 1 5 . 1 1 124 124 GLU C C 124 176.630 176.630 178.113 -1.483 25768 4213 1 5 . 1 1 124 124 GLU CA C 124 57.620 57.620 58.115 -0.496 25768 4214 1 5 . 1 1 124 124 GLU CB C 124 30.450 30.450 30.020 0.430 25768 4215 1 5 . 1 1 124 124 GLU H H 124 8.340 8.340 8.406 -0.066 25768 4216 1 5 . 1 1 125 125 ASP N N 125 121.280 121.280 119.453 1.827 25768 4217 1 5 . 1 1 125 125 ASP C C 125 176.940 176.940 179.084 -2.144 25768 4218 1 5 . 1 1 125 125 ASP CA C 125 55.180 55.180 57.603 -2.423 25768 4219 1 5 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.630 0.590 25768 4220 1 5 . 1 1 125 125 ASP H H 125 8.310 8.310 8.469 -0.159 25768 4221 1 5 . 1 1 126 126 LEU N N 126 122.830 122.830 119.915 2.915 25768 4222 1 5 . 1 1 126 126 LEU C C 126 178.020 178.020 177.852 0.168 25768 4223 1 5 . 1 1 126 126 LEU CA C 126 56.450 56.450 56.972 -0.522 25768 4224 1 5 . 1 1 126 126 LEU CB C 126 42.150 42.150 41.968 0.182 25768 4225 1 5 . 1 1 126 126 LEU H H 126 8.010 8.010 8.269 -0.259 25768 4226 1 5 . 1 1 127 127 ALA N N 127 122.660 122.660 119.727 2.933 25768 4227 1 5 . 1 1 127 127 ALA C C 127 178.600 178.600 177.470 1.130 25768 4228 1 5 . 1 1 127 127 ALA CA C 127 53.780 53.780 52.845 0.935 25768 4229 1 5 . 1 1 127 127 ALA CB C 127 19.000 19.000 19.157 -0.157 25768 4230 1 5 . 1 1 127 127 ALA H H 127 8.100 8.100 7.789 0.311 25768 4231 1 5 . 1 1 128 128 SER N N 128 113.740 113.740 112.006 1.734 25768 4232 1 5 . 1 1 128 128 SER C C 128 175.010 175.010 173.941 1.069 25768 4233 1 5 . 1 1 128 128 SER CA C 128 59.580 59.580 59.128 0.452 25768 4234 1 5 . 1 1 128 128 SER CB C 128 63.800 63.800 62.049 1.751 25768 4235 1 5 . 1 1 128 128 SER H H 128 7.920 7.920 7.711 0.209 25768 4236 1 5 . 1 1 129 129 ASN N N 129 120.300 120.300 120.371 -0.071 25768 4237 1 5 . 1 1 129 129 ASN C C 129 175.590 175.590 175.281 0.309 25768 4238 1 5 . 1 1 129 129 ASN CA C 129 54.180 54.180 53.867 0.313 25768 4239 1 5 . 1 1 129 129 ASN CB C 129 38.900 38.900 40.109 -1.209 25768 4240 1 5 . 1 1 129 129 ASN H H 129 8.120 8.120 8.729 -0.609 25768 4241 1 5 . 1 1 130 130 ARG N N 130 120.630 120.630 121.387 -0.757 25768 4242 1 5 . 1 1 130 130 ARG C C 130 176.720 176.720 175.586 1.134 25768 4243 1 5 . 1 1 130 130 ARG CA C 130 57.240 57.240 55.844 1.396 25768 4244 1 5 . 1 1 130 130 ARG CB C 130 30.500 30.500 31.359 -0.859 25768 4245 1 5 . 1 1 130 130 ARG H H 130 8.050 8.050 8.392 -0.342 25768 4246 1 5 . 1 1 131 131 LYS N N 131 121.150 121.150 122.489 -1.339 25768 4247 1 5 . 1 1 131 131 LYS C C 131 176.750 176.750 176.309 0.441 25768 4248 1 5 . 1 1 131 131 LYS CA C 131 57.050 57.050 56.708 0.342 25768 4249 1 5 . 1 1 131 131 LYS CB C 131 32.870 32.870 33.296 -0.426 25768 4250 1 5 . 1 1 131 131 LYS H H 131 8.020 8.020 8.580 -0.560 25768 4251 1 5 . 1 1 132 132 ALA N N 132 124.110 124.110 123.476 0.634 25768 4252 1 5 . 1 1 132 132 ALA C C 132 177.680 177.680 177.659 0.021 25768 4253 1 5 . 1 1 132 132 ALA CA C 132 53.070 53.070 51.458 1.612 25768 4254 1 5 . 1 1 132 132 ALA CB C 132 19.250 19.250 17.732 1.518 25768 4255 1 5 . 1 1 132 132 ALA H H 132 8.010 8.010 8.116 -0.106 25768 4256 1 5 . 1 1 133 133 GLN N N 133 118.830 118.830 121.980 -3.150 25768 4257 1 5 . 1 1 133 133 GLN C C 133 176.380 176.380 176.073 0.307 25768 4258 1 5 . 1 1 133 133 GLN CA C 133 56.400 56.400 56.086 0.314 25768 4259 1 5 . 1 1 133 133 GLN CB C 133 29.670 29.670 29.276 0.394 25768 4260 1 5 . 1 1 133 133 GLN H H 133 8.070 8.070 8.481 -0.411 25768 4261 1 5 . 1 1 134 134 GLY N N 134 109.400 109.400 106.512 2.888 25768 4262 1 5 . 1 1 134 134 GLY C C 134 174.060 174.060 173.405 0.655 25768 4263 1 5 . 1 1 134 134 GLY CA C 134 45.690 45.690 44.846 0.844 25768 4264 1 5 . 1 1 134 134 GLY H H 134 8.150 8.150 7.653 0.497 25768 4265 1 5 . 1 1 135 135 PHE N N 135 120.480 120.480 120.942 -0.462 25768 4266 1 5 . 1 1 135 135 PHE C C 135 176.000 176.000 175.687 0.313 25768 4267 1 5 . 1 1 135 135 PHE CA C 135 58.370 58.370 58.221 0.149 25768 4268 1 5 . 1 1 135 135 PHE CB C 135 39.710 39.710 39.996 -0.286 25768 4269 1 5 . 1 1 135 135 PHE H H 135 8.060 8.060 8.622 -0.562 25768 4270 1 5 . 1 1 136 136 SER N N 136 116.740 116.740 115.193 1.547 25768 4271 1 5 . 1 1 136 136 SER C C 136 174.620 174.620 173.323 1.297 25768 4272 1 5 . 1 1 136 136 SER CA C 136 58.870 58.870 57.891 0.980 25768 4273 1 5 . 1 1 136 136 SER CB C 136 64.200 64.200 64.939 -0.739 25768 4274 1 5 . 1 1 136 136 SER H H 136 8.160 8.160 8.092 0.068 25768 4275 1 5 . 1 1 137 137 SER N N 137 117.650 117.650 119.740 -2.090 25768 4276 1 5 . 1 1 137 137 SER C C 137 174.410 174.410 174.219 0.191 25768 4277 1 5 . 1 1 137 137 SER CA C 137 58.880 58.880 59.439 -0.559 25768 4278 1 5 . 1 1 137 137 SER CB C 137 64.140 64.140 63.604 0.536 25768 4279 1 5 . 1 1 137 137 SER H H 137 8.140 8.140 8.665 -0.525 25768 4280 1 5 . 1 1 138 138 MET N N 138 121.980 121.980 124.405 -2.425 25768 4281 1 5 . 1 1 138 138 MET C C 138 175.680 175.680 175.712 -0.032 25768 4282 1 5 . 1 1 138 138 MET CA C 138 56.180 56.180 55.508 0.672 25768 4283 1 5 . 1 1 138 138 MET CB C 138 33.240 33.240 33.165 0.075 25768 4284 1 5 . 1 1 138 138 MET H H 138 8.110 8.110 8.317 -0.207 25768 4285 1 5 . 1 1 139 139 LYS N N 139 122.110 122.110 119.768 2.342 25768 4286 1 5 . 1 1 139 139 LYS C C 139 176.220 176.220 176.319 -0.099 25768 4287 1 5 . 1 1 139 139 LYS CA C 139 56.370 56.370 56.621 -0.251 25768 4288 1 5 . 1 1 139 139 LYS CB C 139 33.220 33.220 32.514 0.706 25768 4289 1 5 . 1 1 139 139 LYS H H 139 8.140 8.140 7.917 0.223 25768 4290 1 5 . 1 1 140 140 LEU N N 140 123.860 123.860 117.729 6.131 25768 4291 1 5 . 1 1 140 140 LEU C C 140 177.100 177.100 176.152 0.948 25768 4292 1 5 . 1 1 140 140 LEU CA C 140 55.710 55.710 55.545 0.165 25768 4293 1 5 . 1 1 140 140 LEU CB C 140 42.460 42.460 41.979 0.481 25768 4294 1 5 . 1 1 140 140 LEU H H 140 8.140 8.140 8.303 -0.163 25768 4295 1 5 . 1 1 141 141 GLN N N 141 120.350 120.350 119.834 0.516 25768 4296 1 5 . 1 1 141 141 GLN C C 141 175.170 175.170 175.213 -0.043 25768 4297 1 5 . 1 1 141 141 GLN CA C 141 56.200 56.200 55.472 0.728 25768 4298 1 5 . 1 1 141 141 GLN CB C 141 29.950 29.950 31.660 -1.710 25768 4299 1 5 . 1 1 141 141 GLN H H 141 8.210 8.210 8.425 -0.215 25768 4300 1 5 . 1 1 142 142 ASP N N 142 120.950 120.950 121.678 -0.728 25768 4301 1 5 . 1 1 142 142 ASP C C 142 175.840 175.840 175.436 0.404 25768 4302 1 5 . 1 1 142 142 ASP CA C 142 54.700 54.700 54.208 0.492 25768 4303 1 5 . 1 1 142 142 ASP CB C 142 41.760 41.760 41.227 0.533 25768 4304 1 5 . 1 1 142 142 ASP H H 142 8.120 8.120 8.572 -0.452 25768 4305 1 5 . 1 1 143 143 SER N N 143 114.880 114.880 116.017 -1.137 25768 4306 1 5 . 1 1 143 143 SER C C 143 173.290 173.290 175.012 -1.722 25768 4307 1 5 . 1 1 143 143 SER CA C 143 58.450 58.450 57.924 0.526 25768 4308 1 5 . 1 1 143 143 SER CB C 143 64.760 64.760 63.803 0.958 25768 4309 1 5 . 1 1 143 143 SER H H 143 7.960 7.960 7.885 0.075 25768 4310 1 5 . 1 1 144 144 TRP N N 144 123.110 123.110 127.121 -4.011 25768 4311 1 5 . 1 1 144 144 TRP C C 144 175.880 175.880 175.959 -0.079 25768 4312 1 5 . 1 1 144 144 TRP CA C 144 56.420 56.420 57.063 -0.643 25768 4313 1 5 . 1 1 144 144 TRP CB C 144 31.160 31.160 30.206 0.954 25768 4314 1 5 . 1 1 144 144 TRP H H 144 8.080 8.080 8.479 -0.399 25768 4315 1 5 . 1 1 145 145 GLY N N 145 110.410 110.410 109.722 0.688 25768 4316 1 5 . 1 1 145 145 GLY C C 145 172.870 172.870 173.228 -0.358 25768 4317 1 5 . 1 1 145 145 GLY CA C 145 45.130 45.130 44.899 0.231 25768 4318 1 5 . 1 1 145 145 GLY H H 145 8.660 8.660 8.196 0.464 25768 4319 1 5 . 1 1 148 148 GLY C C 148 171.800 171.800 173.459 -1.659 25768 4320 1 5 . 1 1 148 148 GLY CA C 148 44.140 44.140 44.413 -0.273 25768 4321 1 5 . 1 1 149 149 GLU N N 149 123.070 123.070 118.783 4.287 25768 4322 1 5 . 1 1 149 149 GLU C C 149 174.210 174.210 174.174 0.036 25768 4323 1 5 . 1 1 149 149 GLU CA C 149 55.120 55.120 55.943 -0.823 25768 4324 1 5 . 1 1 149 149 GLU CB C 149 37.410 37.410 33.876 3.534 25768 4325 1 5 . 1 1 149 149 GLU H H 149 8.550 8.550 8.050 0.500 25768 4326 1 5 . 1 1 150 150 LEU N N 150 126.130 126.130 122.163 3.967 25768 4327 1 5 . 1 1 150 150 LEU C C 150 174.410 174.410 175.608 -1.198 25768 4328 1 5 . 1 1 150 150 LEU CA C 150 54.260 54.260 53.309 0.951 25768 4329 1 5 . 1 1 150 150 LEU CB C 150 47.510 47.510 45.549 1.961 25768 4330 1 5 . 1 1 150 150 LEU H H 150 8.550 8.550 8.200 0.350 25768 4331 1 5 . 1 1 151 151 GLY N N 151 109.500 109.500 109.182 0.318 25768 4332 1 5 . 1 1 151 151 GLY C C 151 170.610 170.610 171.983 -1.373 25768 4333 1 5 . 1 1 151 151 GLY CA C 151 45.980 45.980 44.429 1.550 25768 4334 1 5 . 1 1 151 151 GLY H H 151 8.090 8.090 8.701 -0.611 25768 4335 1 5 . 1 1 152 152 PHE N N 152 110.960 110.960 121.442 -10.482 25768 4336 1 5 . 1 1 152 152 PHE C C 152 171.510 171.510 174.405 -2.895 25768 4337 1 5 . 1 1 152 152 PHE CA C 152 58.170 58.170 57.472 0.698 25768 4338 1 5 . 1 1 152 152 PHE CB C 152 41.690 41.690 43.115 -1.425 25768 4339 1 5 . 1 1 152 152 PHE H H 152 8.380 8.380 8.093 0.287 25768 4340 1 5 . 1 1 153 153 ASP N N 153 118.880 118.880 124.447 -5.567 25768 4341 1 5 . 1 1 153 153 ASP C C 153 176.520 176.520 174.859 1.661 25768 4342 1 5 . 1 1 153 153 ASP CA C 153 52.940 52.940 53.430 -0.490 25768 4343 1 5 . 1 1 153 153 ASP CB C 153 44.540 44.540 43.237 1.303 25768 4344 1 5 . 1 1 153 153 ASP H H 153 7.970 7.970 8.730 -0.760 25768 4345 1 5 . 1 1 154 154 TYR N N 154 123.630 123.630 127.100 -3.470 25768 4346 1 5 . 1 1 154 154 TYR C C 154 175.610 175.610 174.356 1.254 25768 4347 1 5 . 1 1 154 154 TYR CA C 154 57.310 57.310 56.547 0.763 25768 4348 1 5 . 1 1 154 154 TYR CB C 154 42.040 42.040 40.004 2.037 25768 4349 1 5 . 1 1 154 154 TYR H H 154 9.730 9.730 9.095 0.635 25768 4350 1 5 . 1 1 155 155 MET N N 155 126.190 126.190 127.255 -1.065 25768 4351 1 5 . 1 1 155 155 MET C C 155 174.970 174.970 175.456 -0.486 25768 4352 1 5 . 1 1 155 155 MET CA C 155 54.720 54.720 57.225 -2.505 25768 4353 1 5 . 1 1 155 155 MET CB C 155 28.300 28.300 32.419 -4.119 25768 4354 1 5 . 1 1 155 155 MET H H 155 8.600 8.600 8.485 0.115 25768 4355 1 5 . 1 1 156 156 LEU N N 156 125.290 125.290 124.771 0.519 25768 4356 1 5 . 1 1 156 156 LEU C C 156 177.680 177.680 177.864 -0.184 25768 4357 1 5 . 1 1 156 156 LEU CA C 156 56.040 56.040 55.466 0.574 25768 4358 1 5 . 1 1 156 156 LEU CB C 156 43.040 43.040 43.458 -0.418 25768 4359 1 5 . 1 1 156 156 LEU H H 156 9.190 9.190 8.642 0.548 25768 4360 1 5 . 1 1 157 157 ASN N N 157 114.690 114.690 116.213 -1.523 25768 4361 1 5 . 1 1 157 157 ASN C C 157 173.640 173.640 177.192 -3.552 25768 4362 1 5 . 1 1 157 157 ASN CA C 157 52.650 52.650 56.772 -4.122 25768 4363 1 5 . 1 1 157 157 ASN CB C 157 37.270 37.270 36.895 0.375 25768 4364 1 5 . 1 1 157 157 ASN H H 157 8.060 8.060 8.292 -0.232 25768 4365 1 5 . 1 1 158 158 GLU N N 158 114.530 114.530 120.994 -6.464 25768 4366 1 5 . 1 1 158 158 GLU C C 158 176.090 176.090 177.357 -1.267 25768 4367 1 5 . 1 1 158 158 GLU CA C 158 60.010 60.010 58.711 1.300 25768 4368 1 5 . 1 1 158 158 GLU CB C 158 29.730 29.730 30.042 -0.312 25768 4369 1 5 . 1 1 158 158 GLU H H 158 8.560 8.560 8.493 0.067 25768 4370 1 5 . 1 1 159 159 HIS N N 159 110.480 110.480 116.428 -5.948 25768 4371 1 5 . 1 1 159 159 HIS C C 159 173.130 173.130 174.237 -1.107 25768 4372 1 5 . 1 1 159 159 HIS CA C 159 56.770 56.770 54.734 2.036 25768 4373 1 5 . 1 1 159 159 HIS CB C 159 32.630 32.630 28.962 3.668 25768 4374 1 5 . 1 1 159 159 HIS H H 159 8.190 8.190 7.872 0.318 25768 4375 1 5 . 1 1 160 160 ALA N N 160 122.890 122.890 119.505 3.385 25768 4376 1 5 . 1 1 160 160 ALA C C 160 176.200 176.200 175.020 1.180 25768 4377 1 5 . 1 1 160 160 ALA CA C 160 51.730 51.730 53.324 -1.593 25768 4378 1 5 . 1 1 160 160 ALA CB C 160 21.560 21.560 18.101 3.459 25768 4379 1 5 . 1 1 160 160 ALA H H 160 8.400 8.400 7.511 0.889 25768 4380 1 5 . 1 1 161 161 LEU N N 161 116.540 116.540 118.699 -2.159 25768 4381 1 5 . 1 1 161 161 LEU C C 161 174.930 174.930 176.150 -1.220 25768 4382 1 5 . 1 1 161 161 LEU CA C 161 54.280 54.280 53.375 0.905 25768 4383 1 5 . 1 1 161 161 LEU CB C 161 45.640 45.640 43.540 2.100 25768 4384 1 5 . 1 1 161 161 LEU H H 161 8.590 8.590 7.969 0.621 25768 4385 1 5 . 1 1 162 162 PHE N N 162 121.780 121.780 123.842 -2.062 25768 4386 1 5 . 1 1 162 162 PHE C C 162 171.960 171.960 174.854 -2.894 25768 4387 1 5 . 1 1 162 162 PHE CA C 162 56.420 56.420 57.633 -1.213 25768 4388 1 5 . 1 1 162 162 PHE CB C 162 43.340 43.340 41.306 2.034 25768 4389 1 5 . 1 1 162 162 PHE H H 162 9.180 9.180 9.130 0.050 25768 4390 1 5 . 1 1 163 163 ASN N N 163 127.850 127.850 126.219 1.631 25768 4391 1 5 . 1 1 163 163 ASN C C 163 171.320 171.320 174.024 -2.704 25768 4392 1 5 . 1 1 163 163 ASN CA C 163 52.340 52.340 52.784 -0.444 25768 4393 1 5 . 1 1 163 163 ASN CB C 163 46.410 46.410 41.199 5.211 25768 4394 1 5 . 1 1 163 163 ASN H H 163 7.700 7.700 7.999 -0.299 25768 4395 1 5 . 1 1 164 164 MET N N 164 119.950 119.950 121.986 -2.036 25768 4396 1 5 . 1 1 164 164 MET C C 164 172.830 172.830 174.896 -2.066 25768 4397 1 5 . 1 1 164 164 MET CA C 164 55.180 55.180 54.441 0.739 25768 4398 1 5 . 1 1 164 164 MET CB C 164 37.770 37.770 37.589 0.181 25768 4399 1 5 . 1 1 164 164 MET H H 164 7.070 7.070 8.961 -1.891 25768 4400 1 5 . 1 1 165 165 ALA N N 165 120.600 120.600 123.885 -3.285 25768 4401 1 5 . 1 1 165 165 ALA C C 165 174.240 174.240 175.343 -1.103 25768 4402 1 5 . 1 1 165 165 ALA CA C 165 51.630 51.630 51.872 -0.242 25768 4403 1 5 . 1 1 165 165 ALA CB C 165 22.330 22.330 21.163 1.167 25768 4404 1 5 . 1 1 165 165 ALA H H 165 8.290 8.290 8.546 -0.256 25768 4405 1 5 . 1 1 166 166 VAL N N 166 117.900 117.900 124.079 -6.179 25768 4406 1 5 . 1 1 166 166 VAL C C 166 172.950 172.950 175.700 -2.750 25768 4407 1 5 . 1 1 166 166 VAL CA C 166 59.710 59.710 61.570 -1.860 25768 4408 1 5 . 1 1 166 166 VAL CB C 166 35.290 35.290 34.949 0.341 25768 4409 1 5 . 1 1 166 166 VAL H H 166 8.720 8.720 8.775 -0.055 25768 4410 1 5 . 1 1 171 171 ILE C C 171 175.750 175.750 175.135 0.615 25768 4411 1 5 . 1 1 171 171 ILE CA C 171 61.720 61.720 62.080 -0.360 25768 4412 1 5 . 1 1 171 171 ILE CB C 171 39.300 39.300 39.135 0.165 25768 4413 1 5 . 1 1 172 172 ASP N N 172 124.070 124.070 119.964 4.106 25768 4414 1 5 . 1 1 172 172 ASP C C 172 176.590 176.590 175.419 1.171 25768 4415 1 5 . 1 1 172 172 ASP CA C 172 54.460 54.460 53.666 0.794 25768 4416 1 5 . 1 1 172 172 ASP CB C 172 41.410 41.410 42.483 -1.073 25768 4417 1 5 . 1 1 172 172 ASP H H 172 8.460 8.460 8.007 0.453 25768 4418 1 5 . 1 1 173 173 THR N N 173 115.570 115.570 112.528 3.042 25768 4419 1 5 . 1 1 173 173 THR C C 173 175.030 175.030 174.264 0.766 25768 4420 1 5 . 1 1 173 173 THR CA C 173 62.680 62.680 61.940 0.740 25768 4421 1 5 . 1 1 173 173 THR CB C 173 69.840 69.840 69.128 0.712 25768 4422 1 5 . 1 1 173 173 THR H H 173 8.080 8.080 8.276 -0.196 25768 4423 1 5 . 1 1 174 174 LYS N N 174 122.680 122.680 125.062 -2.382 25768 4424 1 5 . 1 1 174 174 LYS C C 174 176.340 176.340 175.941 0.399 25768 4425 1 5 . 1 1 174 174 LYS CA C 174 56.820 56.820 56.157 0.663 25768 4426 1 5 . 1 1 174 174 LYS CB C 174 32.790 32.790 32.959 -0.169 25768 4427 1 5 . 1 1 174 174 LYS H H 174 8.180 8.180 8.658 -0.478 25768 4428 1 5 . 1 1 175 175 ALA N N 175 124.050 124.050 123.253 0.797 25768 4429 1 5 . 1 1 175 175 ALA C C 175 177.550 177.550 177.292 0.258 25768 4430 1 5 . 1 1 175 175 ALA CA C 175 52.840 52.840 52.453 0.387 25768 4431 1 5 . 1 1 175 175 ALA CB C 175 19.580 19.580 19.316 0.264 25768 4432 1 5 . 1 1 175 175 ALA H H 175 8.050 8.050 8.004 0.046 25768 4433 1 5 . 1 1 176 176 SER N N 176 114.920 114.920 115.740 -0.820 25768 4434 1 5 . 1 1 176 176 SER C C 176 174.240 174.240 174.378 -0.138 25768 4435 1 5 . 1 1 176 176 SER CA C 176 58.390 58.390 58.280 0.110 25768 4436 1 5 . 1 1 176 176 SER CB C 176 64.370 64.370 63.398 0.972 25768 4437 1 5 . 1 1 176 176 SER H H 176 8.070 8.070 8.440 -0.370 25768 4438 1 5 . 1 1 177 177 ILE N N 177 121.650 121.650 125.577 -3.927 25768 4439 1 5 . 1 1 177 177 ILE C C 177 174.990 174.990 175.869 -0.879 25768 4440 1 5 . 1 1 177 177 ILE CA C 177 61.570 61.570 61.926 -0.356 25768 4441 1 5 . 1 1 177 177 ILE CB C 177 39.100 39.100 38.447 0.653 25768 4442 1 5 . 1 1 177 177 ILE H H 177 7.960 7.960 8.064 -0.104 25768 4443 1 5 . 1 1 178 178 ASN N N 178 127.040 127.040 123.435 3.605 25768 4444 1 5 . 1 1 178 178 ASN C C 178 179.160 179.160 175.218 3.942 25768 4445 1 5 . 1 1 178 178 ASN CA C 178 55.100 55.100 53.683 1.417 25768 4446 1 5 . 1 1 178 178 ASN CB C 178 41.300 41.300 38.972 2.328 25768 4447 1 5 . 1 1 178 178 ASN H H 178 7.850 7.850 8.237 -0.387 25768 4448 1 5 . 1 1 180 180 PRO C C 180 177.520 177.520 176.668 0.852 25768 4449 1 5 . 1 1 180 180 PRO CA C 180 63.980 63.980 62.553 1.427 25768 4450 1 5 . 1 1 180 180 PRO CB C 180 32.190 32.190 32.282 -0.092 25768 4451 1 5 . 1 1 181 181 SER N N 181 115.600 115.600 114.231 1.369 25768 4452 1 5 . 1 1 181 181 SER C C 181 174.710 174.710 174.656 0.054 25768 4453 1 5 . 1 1 181 181 SER CA C 181 58.900 58.900 58.637 0.263 25768 4454 1 5 . 1 1 181 181 SER CB C 181 64.070 64.070 63.178 0.892 25768 4455 1 5 . 1 1 181 181 SER H H 181 8.260 8.260 8.185 0.075 25768 4456 1 5 . 1 1 182 182 ALA N N 182 125.880 125.880 124.830 1.050 25768 4457 1 5 . 1 1 182 182 ALA C C 182 177.560 177.560 175.950 1.610 25768 4458 1 5 . 1 1 182 182 ALA CA C 182 53.090 53.090 51.977 1.113 25768 4459 1 5 . 1 1 182 182 ALA CB C 182 19.310 19.310 19.962 -0.652 25768 4460 1 5 . 1 1 182 182 ALA H H 182 8.130 8.130 7.674 0.456 25768 4461 1 5 . 1 1 183 183 LEU N N 183 119.980 119.980 120.382 -0.402 25768 4462 1 5 . 1 1 183 183 LEU C C 183 177.850 177.850 176.640 1.210 25768 4463 1 5 . 1 1 183 183 LEU CA C 183 55.650 55.650 54.881 0.769 25768 4464 1 5 . 1 1 183 183 LEU CB C 183 42.530 42.530 44.974 -2.444 25768 4465 1 5 . 1 1 183 183 LEU H H 183 7.940 7.940 8.369 -0.429 25768 4466 1 5 . 1 1 184 184 GLY N N 184 109.250 109.250 109.498 -0.248 25768 4467 1 5 . 1 1 184 184 GLY C C 184 174.250 174.250 173.916 0.334 25768 4468 1 5 . 1 1 184 184 GLY CA C 184 45.830 45.830 45.465 0.365 25768 4469 1 5 . 1 1 184 184 GLY H H 184 8.150 8.150 8.552 -0.402 25768 4470 1 5 . 1 1 185 185 VAL N N 185 118.830 118.830 121.162 -2.332 25768 4471 1 5 . 1 1 185 185 VAL C C 185 175.890 175.890 176.079 -0.189 25768 4472 1 5 . 1 1 185 185 VAL CA C 185 62.740 62.740 62.459 0.281 25768 4473 1 5 . 1 1 185 185 VAL CB C 185 32.770 32.770 32.608 0.162 25768 4474 1 5 . 1 1 185 185 VAL H H 185 7.760 7.760 8.051 -0.291 25768 4475 1 5 . 1 1 186 186 ASN N N 186 121.850 121.850 117.191 4.659 25768 4476 1 5 . 1 1 186 186 ASN C C 186 174.970 174.970 174.905 0.065 25768 4477 1 5 . 1 1 186 186 ASN CA C 186 53.590 53.590 54.026 -0.436 25768 4478 1 5 . 1 1 186 186 ASN CB C 186 39.160 39.160 38.435 0.725 25768 4479 1 5 . 1 1 186 186 ASN H H 186 8.380 8.380 8.133 0.247 25768 4480 1 5 . 1 1 187 187 LYS N N 187 122.120 122.120 122.274 -0.154 25768 4481 1 5 . 1 1 187 187 LYS C C 187 176.490 176.490 176.451 0.039 25768 4482 1 5 . 1 1 187 187 LYS CA C 187 56.750 56.750 56.139 0.611 25768 4483 1 5 . 1 1 187 187 LYS CB C 187 33.250 33.250 31.937 1.313 25768 4484 1 5 . 1 1 187 187 LYS H H 187 8.140 8.140 8.477 -0.337 25768 4485 1 5 . 1 1 188 188 THR N N 188 115.250 115.250 114.020 1.230 25768 4486 1 5 . 1 1 188 188 THR C C 188 174.250 174.250 174.639 -0.389 25768 4487 1 5 . 1 1 188 188 THR CA C 188 62.360 62.360 61.690 0.671 25768 4488 1 5 . 1 1 188 188 THR CB C 188 70.280 70.280 70.291 -0.011 25768 4489 1 5 . 1 1 188 188 THR H H 188 8.100 8.100 8.452 -0.352 25768 4490 1 5 . 1 1 189 189 LYS N N 189 123.780 123.780 119.676 4.104 25768 4491 1 5 . 1 1 189 189 LYS C C 189 176.090 176.090 176.332 -0.242 25768 4492 1 5 . 1 1 189 189 LYS CA C 189 56.590 56.590 57.197 -0.607 25768 4493 1 5 . 1 1 189 189 LYS CB C 189 33.350 33.350 32.497 0.853 25768 4494 1 5 . 1 1 189 189 LYS H H 189 8.110 8.110 7.937 0.173 25768 4495 1 5 . 1 1 190 190 VAL N N 190 120.920 120.920 114.258 6.662 25768 4496 1 5 . 1 1 190 190 VAL C C 190 175.590 175.590 175.857 -0.267 25768 4497 1 5 . 1 1 190 190 VAL CA C 190 62.400 62.400 63.160 -0.760 25768 4498 1 5 . 1 1 190 190 VAL CB C 190 32.990 32.990 32.499 0.491 25768 4499 1 5 . 1 1 190 190 VAL H H 190 8.040 8.040 8.379 -0.339 25768 4500 1 5 . 1 1 191 191 ASP N N 191 123.790 123.790 118.837 4.953 25768 4501 1 5 . 1 1 191 191 ASP C C 191 175.750 175.750 175.899 -0.149 25768 4502 1 5 . 1 1 191 191 ASP CA C 191 54.650 54.650 55.802 -1.152 25768 4503 1 5 . 1 1 191 191 ASP CB C 191 41.450 41.450 43.749 -2.299 25768 4504 1 5 . 1 1 191 191 ASP H H 191 8.240 8.240 7.855 0.385 25768 4505 1 5 . 1 1 192 192 VAL N N 192 118.850 118.850 112.393 6.457 25768 4506 1 5 . 1 1 192 192 VAL C C 192 175.380 175.380 174.337 1.043 25768 4507 1 5 . 1 1 192 192 VAL CA C 192 62.110 62.110 62.864 -0.753 25768 4508 1 5 . 1 1 192 192 VAL CB C 192 33.290 33.290 33.683 -0.393 25768 4509 1 5 . 1 1 192 192 VAL H H 192 7.860 7.860 7.531 0.329 25768 4510 1 5 . 1 1 193 193 ASP N N 193 124.190 124.190 119.369 4.821 25768 4511 1 5 . 1 1 193 193 ASP C C 193 175.630 175.630 174.756 0.874 25768 4512 1 5 . 1 1 193 193 ASP CA C 193 54.540 54.540 55.658 -1.119 25768 4513 1 5 . 1 1 193 193 ASP CB C 193 41.410 41.410 39.498 1.912 25768 4514 1 5 . 1 1 193 193 ASP H H 193 8.310 8.310 8.534 -0.224 25768 4515 1 5 . 1 1 194 194 VAL N N 194 119.580 119.580 116.171 3.409 25768 4516 1 5 . 1 1 194 194 VAL C C 194 174.950 174.950 174.305 0.645 25768 4517 1 5 . 1 1 194 194 VAL CA C 194 61.770 61.770 61.310 0.460 25768 4518 1 5 . 1 1 194 194 VAL CB C 194 33.680 33.680 35.190 -1.510 25768 4519 1 5 . 1 1 194 194 VAL H H 194 7.890 7.890 7.515 0.375 25768 4520 1 5 . 1 1 195 195 ASP N N 195 125.660 125.660 125.081 0.579 25768 4521 1 5 . 1 1 195 195 ASP C C 195 174.290 174.290 173.884 0.406 25768 4522 1 5 . 1 1 195 195 ASP CA C 195 51.940 51.940 52.136 -0.196 25768 4523 1 5 . 1 1 195 195 ASP CB C 195 40.950 40.950 40.582 0.368 25768 4524 1 5 . 1 1 195 195 ASP H H 195 8.410 8.410 8.188 0.222 25768 4525 1 5 . 1 1 198 198 VAL C C 198 173.940 173.940 174.611 -0.671 25768 4526 1 5 . 1 1 198 198 VAL CA C 198 61.270 61.270 61.060 0.210 25768 4527 1 5 . 1 1 198 198 VAL CB C 198 35.910 35.910 33.176 2.734 25768 4528 1 5 . 1 1 199 199 TYR N N 199 123.780 123.780 122.011 1.769 25768 4529 1 5 . 1 1 199 199 TYR C C 199 174.150 174.150 174.079 0.071 25768 4530 1 5 . 1 1 199 199 TYR CA C 199 56.220 56.220 55.380 0.840 25768 4531 1 5 . 1 1 199 199 TYR CB C 199 41.660 41.660 40.991 0.669 25768 4532 1 5 . 1 1 199 199 TYR H H 199 8.540 8.540 7.443 1.097 25768 4533 1 5 . 1 1 200 200 MET N N 200 123.920 123.920 123.113 0.807 25768 4534 1 5 . 1 1 200 200 MET C C 200 173.810 173.810 175.050 -1.240 25768 4535 1 5 . 1 1 200 200 MET CA C 200 54.710 54.710 54.780 -0.070 25768 4536 1 5 . 1 1 200 200 MET CB C 200 37.110 37.110 34.899 2.211 25768 4537 1 5 . 1 1 200 200 MET H H 200 9.130 9.130 8.268 0.862 25768 4538 1 5 . 1 1 201 201 ILE N N 201 123.670 123.670 117.880 5.790 25768 4539 1 5 . 1 1 201 201 ILE C C 201 174.030 174.030 174.296 -0.266 25768 4540 1 5 . 1 1 201 201 ILE CA C 201 59.820 59.820 58.832 0.988 25768 4541 1 5 . 1 1 201 201 ILE CB C 201 41.720 41.720 41.663 0.057 25768 4542 1 5 . 1 1 201 201 ILE H H 201 8.030 8.030 8.600 -0.570 25768 4543 1 5 . 1 1 202 202 GLY N N 202 112.910 112.910 110.360 2.550 25768 4544 1 5 . 1 1 202 202 GLY C C 202 170.280 170.280 171.855 -1.575 25768 4545 1 5 . 1 1 202 202 GLY CA C 202 46.800 46.800 45.197 1.603 25768 4546 1 5 . 1 1 202 202 GLY H H 202 8.580 8.580 7.518 1.062 25768 4547 1 5 . 1 1 203 203 PHE N N 203 116.240 116.240 117.584 -1.344 25768 4548 1 5 . 1 1 203 203 PHE C C 203 173.940 173.940 175.002 -1.062 25768 4549 1 5 . 1 1 203 203 PHE CA C 203 55.890 55.890 55.629 0.261 25768 4550 1 5 . 1 1 203 203 PHE CB C 203 45.060 45.060 43.315 1.745 25768 4551 1 5 . 1 1 203 203 PHE H H 203 8.620 8.620 7.996 0.624 25768 4552 1 5 . 1 1 204 204 GLY N N 204 105.610 105.610 105.979 -0.369 25768 4553 1 5 . 1 1 204 204 GLY C C 204 171.190 171.190 172.146 -0.956 25768 4554 1 5 . 1 1 204 204 GLY CA C 204 46.720 46.720 44.618 2.102 25768 4555 1 5 . 1 1 204 204 GLY H H 204 8.960 8.960 8.275 0.685 25768 4556 1 5 . 1 1 205 205 TYR N N 205 121.160 121.160 122.801 -1.641 25768 4557 1 5 . 1 1 205 205 TYR C C 205 173.030 173.030 175.214 -2.184 25768 4558 1 5 . 1 1 205 205 TYR CA C 205 57.190 57.190 56.764 0.426 25768 4559 1 5 . 1 1 205 205 TYR CB C 205 44.400 44.400 42.344 2.055 25768 4560 1 5 . 1 1 205 205 TYR H H 205 9.380 9.380 8.612 0.768 25768 4561 1 5 . 1 1 206 206 LYS N N 206 126.970 126.970 123.686 3.284 25768 4562 1 5 . 1 1 206 206 LYS C C 206 174.210 174.210 176.269 -2.059 25768 4563 1 5 . 1 1 206 206 LYS CA C 206 54.770 54.770 55.245 -0.475 25768 4564 1 5 . 1 1 206 206 LYS CB C 206 34.440 34.440 35.140 -0.700 25768 4565 1 5 . 1 1 206 206 LYS H H 206 8.380 8.380 8.649 -0.269 25768 4566 1 5 . 1 1 207 207 PHE N N 207 126.330 126.330 123.780 2.550 25768 4567 1 5 . 1 1 207 207 PHE C C 207 175.020 175.020 174.730 0.290 25768 4568 1 5 . 1 1 207 207 PHE CA C 207 58.170 58.170 57.111 1.059 25768 4569 1 5 . 1 1 207 207 PHE CB C 207 40.920 40.920 39.886 1.034 25768 4570 1 5 . 1 1 207 207 PHE H H 207 9.290 9.290 8.839 0.451 25768 4571 1 5 . 1 1 208 208 LEU N N 208 122.740 122.740 124.093 -1.353 25768 4572 1 5 . 1 1 208 208 LEU C C 208 176.510 176.510 176.944 -0.434 25768 4573 1 5 . 1 1 208 208 LEU CA C 208 54.910 54.910 54.197 0.714 25768 4574 1 5 . 1 1 208 208 LEU CB C 208 43.830 43.830 43.201 0.629 25768 4575 1 5 . 1 1 208 208 LEU H H 208 8.310 8.310 8.385 -0.075 25768 4576 1 6 . 1 1 2 2 HIS C C 2 175.310 175.310 174.271 1.039 25768 4577 1 6 . 1 1 3 3 LYS N N 3 122.080 122.080 123.817 -1.737 25768 4578 1 6 . 1 1 3 3 LYS C C 3 173.490 173.490 174.399 -0.909 25768 4579 1 6 . 1 1 3 3 LYS CA C 3 55.050 55.050 54.819 0.231 25768 4580 1 6 . 1 1 3 3 LYS CB C 3 35.380 35.380 35.992 -0.612 25768 4581 1 6 . 1 1 3 3 LYS H H 3 8.620 8.620 7.965 0.655 25768 4582 1 6 . 1 1 4 4 ALA N N 4 120.860 120.860 121.475 -0.615 25768 4583 1 6 . 1 1 4 4 ALA C C 4 178.190 178.190 177.884 0.306 25768 4584 1 6 . 1 1 4 4 ALA CA C 4 53.480 53.480 53.305 0.175 25768 4585 1 6 . 1 1 4 4 ALA CB C 4 18.140 18.140 18.518 -0.378 25768 4586 1 6 . 1 1 4 4 ALA H H 4 8.580 8.580 8.271 0.309 25768 4587 1 6 . 1 1 5 5 GLY N N 5 112.890 112.890 112.504 0.386 25768 4588 1 6 . 1 1 5 5 GLY C C 5 173.830 173.830 172.717 1.113 25768 4589 1 6 . 1 1 5 5 GLY CA C 5 44.880 44.880 43.997 0.883 25768 4590 1 6 . 1 1 5 5 GLY H H 5 9.210 9.210 8.055 1.155 25768 4591 1 6 . 1 1 6 6 ASP N N 6 121.590 121.590 121.615 -0.025 25768 4592 1 6 . 1 1 6 6 ASP C C 6 174.380 174.380 174.355 0.025 25768 4593 1 6 . 1 1 6 6 ASP CA C 6 55.790 55.790 54.341 1.449 25768 4594 1 6 . 1 1 6 6 ASP CB C 6 41.760 41.760 41.033 0.727 25768 4595 1 6 . 1 1 6 6 ASP H H 6 7.620 7.620 7.178 0.442 25768 4596 1 6 . 1 1 7 7 PHE N N 7 120.860 120.860 121.942 -1.082 25768 4597 1 6 . 1 1 7 7 PHE C C 7 174.050 174.050 174.668 -0.618 25768 4598 1 6 . 1 1 7 7 PHE CA C 7 56.110 56.110 56.721 -0.611 25768 4599 1 6 . 1 1 7 7 PHE CB C 7 42.550 42.550 39.147 3.403 25768 4600 1 6 . 1 1 7 7 PHE H H 7 8.250 8.250 8.099 0.151 25768 4601 1 6 . 1 1 8 8 ILE N N 8 127.950 127.950 117.817 10.133 25768 4602 1 6 . 1 1 8 8 ILE C C 8 174.000 174.000 173.993 0.007 25768 4603 1 6 . 1 1 8 8 ILE CA C 8 61.160 61.160 59.571 1.589 25768 4604 1 6 . 1 1 8 8 ILE CB C 8 42.660 42.660 42.284 0.376 25768 4605 1 6 . 1 1 8 8 ILE H H 8 9.230 9.230 8.133 1.097 25768 4606 1 6 . 1 1 9 9 ILE N N 9 125.380 125.380 122.430 2.950 25768 4607 1 6 . 1 1 9 9 ILE C C 9 173.630 173.630 173.768 -0.138 25768 4608 1 6 . 1 1 9 9 ILE CA C 9 59.600 59.600 59.060 0.540 25768 4609 1 6 . 1 1 9 9 ILE CB C 9 41.180 41.180 42.081 -0.901 25768 4610 1 6 . 1 1 9 9 ILE H H 9 8.580 8.580 8.924 -0.344 25768 4611 1 6 . 1 1 10 10 ARG N N 10 124.950 124.950 127.702 -2.752 25768 4612 1 6 . 1 1 10 10 ARG C C 10 175.030 175.030 174.109 0.921 25768 4613 1 6 . 1 1 10 10 ARG CA C 10 53.920 53.920 53.996 -0.076 25768 4614 1 6 . 1 1 10 10 ARG CB C 10 31.880 31.880 34.938 -3.058 25768 4615 1 6 . 1 1 10 10 ARG H H 10 9.230 9.230 9.110 0.120 25768 4616 1 6 . 1 1 11 11 GLY N N 11 105.650 105.650 110.225 -4.575 25768 4617 1 6 . 1 1 11 11 GLY C C 11 172.090 172.090 171.893 0.197 25768 4618 1 6 . 1 1 11 11 GLY CA C 11 44.460 44.460 45.250 -0.790 25768 4619 1 6 . 1 1 11 11 GLY H H 11 8.780 8.780 9.081 -0.301 25768 4620 1 6 . 1 1 12 12 GLY N N 12 107.800 107.800 107.120 0.680 25768 4621 1 6 . 1 1 12 12 GLY C C 12 171.460 171.460 171.577 -0.117 25768 4622 1 6 . 1 1 12 12 GLY CA C 12 46.630 46.630 45.876 0.754 25768 4623 1 6 . 1 1 12 12 GLY H H 12 8.510 8.510 7.874 0.636 25768 4624 1 6 . 1 1 13 13 PHE N N 13 119.900 119.900 119.473 0.427 25768 4625 1 6 . 1 1 13 13 PHE C C 13 174.190 174.190 173.231 0.959 25768 4626 1 6 . 1 1 13 13 PHE CA C 13 56.340 56.340 56.105 0.235 25768 4627 1 6 . 1 1 13 13 PHE CB C 13 41.090 41.090 43.152 -2.062 25768 4628 1 6 . 1 1 13 13 PHE H H 13 8.610 8.610 8.202 0.408 25768 4629 1 6 . 1 1 14 14 ALA N N 14 128.030 128.030 124.328 3.702 25768 4630 1 6 . 1 1 14 14 ALA C C 14 176.560 176.560 176.017 0.543 25768 4631 1 6 . 1 1 14 14 ALA CA C 14 49.940 49.940 50.102 -0.162 25768 4632 1 6 . 1 1 14 14 ALA CB C 14 20.360 20.360 20.733 -0.373 25768 4633 1 6 . 1 1 14 14 ALA H H 14 9.220 9.220 7.390 1.830 25768 4634 1 6 . 1 1 15 15 THR N N 15 118.620 118.620 116.159 2.461 25768 4635 1 6 . 1 1 15 15 THR CA C 15 61.440 61.440 61.546 -0.106 25768 4636 1 6 . 1 1 15 15 THR CB C 15 71.370 71.370 69.777 1.593 25768 4637 1 6 . 1 1 15 15 THR H H 15 9.220 9.220 8.186 1.034 25768 4638 1 6 . 1 1 18 18 PRO C C 18 176.690 176.690 176.820 -0.130 25768 4639 1 6 . 1 1 18 18 PRO CA C 18 63.610 63.610 63.515 0.095 25768 4640 1 6 . 1 1 18 18 PRO CB C 18 32.440 32.440 32.223 0.217 25768 4641 1 6 . 1 1 19 19 ASP N N 19 120.320 120.320 120.674 -0.354 25768 4642 1 6 . 1 1 19 19 ASP C C 19 175.950 175.950 176.198 -0.248 25768 4643 1 6 . 1 1 19 19 ASP CA C 19 54.710 54.710 54.835 -0.125 25768 4644 1 6 . 1 1 19 19 ASP CB C 19 41.450 41.450 40.336 1.114 25768 4645 1 6 . 1 1 19 19 ASP H H 19 8.330 8.330 8.443 -0.113 25768 4646 1 6 . 1 1 20 20 ASP N N 20 121.990 121.990 124.603 -2.613 25768 4647 1 6 . 1 1 20 20 ASP C C 20 176.760 176.760 176.768 -0.008 25768 4648 1 6 . 1 1 20 20 ASP CA C 20 54.470 54.470 55.814 -1.344 25768 4649 1 6 . 1 1 20 20 ASP CB C 20 41.310 41.310 41.644 -0.334 25768 4650 1 6 . 1 1 20 20 ASP H H 20 8.240 8.240 8.032 0.208 25768 4651 1 6 . 1 1 21 21 SER N N 21 117.050 117.050 115.556 1.494 25768 4652 1 6 . 1 1 21 21 SER C C 21 175.170 175.170 174.218 0.952 25768 4653 1 6 . 1 1 21 21 SER CA C 21 59.490 59.490 57.883 1.607 25768 4654 1 6 . 1 1 21 21 SER CB C 21 64.080 64.080 64.217 -0.137 25768 4655 1 6 . 1 1 21 21 SER H H 21 8.360 8.360 8.250 0.110 25768 4656 1 6 . 1 1 22 22 SER N N 22 117.820 117.820 122.212 -4.392 25768 4657 1 6 . 1 1 22 22 SER C C 22 174.940 174.940 174.556 0.384 25768 4658 1 6 . 1 1 22 22 SER CA C 22 59.160 59.160 58.300 0.860 25768 4659 1 6 . 1 1 22 22 SER CB C 22 64.110 64.110 63.822 0.288 25768 4660 1 6 . 1 1 22 22 SER H H 22 8.310 8.310 8.497 -0.187 25768 4661 1 6 . 1 1 23 23 SER N N 23 117.660 117.660 117.015 0.645 25768 4662 1 6 . 1 1 23 23 SER C C 23 174.340 174.340 173.752 0.588 25768 4663 1 6 . 1 1 23 23 SER CA C 23 59.050 59.050 59.133 -0.083 25768 4664 1 6 . 1 1 23 23 SER CB C 23 64.210 64.210 63.469 0.741 25768 4665 1 6 . 1 1 23 23 SER H H 23 8.120 8.120 8.443 -0.323 25768 4666 1 6 . 1 1 24 24 ASP N N 24 122.590 122.590 124.015 -1.425 25768 4667 1 6 . 1 1 24 24 ASP C C 24 176.250 176.250 175.071 1.179 25768 4668 1 6 . 1 1 24 24 ASP CA C 24 54.910 54.910 54.014 0.896 25768 4669 1 6 . 1 1 24 24 ASP CB C 24 41.270 41.270 43.283 -2.013 25768 4670 1 6 . 1 1 24 24 ASP H H 24 8.230 8.230 8.270 -0.040 25768 4671 1 6 . 1 1 25 25 ILE N N 25 120.650 120.650 120.011 0.639 25768 4672 1 6 . 1 1 25 25 ILE C C 25 176.190 176.190 175.479 0.711 25768 4673 1 6 . 1 1 25 25 ILE CA C 25 61.880 61.880 60.688 1.192 25768 4674 1 6 . 1 1 25 25 ILE CB C 25 38.730 38.730 38.650 0.080 25768 4675 1 6 . 1 1 25 25 ILE H H 25 7.860 7.860 8.317 -0.457 25768 4676 1 6 . 1 1 26 26 LYS N N 26 124.420 124.420 128.910 -4.490 25768 4677 1 6 . 1 1 26 26 LYS C C 26 176.640 176.640 176.117 0.523 25768 4678 1 6 . 1 1 26 26 LYS CA C 26 56.520 56.520 55.459 1.062 25768 4679 1 6 . 1 1 26 26 LYS CB C 26 32.890 32.890 31.588 1.302 25768 4680 1 6 . 1 1 26 26 LYS H H 26 8.140 8.140 8.793 -0.653 25768 4681 1 6 . 1 1 27 27 LEU N N 27 123.120 123.120 122.163 0.957 25768 4682 1 6 . 1 1 27 27 LEU C C 27 177.110 177.110 175.644 1.466 25768 4683 1 6 . 1 1 27 27 LEU CA C 27 55.590 55.590 55.944 -0.354 25768 4684 1 6 . 1 1 27 27 LEU CB C 27 42.500 42.500 41.955 0.545 25768 4685 1 6 . 1 1 27 27 LEU H H 27 8.080 8.080 8.485 -0.405 25768 4686 1 6 . 1 1 28 28 ASP N N 28 120.850 120.850 117.284 3.566 25768 4687 1 6 . 1 1 28 28 ASP C C 28 176.960 176.960 174.589 2.371 25768 4688 1 6 . 1 1 28 28 ASP CA C 28 54.800 54.800 53.889 0.911 25768 4689 1 6 . 1 1 28 28 ASP CB C 28 41.380 41.380 42.918 -1.538 25768 4690 1 6 . 1 1 28 28 ASP H H 28 8.180 8.180 8.015 0.165 25768 4691 1 6 . 1 1 29 29 GLY N N 29 109.800 109.800 109.452 0.348 25768 4692 1 6 . 1 1 29 29 GLY C C 29 174.370 174.370 173.865 0.505 25768 4693 1 6 . 1 1 29 29 GLY CA C 29 46.150 46.150 45.058 1.092 25768 4694 1 6 . 1 1 29 29 GLY H H 29 8.230 8.230 8.342 -0.112 25768 4695 1 6 . 1 1 30 30 ALA N N 30 123.880 123.880 127.640 -3.760 25768 4696 1 6 . 1 1 30 30 ALA C C 30 178.040 178.040 177.459 0.581 25768 4697 1 6 . 1 1 30 30 ALA CA C 30 53.140 53.140 51.613 1.527 25768 4698 1 6 . 1 1 30 30 ALA CB C 30 19.350 19.350 18.416 0.934 25768 4699 1 6 . 1 1 30 30 ALA H H 30 8.040 8.040 8.280 -0.240 25768 4700 1 6 . 1 1 31 31 LYS N N 31 119.800 119.800 123.572 -3.772 25768 4701 1 6 . 1 1 31 31 LYS C C 31 176.770 176.770 176.127 0.643 25768 4702 1 6 . 1 1 31 31 LYS CA C 31 56.870 56.870 55.479 1.391 25768 4703 1 6 . 1 1 31 31 LYS CB C 31 32.980 32.980 31.354 1.626 25768 4704 1 6 . 1 1 31 31 LYS H H 31 8.060 8.060 8.113 -0.053 25768 4705 1 6 . 1 1 32 32 GLN N N 32 120.930 120.930 123.006 -2.076 25768 4706 1 6 . 1 1 32 32 GLN C C 32 176.000 176.000 175.544 0.456 25768 4707 1 6 . 1 1 32 32 GLN CA C 32 56.280 56.280 55.146 1.134 25768 4708 1 6 . 1 1 32 32 GLN CB C 32 29.580 29.580 27.985 1.595 25768 4709 1 6 . 1 1 32 32 GLN H H 32 8.170 8.170 8.498 -0.328 25768 4710 1 6 . 1 1 33 33 ARG N N 33 122.370 122.370 121.335 1.035 25768 4711 1 6 . 1 1 33 33 ARG C C 33 176.820 176.820 175.596 1.224 25768 4712 1 6 . 1 1 33 33 ARG CA C 33 56.680 56.680 57.122 -0.442 25768 4713 1 6 . 1 1 33 33 ARG CB C 33 31.040 31.040 30.169 0.872 25768 4714 1 6 . 1 1 33 33 ARG H H 33 8.270 8.270 8.129 0.141 25768 4715 1 6 . 1 1 34 34 GLY N N 34 110.210 110.210 106.909 3.301 25768 4716 1 6 . 1 1 34 34 GLY C C 34 174.280 174.280 174.967 -0.687 25768 4717 1 6 . 1 1 34 34 GLY CA C 34 45.770 45.770 44.617 1.153 25768 4718 1 6 . 1 1 34 34 GLY H H 34 8.360 8.360 8.224 0.136 25768 4719 1 6 . 1 1 35 35 THR N N 35 114.100 114.100 112.150 1.950 25768 4720 1 6 . 1 1 35 35 THR C C 35 174.550 174.550 174.104 0.446 25768 4721 1 6 . 1 1 35 35 THR CA C 35 62.140 62.140 64.383 -2.244 25768 4722 1 6 . 1 1 35 35 THR CB C 35 70.330 70.330 67.843 2.487 25768 4723 1 6 . 1 1 35 35 THR H H 35 7.970 7.970 8.263 -0.293 25768 4724 1 6 . 1 1 36 36 LYS N N 36 123.850 123.850 123.045 0.805 25768 4725 1 6 . 1 1 36 36 LYS C C 36 176.040 176.040 176.337 -0.297 25768 4726 1 6 . 1 1 36 36 LYS CA C 36 56.600 56.600 55.975 0.625 25768 4727 1 6 . 1 1 36 36 LYS CB C 36 33.280 33.280 33.085 0.195 25768 4728 1 6 . 1 1 36 36 LYS H H 36 8.230 8.230 8.236 -0.006 25768 4729 1 6 . 1 1 37 37 ALA N N 37 125.650 125.650 121.703 3.947 25768 4730 1 6 . 1 1 37 37 ALA C C 37 177.570 177.570 176.482 1.088 25768 4731 1 6 . 1 1 37 37 ALA CA C 37 52.860 52.860 52.470 0.390 25768 4732 1 6 . 1 1 37 37 ALA CB C 37 19.610 19.610 17.739 1.871 25768 4733 1 6 . 1 1 37 37 ALA H H 37 8.290 8.290 8.314 -0.024 25768 4734 1 6 . 1 1 38 38 THR N N 38 113.350 113.350 115.977 -2.627 25768 4735 1 6 . 1 1 38 38 THR C C 38 174.540 174.540 175.052 -0.512 25768 4736 1 6 . 1 1 38 38 THR CA C 38 62.010 62.010 61.903 0.107 25768 4737 1 6 . 1 1 38 38 THR CB C 38 70.350 70.350 69.471 0.879 25768 4738 1 6 . 1 1 38 38 THR H H 38 7.970 7.970 8.126 -0.156 25768 4739 1 6 . 1 1 39 39 VAL N N 39 120.790 120.790 124.223 -3.433 25768 4740 1 6 . 1 1 39 39 VAL C C 39 175.620 175.620 175.530 0.090 25768 4741 1 6 . 1 1 39 39 VAL CA C 39 62.470 62.470 63.178 -0.708 25768 4742 1 6 . 1 1 39 39 VAL CB C 39 32.940 32.940 32.374 0.566 25768 4743 1 6 . 1 1 39 39 VAL H H 39 8.020 8.020 8.590 -0.570 25768 4744 1 6 . 1 1 40 40 ASP N N 40 123.690 123.690 120.073 3.617 25768 4745 1 6 . 1 1 40 40 ASP C C 40 176.190 176.190 175.990 0.200 25768 4746 1 6 . 1 1 40 40 ASP CA C 40 54.780 54.780 53.664 1.116 25768 4747 1 6 . 1 1 40 40 ASP CB C 40 41.590 41.590 42.211 -0.621 25768 4748 1 6 . 1 1 40 40 ASP H H 40 8.310 8.310 7.965 0.345 25768 4749 1 6 . 1 1 41 41 SER N N 41 115.470 115.470 119.300 -3.830 25768 4750 1 6 . 1 1 41 41 SER C C 41 174.170 174.170 175.495 -1.325 25768 4751 1 6 . 1 1 41 41 SER CA C 41 59.000 59.000 58.479 0.521 25768 4752 1 6 . 1 1 41 41 SER CB C 41 64.420 64.420 64.323 0.097 25768 4753 1 6 . 1 1 41 41 SER H H 41 8.130 8.130 8.617 -0.487 25768 4754 1 6 . 1 1 42 42 ASP N N 42 122.430 122.430 122.358 0.072 25768 4755 1 6 . 1 1 42 42 ASP C C 42 175.740 175.740 174.698 1.042 25768 4756 1 6 . 1 1 42 42 ASP CA C 42 54.780 54.780 55.577 -0.797 25768 4757 1 6 . 1 1 42 42 ASP CB C 42 41.620 41.620 40.289 1.331 25768 4758 1 6 . 1 1 42 42 ASP H H 42 8.410 8.410 8.146 0.264 25768 4759 1 6 . 1 1 43 43 THR N N 43 117.580 117.580 112.999 4.581 25768 4760 1 6 . 1 1 43 43 THR C C 43 173.630 173.630 174.459 -0.829 25768 4761 1 6 . 1 1 43 43 THR CA C 43 63.120 63.120 61.477 1.643 25768 4762 1 6 . 1 1 43 43 THR CB C 43 70.650 70.650 69.916 0.734 25768 4763 1 6 . 1 1 43 43 THR H H 43 8.010 8.010 8.115 -0.105 25768 4764 1 6 . 1 1 44 44 GLN N N 44 125.420 125.420 125.468 -0.048 25768 4765 1 6 . 1 1 44 44 GLN C C 44 174.080 174.080 175.994 -1.914 25768 4766 1 6 . 1 1 44 44 GLN CA C 44 55.110 55.110 55.689 -0.579 25768 4767 1 6 . 1 1 44 44 GLN CB C 44 31.570 31.570 29.400 2.170 25768 4768 1 6 . 1 1 44 44 GLN H H 44 9.260 9.260 8.891 0.369 25768 4769 1 6 . 1 1 45 45 LEU N N 45 124.190 124.190 127.903 -3.713 25768 4770 1 6 . 1 1 45 45 LEU C C 45 175.970 175.970 176.580 -0.610 25768 4771 1 6 . 1 1 45 45 LEU CA C 45 54.690 54.690 55.301 -0.611 25768 4772 1 6 . 1 1 45 45 LEU CB C 45 42.270 42.270 42.703 -0.433 25768 4773 1 6 . 1 1 45 45 LEU H H 45 8.550 8.550 8.066 0.484 25768 4774 1 6 . 1 1 46 46 GLY N N 46 113.310 113.310 114.269 -0.959 25768 4775 1 6 . 1 1 46 46 GLY C C 46 171.180 171.180 173.858 -2.678 25768 4776 1 6 . 1 1 46 46 GLY CA C 46 44.400 44.400 44.998 -0.598 25768 4777 1 6 . 1 1 46 46 GLY H H 46 8.810 8.810 8.579 0.231 25768 4778 1 6 . 1 1 47 47 LEU N N 47 123.890 123.890 129.436 -5.546 25768 4779 1 6 . 1 1 47 47 LEU C C 47 175.400 175.400 175.212 0.188 25768 4780 1 6 . 1 1 47 47 LEU CA C 47 53.750 53.750 54.107 -0.357 25768 4781 1 6 . 1 1 47 47 LEU CB C 47 46.800 46.800 44.206 2.594 25768 4782 1 6 . 1 1 47 47 LEU H H 47 8.590 8.590 8.697 -0.107 25768 4783 1 6 . 1 1 48 48 THR N N 48 111.210 111.210 117.447 -6.237 25768 4784 1 6 . 1 1 48 48 THR C C 48 172.520 172.520 173.061 -0.541 25768 4785 1 6 . 1 1 48 48 THR CA C 48 58.950 58.950 60.946 -1.996 25768 4786 1 6 . 1 1 48 48 THR CB C 48 72.360 72.360 72.215 0.145 25768 4787 1 6 . 1 1 48 48 THR H H 48 8.620 8.620 8.919 -0.299 25768 4788 1 6 . 1 1 49 49 PHE N N 49 118.810 118.810 124.974 -6.164 25768 4789 1 6 . 1 1 49 49 PHE C C 49 174.700 174.700 175.498 -0.798 25768 4790 1 6 . 1 1 49 49 PHE CA C 49 55.080 55.080 57.065 -1.985 25768 4791 1 6 . 1 1 49 49 PHE CB C 49 42.360 42.360 41.688 0.672 25768 4792 1 6 . 1 1 49 49 PHE H H 49 8.410 8.410 8.673 -0.263 25768 4793 1 6 . 1 1 50 50 THR N N 50 121.230 121.230 121.318 -0.088 25768 4794 1 6 . 1 1 50 50 THR C C 50 173.250 173.250 173.086 0.164 25768 4795 1 6 . 1 1 50 50 THR CA C 50 62.740 62.740 61.649 1.091 25768 4796 1 6 . 1 1 50 50 THR CB C 50 73.740 73.740 70.029 3.711 25768 4797 1 6 . 1 1 50 50 THR H H 50 9.330 9.330 8.548 0.782 25768 4798 1 6 . 1 1 51 51 TYR N N 51 126.010 126.010 128.347 -2.337 25768 4799 1 6 . 1 1 51 51 TYR C C 51 174.850 174.850 174.165 0.685 25768 4800 1 6 . 1 1 51 51 TYR CA C 51 56.240 56.240 57.023 -0.783 25768 4801 1 6 . 1 1 51 51 TYR CB C 51 41.630 41.630 41.069 0.561 25768 4802 1 6 . 1 1 51 51 TYR H H 51 9.150 9.150 8.365 0.785 25768 4803 1 6 . 1 1 52 52 MET N N 52 127.390 127.390 126.083 1.307 25768 4804 1 6 . 1 1 52 52 MET C C 52 174.490 174.490 174.303 0.187 25768 4805 1 6 . 1 1 52 52 MET CA C 52 52.450 52.450 54.240 -1.790 25768 4806 1 6 . 1 1 52 52 MET CB C 52 28.590 28.590 33.121 -4.531 25768 4807 1 6 . 1 1 52 52 MET H H 52 7.950 7.950 8.482 -0.532 25768 4808 1 6 . 1 1 53 53 PHE N N 53 123.830 123.830 126.154 -2.324 25768 4809 1 6 . 1 1 53 53 PHE C C 53 173.720 173.720 173.757 -0.037 25768 4810 1 6 . 1 1 53 53 PHE CA C 53 57.110 57.110 56.873 0.237 25768 4811 1 6 . 1 1 53 53 PHE CB C 53 39.420 39.420 40.895 -1.475 25768 4812 1 6 . 1 1 53 53 PHE H H 53 7.720 7.720 8.527 -0.807 25768 4813 1 6 . 1 1 54 54 ALA N N 54 125.650 125.650 126.838 -1.188 25768 4814 1 6 . 1 1 54 54 ALA C C 54 175.020 175.020 175.469 -0.449 25768 4815 1 6 . 1 1 54 54 ALA CA C 54 50.740 50.740 52.803 -2.063 25768 4816 1 6 . 1 1 54 54 ALA CB C 54 22.700 22.700 18.535 4.165 25768 4817 1 6 . 1 1 54 54 ALA H H 54 8.360 8.360 8.167 0.193 25768 4818 1 6 . 1 1 55 55 ASP N N 55 118.790 118.790 121.390 -2.600 25768 4819 1 6 . 1 1 55 55 ASP C C 55 174.780 174.780 176.044 -1.264 25768 4820 1 6 . 1 1 55 55 ASP CA C 55 58.590 58.590 54.798 3.792 25768 4821 1 6 . 1 1 55 55 ASP CB C 55 40.430 40.430 40.688 -0.258 25768 4822 1 6 . 1 1 55 55 ASP H H 55 8.590 8.590 8.472 0.118 25768 4823 1 6 . 1 1 56 56 LYS N N 56 106.200 106.200 114.203 -8.003 25768 4824 1 6 . 1 1 56 56 LYS C C 56 174.940 174.940 175.871 -0.931 25768 4825 1 6 . 1 1 56 56 LYS CA C 56 55.260 55.260 55.823 -0.563 25768 4826 1 6 . 1 1 56 56 LYS CB C 56 34.510 34.510 33.460 1.050 25768 4827 1 6 . 1 1 56 56 LYS H H 56 7.260 7.260 7.224 0.036 25768 4828 1 6 . 1 1 57 57 TRP N N 57 115.680 115.680 123.929 -8.249 25768 4829 1 6 . 1 1 57 57 TRP C C 57 173.940 173.940 175.581 -1.641 25768 4830 1 6 . 1 1 57 57 TRP CA C 57 55.410 55.410 58.458 -3.048 25768 4831 1 6 . 1 1 57 57 TRP CB C 57 34.470 34.470 32.032 2.438 25768 4832 1 6 . 1 1 57 57 TRP H H 57 6.570 6.570 7.911 -1.341 25768 4833 1 6 . 1 1 58 58 GLY N N 58 107.610 107.610 109.254 -1.644 25768 4834 1 6 . 1 1 58 58 GLY C C 58 172.730 172.730 172.040 0.690 25768 4835 1 6 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.365 -0.315 25768 4836 1 6 . 1 1 58 58 GLY H H 58 9.260 9.260 8.424 0.836 25768 4837 1 6 . 1 1 59 59 VAL N N 59 118.130 118.130 119.556 -1.426 25768 4838 1 6 . 1 1 59 59 VAL C C 59 173.000 173.000 174.794 -1.794 25768 4839 1 6 . 1 1 59 59 VAL CA C 59 59.950 59.950 61.350 -1.400 25768 4840 1 6 . 1 1 59 59 VAL CB C 59 35.170 35.170 35.694 -0.524 25768 4841 1 6 . 1 1 59 59 VAL H H 59 9.030 9.030 8.791 0.239 25768 4842 1 6 . 1 1 60 60 GLU N N 60 127.900 127.900 125.548 2.352 25768 4843 1 6 . 1 1 60 60 GLU C C 60 174.470 174.470 174.161 0.309 25768 4844 1 6 . 1 1 60 60 GLU CA C 60 52.940 52.940 55.596 -2.656 25768 4845 1 6 . 1 1 60 60 GLU CB C 60 35.100 35.100 33.617 1.483 25768 4846 1 6 . 1 1 60 60 GLU H H 60 9.440 9.440 8.639 0.801 25768 4847 1 6 . 1 1 61 61 LEU N N 61 127.410 127.410 125.896 1.514 25768 4848 1 6 . 1 1 61 61 LEU C C 61 174.950 174.950 174.749 0.201 25768 4849 1 6 . 1 1 61 61 LEU CA C 61 53.390 53.390 53.883 -0.492 25768 4850 1 6 . 1 1 61 61 LEU CB C 61 45.980 45.980 46.042 -0.062 25768 4851 1 6 . 1 1 61 61 LEU H H 61 8.740 8.740 8.205 0.535 25768 4852 1 6 . 1 1 62 62 VAL N N 62 125.750 125.750 123.274 2.476 25768 4853 1 6 . 1 1 62 62 VAL C C 62 173.960 173.960 174.397 -0.437 25768 4854 1 6 . 1 1 62 62 VAL CA C 62 61.350 61.350 60.745 0.605 25768 4855 1 6 . 1 1 62 62 VAL CB C 62 34.740 34.740 34.627 0.113 25768 4856 1 6 . 1 1 62 62 VAL H H 62 8.790 8.790 8.125 0.665 25768 4857 1 6 . 1 1 63 63 ALA N N 63 127.230 127.230 125.428 1.802 25768 4858 1 6 . 1 1 63 63 ALA C C 63 173.930 173.930 174.844 -0.914 25768 4859 1 6 . 1 1 63 63 ALA CA C 63 51.140 51.140 52.617 -1.477 25768 4860 1 6 . 1 1 63 63 ALA CB C 63 22.500 22.500 21.710 0.790 25768 4861 1 6 . 1 1 63 63 ALA H H 63 8.740 8.740 8.402 0.338 25768 4862 1 6 . 1 1 64 64 ALA N N 64 120.410 120.410 125.465 -5.055 25768 4863 1 6 . 1 1 64 64 ALA C C 64 176.770 176.770 176.825 -0.055 25768 4864 1 6 . 1 1 64 64 ALA CA C 64 51.420 51.420 50.943 0.477 25768 4865 1 6 . 1 1 64 64 ALA CB C 64 22.590 22.590 22.555 0.035 25768 4866 1 6 . 1 1 64 64 ALA H H 64 8.290 8.290 8.355 -0.065 25768 4867 1 6 . 1 1 65 65 THR N N 65 116.130 116.130 112.568 3.562 25768 4868 1 6 . 1 1 65 65 THR C C 65 171.220 171.220 174.191 -2.971 25768 4869 1 6 . 1 1 65 65 THR CA C 65 58.860 58.860 58.802 0.058 25768 4870 1 6 . 1 1 65 65 THR CB C 65 72.020 72.020 68.768 3.252 25768 4871 1 6 . 1 1 65 65 THR H H 65 8.760 8.760 8.462 0.298 25768 4872 1 6 . 1 1 66 66 PRO C C 66 176.720 176.720 176.643 0.077 25768 4873 1 6 . 1 1 66 66 PRO CA C 66 63.610 63.610 64.700 -1.089 25768 4874 1 6 . 1 1 66 66 PRO CB C 66 32.550 32.550 32.069 0.481 25768 4875 1 6 . 1 1 67 67 PHE N N 67 120.360 120.360 115.554 4.806 25768 4876 1 6 . 1 1 67 67 PHE C C 67 175.480 175.480 176.184 -0.704 25768 4877 1 6 . 1 1 67 67 PHE CA C 67 58.840 58.840 57.459 1.381 25768 4878 1 6 . 1 1 67 67 PHE CB C 67 40.170 40.170 40.700 -0.530 25768 4879 1 6 . 1 1 67 67 PHE H H 67 8.590 8.590 7.814 0.776 25768 4880 1 6 . 1 1 68 68 ASN N N 68 119.030 119.030 120.577 -1.547 25768 4881 1 6 . 1 1 68 68 ASN C C 68 174.740 174.740 174.187 0.553 25768 4882 1 6 . 1 1 68 68 ASN CA C 68 53.430 53.430 54.411 -0.981 25768 4883 1 6 . 1 1 68 68 ASN CB C 68 39.420 39.420 37.878 1.542 25768 4884 1 6 . 1 1 68 68 ASN H H 68 8.340 8.340 8.764 -0.424 25768 4885 1 6 . 1 1 69 69 HIS N N 69 119.590 119.590 122.467 -2.877 25768 4886 1 6 . 1 1 69 69 HIS C C 69 174.370 174.370 174.110 0.260 25768 4887 1 6 . 1 1 69 69 HIS CA C 69 55.950 55.950 55.737 0.213 25768 4888 1 6 . 1 1 69 69 HIS CB C 69 29.960 29.960 32.879 -2.918 25768 4889 1 6 . 1 1 69 69 HIS H H 69 8.350 8.350 8.117 0.233 25768 4890 1 6 . 1 1 70 70 GLN N N 70 121.980 121.980 123.896 -1.916 25768 4891 1 6 . 1 1 70 70 GLN C C 70 175.740 175.740 174.710 1.030 25768 4892 1 6 . 1 1 70 70 GLN CA C 70 56.340 56.340 55.902 0.438 25768 4893 1 6 . 1 1 70 70 GLN CB C 70 29.660 29.660 29.086 0.574 25768 4894 1 6 . 1 1 70 70 GLN H H 70 8.350 8.350 8.748 -0.398 25768 4895 1 6 . 1 1 71 71 VAL N N 71 120.530 120.530 125.442 -4.912 25768 4896 1 6 . 1 1 71 71 VAL C C 71 175.500 175.500 174.099 1.401 25768 4897 1 6 . 1 1 71 71 VAL CA C 71 62.540 62.540 63.002 -0.462 25768 4898 1 6 . 1 1 71 71 VAL CB C 71 33.090 33.090 33.951 -0.861 25768 4899 1 6 . 1 1 71 71 VAL H H 71 8.020 8.020 8.073 -0.053 25768 4900 1 6 . 1 1 72 72 ASP N N 72 123.910 123.910 125.946 -2.036 25768 4901 1 6 . 1 1 72 72 ASP C C 72 176.300 176.300 176.842 -0.542 25768 4902 1 6 . 1 1 72 72 ASP CA C 72 54.340 54.340 54.650 -0.310 25768 4903 1 6 . 1 1 72 72 ASP CB C 72 41.480 41.480 41.261 0.219 25768 4904 1 6 . 1 1 72 72 ASP H H 72 8.280 8.280 8.492 -0.212 25768 4905 1 6 . 1 1 73 73 VAL N N 73 120.580 120.580 117.718 2.862 25768 4906 1 6 . 1 1 73 73 VAL C C 73 176.350 176.350 175.879 0.471 25768 4907 1 6 . 1 1 73 73 VAL CA C 73 62.970 62.970 63.678 -0.708 25768 4908 1 6 . 1 1 73 73 VAL CB C 73 32.550 32.550 31.941 0.609 25768 4909 1 6 . 1 1 73 73 VAL H H 73 7.960 7.960 7.759 0.201 25768 4910 1 6 . 1 1 74 74 LYS N N 74 123.620 123.620 122.162 1.458 25768 4911 1 6 . 1 1 74 74 LYS C C 74 177.130 177.130 175.565 1.565 25768 4912 1 6 . 1 1 74 74 LYS CA C 74 57.060 57.060 56.138 0.922 25768 4913 1 6 . 1 1 74 74 LYS CB C 74 32.860 32.860 33.053 -0.193 25768 4914 1 6 . 1 1 74 74 LYS H H 74 8.230 8.230 7.874 0.356 25768 4915 1 6 . 1 1 75 75 GLY N N 75 109.370 109.370 113.380 -4.010 25768 4916 1 6 . 1 1 75 75 GLY C C 75 174.030 174.030 174.280 -0.250 25768 4917 1 6 . 1 1 75 75 GLY CA C 75 45.800 45.800 45.538 0.262 25768 4918 1 6 . 1 1 75 75 GLY H H 75 8.160 8.160 8.501 -0.341 25768 4919 1 6 . 1 1 76 76 LEU N N 76 121.660 121.660 121.216 0.444 25768 4920 1 6 . 1 1 76 76 LEU C C 76 177.410 177.410 177.363 0.047 25768 4921 1 6 . 1 1 76 76 LEU CA C 76 55.410 55.410 54.940 0.470 25768 4922 1 6 . 1 1 76 76 LEU CB C 76 42.790 42.790 43.247 -0.457 25768 4923 1 6 . 1 1 76 76 LEU H H 76 8.030 8.030 7.990 0.040 25768 4924 1 6 . 1 1 77 77 GLY N N 77 109.330 109.330 108.415 0.915 25768 4925 1 6 . 1 1 77 77 GLY C C 77 171.800 171.800 173.304 -1.504 25768 4926 1 6 . 1 1 77 77 GLY CA C 77 44.990 44.990 44.480 0.510 25768 4927 1 6 . 1 1 77 77 GLY H H 77 8.100 8.100 8.268 -0.168 25768 4928 1 6 . 1 1 78 78 PRO C C 78 177.740 177.740 176.725 1.015 25768 4929 1 6 . 1 1 78 78 PRO CA C 78 63.890 63.890 63.453 0.437 25768 4930 1 6 . 1 1 78 78 PRO CB C 78 32.170 32.170 32.113 0.057 25768 4931 1 6 . 1 1 79 79 GLY N N 79 109.530 109.530 106.697 2.833 25768 4932 1 6 . 1 1 79 79 GLY C C 79 174.460 174.460 173.165 1.295 25768 4933 1 6 . 1 1 79 79 GLY CA C 79 45.780 45.780 44.376 1.404 25768 4934 1 6 . 1 1 79 79 GLY H H 79 8.410 8.410 7.969 0.441 25768 4935 1 6 . 1 1 80 80 LEU N N 80 121.880 121.880 124.203 -2.323 25768 4936 1 6 . 1 1 80 80 LEU C C 80 177.100 177.100 176.282 0.818 25768 4937 1 6 . 1 1 80 80 LEU CA C 80 55.720 55.720 54.550 1.170 25768 4938 1 6 . 1 1 80 80 LEU CB C 80 42.580 42.580 43.325 -0.745 25768 4939 1 6 . 1 1 80 80 LEU H H 80 8.010 8.010 8.367 -0.357 25768 4940 1 6 . 1 1 81 81 ASP N N 81 119.990 119.990 123.853 -3.863 25768 4941 1 6 . 1 1 81 81 ASP C C 81 176.880 176.880 176.669 0.211 25768 4942 1 6 . 1 1 81 81 ASP CA C 81 54.770 54.770 54.312 0.459 25768 4943 1 6 . 1 1 81 81 ASP CB C 81 41.390 41.390 40.987 0.403 25768 4944 1 6 . 1 1 81 81 ASP H H 81 8.220 8.220 8.634 -0.414 25768 4945 1 6 . 1 1 82 82 GLY N N 82 109.270 109.270 108.069 1.201 25768 4946 1 6 . 1 1 82 82 GLY C C 82 174.190 174.190 174.250 -0.060 25768 4947 1 6 . 1 1 82 82 GLY CA C 82 45.990 45.990 44.843 1.147 25768 4948 1 6 . 1 1 82 82 GLY H H 82 8.170 8.170 7.935 0.235 25768 4949 1 6 . 1 1 83 83 LYS N N 83 121.000 121.000 120.640 0.360 25768 4950 1 6 . 1 1 83 83 LYS C C 83 176.610 176.610 175.779 0.831 25768 4951 1 6 . 1 1 83 83 LYS CA C 83 56.620 56.620 56.243 0.377 25768 4952 1 6 . 1 1 83 83 LYS CB C 83 33.020 33.020 32.492 0.528 25768 4953 1 6 . 1 1 83 83 LYS H H 83 7.970 7.970 8.037 -0.067 25768 4954 1 6 . 1 1 84 84 LEU N N 84 123.120 123.120 123.476 -0.356 25768 4955 1 6 . 1 1 84 84 LEU C C 84 176.920 176.920 175.474 1.446 25768 4956 1 6 . 1 1 84 84 LEU CA C 84 55.550 55.550 55.747 -0.197 25768 4957 1 6 . 1 1 84 84 LEU CB C 84 42.430 42.430 42.655 -0.225 25768 4958 1 6 . 1 1 84 84 LEU H H 84 8.130 8.130 8.705 -0.575 25768 4959 1 6 . 1 1 85 85 ALA N N 85 123.930 123.930 123.240 0.690 25768 4960 1 6 . 1 1 85 85 ALA C C 85 177.060 177.060 176.777 0.283 25768 4961 1 6 . 1 1 85 85 ALA CA C 85 52.790 52.790 51.560 1.230 25768 4962 1 6 . 1 1 85 85 ALA CB C 85 19.670 19.670 19.910 -0.240 25768 4963 1 6 . 1 1 85 85 ALA H H 85 8.040 8.040 7.927 0.113 25768 4964 1 6 . 1 1 86 86 ASP N N 86 119.760 119.760 119.152 0.608 25768 4965 1 6 . 1 1 86 86 ASP C C 86 175.820 175.820 174.978 0.842 25768 4966 1 6 . 1 1 86 86 ASP CA C 86 54.520 54.520 54.155 0.365 25768 4967 1 6 . 1 1 86 86 ASP CB C 86 41.390 41.390 38.833 2.557 25768 4968 1 6 . 1 1 86 86 ASP H H 86 8.110 8.110 8.578 -0.468 25768 4969 1 6 . 1 1 87 87 ILE N N 87 120.620 120.620 115.310 5.310 25768 4970 1 6 . 1 1 87 87 ILE C C 87 175.740 175.740 174.953 0.787 25768 4971 1 6 . 1 1 87 87 ILE CA C 87 61.160 61.160 60.708 0.452 25768 4972 1 6 . 1 1 87 87 ILE CB C 87 39.260 39.260 40.401 -1.141 25768 4973 1 6 . 1 1 87 87 ILE H H 87 7.800 7.800 7.421 0.379 25768 4974 1 6 . 1 1 88 88 LYS N N 88 125.820 125.820 123.799 2.021 25768 4975 1 6 . 1 1 88 88 LYS C C 88 175.340 175.340 177.308 -1.968 25768 4976 1 6 . 1 1 88 88 LYS CA C 88 56.300 56.300 57.584 -1.284 25768 4977 1 6 . 1 1 88 88 LYS CB C 88 32.900 32.900 32.719 0.181 25768 4978 1 6 . 1 1 88 88 LYS H H 88 8.250 8.250 8.313 -0.063 25768 4979 1 6 . 1 1 89 89 GLN N N 89 121.750 121.750 118.046 3.704 25768 4980 1 6 . 1 1 89 89 GLN C C 89 175.000 175.000 174.426 0.574 25768 4981 1 6 . 1 1 89 89 GLN CA C 89 55.210 55.210 55.974 -0.764 25768 4982 1 6 . 1 1 89 89 GLN CB C 89 30.570 30.570 29.038 1.532 25768 4983 1 6 . 1 1 89 89 GLN H H 89 8.000 8.000 8.006 -0.006 25768 4984 1 6 . 1 1 90 90 LEU N N 90 126.660 126.660 127.627 -0.967 25768 4985 1 6 . 1 1 90 90 LEU C C 90 174.240 174.240 175.368 -1.128 25768 4986 1 6 . 1 1 90 90 LEU CA C 90 52.720 52.720 52.276 0.445 25768 4987 1 6 . 1 1 90 90 LEU CB C 90 42.350 42.350 41.992 0.358 25768 4988 1 6 . 1 1 90 90 LEU H H 90 8.630 8.630 8.333 0.297 25768 4989 1 6 . 1 1 92 92 PRO C C 92 173.900 173.900 176.698 -2.798 25768 4990 1 6 . 1 1 92 92 PRO CA C 92 63.320 63.320 63.184 0.136 25768 4991 1 6 . 1 1 92 92 PRO CB C 92 31.920 31.920 32.275 -0.355 25768 4992 1 6 . 1 1 93 93 THR N N 93 119.770 119.770 114.535 5.235 25768 4993 1 6 . 1 1 93 93 THR C C 93 171.360 171.360 173.912 -2.552 25768 4994 1 6 . 1 1 93 93 THR CA C 93 62.610 62.610 61.922 0.688 25768 4995 1 6 . 1 1 93 93 THR CB C 93 72.680 72.680 69.303 3.377 25768 4996 1 6 . 1 1 93 93 THR H H 93 8.290 8.290 8.245 0.045 25768 4997 1 6 . 1 1 94 94 LEU N N 94 128.880 128.880 126.702 2.178 25768 4998 1 6 . 1 1 94 94 LEU C C 94 175.130 175.130 175.090 0.040 25768 4999 1 6 . 1 1 94 94 LEU CA C 94 53.520 53.520 54.354 -0.834 25768 5000 1 6 . 1 1 94 94 LEU CB C 94 46.140 46.140 42.568 3.572 25768 5001 1 6 . 1 1 94 94 LEU H H 94 8.680 8.680 8.770 -0.090 25768 5002 1 6 . 1 1 95 95 LEU N N 95 123.630 123.630 121.665 1.965 25768 5003 1 6 . 1 1 95 95 LEU C C 95 175.540 175.540 175.752 -0.212 25768 5004 1 6 . 1 1 95 95 LEU CA C 95 55.190 55.190 54.061 1.129 25768 5005 1 6 . 1 1 95 95 LEU CB C 95 45.300 45.300 46.672 -1.372 25768 5006 1 6 . 1 1 95 95 LEU H H 95 9.580 9.580 8.409 1.171 25768 5007 1 6 . 1 1 96 96 LEU N N 96 123.150 123.150 119.228 3.922 25768 5008 1 6 . 1 1 96 96 LEU C C 96 174.960 174.960 175.752 -0.792 25768 5009 1 6 . 1 1 96 96 LEU CA C 96 54.420 54.420 53.653 0.767 25768 5010 1 6 . 1 1 96 96 LEU CB C 96 44.560 44.560 44.231 0.329 25768 5011 1 6 . 1 1 96 96 LEU H H 96 8.770 8.770 8.573 0.197 25768 5012 1 6 . 1 1 97 97 GLN N N 97 121.290 121.290 119.492 1.798 25768 5013 1 6 . 1 1 97 97 GLN C C 97 174.380 174.380 173.907 0.473 25768 5014 1 6 . 1 1 97 97 GLN CA C 97 54.740 54.740 54.542 0.198 25768 5015 1 6 . 1 1 97 97 GLN CB C 97 36.600 36.600 32.679 3.921 25768 5016 1 6 . 1 1 97 97 GLN H H 97 9.480 9.480 8.466 1.014 25768 5017 1 6 . 1 1 98 98 TYR N N 98 122.250 122.250 127.469 -5.219 25768 5018 1 6 . 1 1 98 98 TYR C C 98 173.460 173.460 175.136 -1.676 25768 5019 1 6 . 1 1 98 98 TYR CA C 98 55.160 55.160 55.693 -0.533 25768 5020 1 6 . 1 1 98 98 TYR CB C 98 42.420 42.420 41.902 0.518 25768 5021 1 6 . 1 1 98 98 TYR H H 98 9.010 9.010 8.150 0.860 25768 5022 1 6 . 1 1 99 99 TYR N N 99 126.860 126.860 127.858 -0.998 25768 5023 1 6 . 1 1 99 99 TYR C C 99 175.380 175.380 174.456 0.924 25768 5024 1 6 . 1 1 99 99 TYR CA C 99 54.220 54.220 54.952 -0.732 25768 5025 1 6 . 1 1 99 99 TYR CB C 99 38.890 38.890 37.021 1.869 25768 5026 1 6 . 1 1 99 99 TYR H H 99 8.300 8.300 8.073 0.227 25768 5027 1 6 . 1 1 100 100 PRO C C 100 178.330 178.330 176.420 1.910 25768 5028 1 6 . 1 1 100 100 PRO CA C 100 64.750 64.750 64.438 0.312 25768 5029 1 6 . 1 1 100 100 PRO CB C 100 32.130 32.130 32.301 -0.171 25768 5030 1 6 . 1 1 101 101 MET N N 101 114.520 114.520 117.920 -3.400 25768 5031 1 6 . 1 1 101 101 MET C C 101 178.240 178.240 174.890 3.350 25768 5032 1 6 . 1 1 101 101 MET CA C 101 53.500 53.500 54.347 -0.847 25768 5033 1 6 . 1 1 101 101 MET CB C 101 30.160 30.160 34.213 -4.053 25768 5034 1 6 . 1 1 101 101 MET H H 101 9.390 9.390 8.058 1.332 25768 5035 1 6 . 1 1 102 102 GLY N N 102 117.500 117.500 107.390 10.110 25768 5036 1 6 . 1 1 102 102 GLY C C 102 175.690 175.690 174.437 1.253 25768 5037 1 6 . 1 1 102 102 GLY CA C 102 46.760 46.760 44.843 1.917 25768 5038 1 6 . 1 1 102 102 GLY H H 102 8.640 8.640 7.681 0.959 25768 5039 1 6 . 1 1 103 103 GLY N N 103 111.030 111.030 109.330 1.700 25768 5040 1 6 . 1 1 103 103 GLY C C 103 174.070 174.070 173.412 0.658 25768 5041 1 6 . 1 1 103 103 GLY CA C 103 46.140 46.140 45.078 1.062 25768 5042 1 6 . 1 1 103 103 GLY H H 103 9.390 9.390 8.485 0.905 25768 5043 1 6 . 1 1 104 104 THR N N 104 109.290 109.290 113.845 -4.555 25768 5044 1 6 . 1 1 104 104 THR C C 104 174.290 174.290 173.507 0.783 25768 5045 1 6 . 1 1 104 104 THR CA C 104 60.900 60.900 61.310 -0.410 25768 5046 1 6 . 1 1 104 104 THR CB C 104 72.070 72.070 70.554 1.516 25768 5047 1 6 . 1 1 104 104 THR H H 104 7.290 7.290 7.811 -0.521 25768 5048 1 6 . 1 1 105 105 ASN C C 105 175.050 175.050 174.728 0.322 25768 5049 1 6 . 1 1 105 105 ASN CA C 105 52.880 52.880 53.153 -0.273 25768 5050 1 6 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.617 -0.357 25768 5051 1 6 . 1 1 106 106 SER N N 106 113.000 113.000 117.008 -4.008 25768 5052 1 6 . 1 1 106 106 SER C C 106 176.000 176.000 175.404 0.596 25768 5053 1 6 . 1 1 106 106 SER CA C 106 58.700 58.700 57.904 0.796 25768 5054 1 6 . 1 1 106 106 SER CB C 106 64.540 64.540 64.324 0.216 25768 5055 1 6 . 1 1 106 106 SER H H 106 7.450 7.450 7.604 -0.154 25768 5056 1 6 . 1 1 107 107 ALA N N 107 132.220 132.220 127.960 4.260 25768 5057 1 6 . 1 1 107 107 ALA C C 107 176.610 176.610 177.244 -0.634 25768 5058 1 6 . 1 1 107 107 ALA CA C 107 54.380 54.380 53.501 0.879 25768 5059 1 6 . 1 1 107 107 ALA CB C 107 18.690 18.690 19.283 -0.593 25768 5060 1 6 . 1 1 107 107 ALA H H 107 8.870 8.870 8.527 0.343 25768 5061 1 6 . 1 1 108 108 PHE N N 108 116.050 116.050 117.322 -1.272 25768 5062 1 6 . 1 1 108 108 PHE C C 108 174.270 174.270 175.062 -0.792 25768 5063 1 6 . 1 1 108 108 PHE CA C 108 56.140 56.140 58.130 -1.990 25768 5064 1 6 . 1 1 108 108 PHE CB C 108 40.520 40.520 40.745 -0.225 25768 5065 1 6 . 1 1 108 108 PHE H H 108 7.550 7.550 7.695 -0.145 25768 5066 1 6 . 1 1 109 109 GLN N N 109 128.260 128.260 123.606 4.654 25768 5067 1 6 . 1 1 109 109 GLN C C 109 172.300 172.300 173.795 -1.495 25768 5068 1 6 . 1 1 109 109 GLN CA C 109 52.310 52.310 53.251 -0.941 25768 5069 1 6 . 1 1 109 109 GLN CB C 109 29.050 29.050 30.022 -0.972 25768 5070 1 6 . 1 1 109 109 GLN H H 109 9.060 9.060 8.458 0.602 25768 5071 1 6 . 1 1 110 110 PRO C C 110 175.020 175.020 176.131 -1.111 25768 5072 1 6 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.899 -1.349 25768 5073 1 6 . 1 1 110 110 PRO CB C 110 33.280 33.280 31.865 1.415 25768 5074 1 6 . 1 1 111 111 TYR N N 111 115.730 115.730 117.865 -2.135 25768 5075 1 6 . 1 1 111 111 TYR C C 111 173.850 173.850 173.512 0.338 25768 5076 1 6 . 1 1 111 111 TYR CA C 111 56.470 56.470 55.814 0.656 25768 5077 1 6 . 1 1 111 111 TYR CB C 111 38.650 38.650 40.469 -1.819 25768 5078 1 6 . 1 1 111 111 TYR H H 111 8.500 8.500 8.175 0.325 25768 5079 1 6 . 1 1 112 112 GLY N N 112 103.570 103.570 107.347 -3.777 25768 5080 1 6 . 1 1 112 112 GLY C C 112 172.020 172.020 172.755 -0.735 25768 5081 1 6 . 1 1 112 112 GLY CA C 112 43.950 43.950 43.033 0.917 25768 5082 1 6 . 1 1 112 112 GLY H H 112 8.110 8.110 8.254 -0.144 25768 5083 1 6 . 1 1 113 113 GLY N N 113 108.510 108.510 107.526 0.984 25768 5084 1 6 . 1 1 113 113 GLY C C 113 171.540 171.540 172.235 -0.695 25768 5085 1 6 . 1 1 113 113 GLY CA C 113 46.120 46.120 44.380 1.740 25768 5086 1 6 . 1 1 113 113 GLY H H 113 9.080 9.080 8.647 0.433 25768 5087 1 6 . 1 1 114 114 LEU N N 114 120.270 120.270 124.742 -4.472 25768 5088 1 6 . 1 1 114 114 LEU C C 114 175.810 175.810 177.101 -1.291 25768 5089 1 6 . 1 1 114 114 LEU CA C 114 53.920 53.920 53.664 0.256 25768 5090 1 6 . 1 1 114 114 LEU CB C 114 47.940 47.940 44.404 3.537 25768 5091 1 6 . 1 1 114 114 LEU H H 114 8.620 8.620 8.205 0.415 25768 5092 1 6 . 1 1 115 115 GLY N N 115 110.620 110.620 111.666 -1.046 25768 5093 1 6 . 1 1 115 115 GLY C C 115 171.560 171.560 173.378 -1.818 25768 5094 1 6 . 1 1 115 115 GLY CA C 115 46.940 46.940 44.648 2.292 25768 5095 1 6 . 1 1 115 115 GLY H H 115 9.000 9.000 8.781 0.219 25768 5096 1 6 . 1 1 116 116 VAL N N 116 113.600 113.600 125.337 -11.737 25768 5097 1 6 . 1 1 116 116 VAL C C 116 174.120 174.120 174.903 -0.783 25768 5098 1 6 . 1 1 116 116 VAL CA C 116 58.970 58.970 60.204 -1.234 25768 5099 1 6 . 1 1 116 116 VAL CB C 116 36.600 36.600 33.172 3.428 25768 5100 1 6 . 1 1 116 116 VAL H H 116 8.680 8.680 7.969 0.711 25768 5101 1 6 . 1 1 117 117 ASN N N 117 120.020 120.020 123.846 -3.826 25768 5102 1 6 . 1 1 117 117 ASN CA C 117 52.190 52.190 53.189 -0.999 25768 5103 1 6 . 1 1 117 117 ASN CB C 117 42.450 42.450 42.579 -0.129 25768 5104 1 6 . 1 1 117 117 ASN H H 117 8.840 8.840 8.771 0.069 25768 5105 1 6 . 1 1 119 119 THR C C 119 174.350 174.350 174.129 0.221 25768 5106 1 6 . 1 1 119 119 THR CA C 119 63.140 63.140 62.121 1.019 25768 5107 1 6 . 1 1 119 119 THR CB C 119 70.170 70.170 69.604 0.566 25768 5108 1 6 . 1 1 120 120 THR N N 120 114.120 114.120 116.831 -2.711 25768 5109 1 6 . 1 1 120 120 THR C C 120 174.220 174.220 173.065 1.155 25768 5110 1 6 . 1 1 120 120 THR CA C 120 61.900 61.900 63.294 -1.394 25768 5111 1 6 . 1 1 120 120 THR CB C 120 70.140 70.140 68.249 1.891 25768 5112 1 6 . 1 1 120 120 THR H H 120 7.570 7.570 8.144 -0.574 25768 5113 1 6 . 1 1 121 121 PHE N N 121 121.230 121.230 124.155 -2.925 25768 5114 1 6 . 1 1 121 121 PHE C C 121 174.910 174.910 174.361 0.549 25768 5115 1 6 . 1 1 121 121 PHE CA C 121 58.720 58.720 57.529 1.191 25768 5116 1 6 . 1 1 121 121 PHE CB C 121 40.470 40.470 40.117 0.353 25768 5117 1 6 . 1 1 121 121 PHE H H 121 7.830 7.830 7.929 -0.099 25768 5118 1 6 . 1 1 122 122 PHE C C 122 175.070 175.070 174.527 0.543 25768 5119 1 6 . 1 1 122 122 PHE CA C 122 57.890 57.890 56.267 1.623 25768 5120 1 6 . 1 1 122 122 PHE CB C 122 39.870 39.870 40.360 -0.490 25768 5121 1 6 . 1 1 123 123 ASP N N 123 122.170 122.170 121.763 0.407 25768 5122 1 6 . 1 1 123 123 ASP C C 123 176.150 176.150 176.584 -0.434 25768 5123 1 6 . 1 1 123 123 ASP CA C 123 54.530 54.530 53.777 0.753 25768 5124 1 6 . 1 1 123 123 ASP CB C 123 41.830 41.830 43.346 -1.516 25768 5125 1 6 . 1 1 123 123 ASP H H 123 7.950 7.950 8.607 -0.657 25768 5126 1 6 . 1 1 124 124 GLU N N 124 122.690 122.690 121.065 1.625 25768 5127 1 6 . 1 1 124 124 GLU C C 124 176.630 176.630 177.590 -0.960 25768 5128 1 6 . 1 1 124 124 GLU CA C 124 57.620 57.620 58.358 -0.737 25768 5129 1 6 . 1 1 124 124 GLU CB C 124 30.450 30.450 30.186 0.264 25768 5130 1 6 . 1 1 124 124 GLU H H 124 8.340 8.340 8.685 -0.345 25768 5131 1 6 . 1 1 125 125 ASP N N 125 121.280 121.280 120.048 1.232 25768 5132 1 6 . 1 1 125 125 ASP C C 125 176.940 176.940 178.677 -1.737 25768 5133 1 6 . 1 1 125 125 ASP CA C 125 55.180 55.180 57.240 -2.060 25768 5134 1 6 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.432 0.788 25768 5135 1 6 . 1 1 125 125 ASP H H 125 8.310 8.310 8.569 -0.259 25768 5136 1 6 . 1 1 126 126 LEU N N 126 122.830 122.830 120.106 2.724 25768 5137 1 6 . 1 1 126 126 LEU C C 126 178.020 178.020 177.390 0.630 25768 5138 1 6 . 1 1 126 126 LEU CA C 126 56.450 56.450 57.004 -0.554 25768 5139 1 6 . 1 1 126 126 LEU CB C 126 42.150 42.150 41.958 0.192 25768 5140 1 6 . 1 1 126 126 LEU H H 126 8.010 8.010 8.204 -0.194 25768 5141 1 6 . 1 1 127 127 ALA N N 127 122.660 122.660 117.802 4.858 25768 5142 1 6 . 1 1 127 127 ALA C C 127 178.600 178.600 177.553 1.047 25768 5143 1 6 . 1 1 127 127 ALA CA C 127 53.780 53.780 52.344 1.436 25768 5144 1 6 . 1 1 127 127 ALA CB C 127 19.000 19.000 19.749 -0.749 25768 5145 1 6 . 1 1 127 127 ALA H H 127 8.100 8.100 7.610 0.490 25768 5146 1 6 . 1 1 128 128 SER N N 128 113.740 113.740 112.246 1.494 25768 5147 1 6 . 1 1 128 128 SER C C 128 175.010 175.010 173.471 1.539 25768 5148 1 6 . 1 1 128 128 SER CA C 128 59.580 59.580 58.402 1.178 25768 5149 1 6 . 1 1 128 128 SER CB C 128 63.800 63.800 63.276 0.524 25768 5150 1 6 . 1 1 128 128 SER H H 128 7.920 7.920 7.796 0.124 25768 5151 1 6 . 1 1 129 129 ASN N N 129 120.300 120.300 121.698 -1.398 25768 5152 1 6 . 1 1 129 129 ASN C C 129 175.590 175.590 175.460 0.130 25768 5153 1 6 . 1 1 129 129 ASN CA C 129 54.180 54.180 53.189 0.991 25768 5154 1 6 . 1 1 129 129 ASN CB C 129 38.900 38.900 38.345 0.555 25768 5155 1 6 . 1 1 129 129 ASN H H 129 8.120 8.120 8.645 -0.525 25768 5156 1 6 . 1 1 130 130 ARG N N 130 120.630 120.630 120.556 0.074 25768 5157 1 6 . 1 1 130 130 ARG C C 130 176.720 176.720 176.022 0.698 25768 5158 1 6 . 1 1 130 130 ARG CA C 130 57.240 57.240 56.050 1.190 25768 5159 1 6 . 1 1 130 130 ARG CB C 130 30.500 30.500 31.401 -0.901 25768 5160 1 6 . 1 1 130 130 ARG H H 130 8.050 8.050 7.736 0.314 25768 5161 1 6 . 1 1 131 131 LYS N N 131 121.150 121.150 118.005 3.145 25768 5162 1 6 . 1 1 131 131 LYS C C 131 176.750 176.750 177.144 -0.394 25768 5163 1 6 . 1 1 131 131 LYS CA C 131 57.050 57.050 56.705 0.345 25768 5164 1 6 . 1 1 131 131 LYS CB C 131 32.870 32.870 33.220 -0.350 25768 5165 1 6 . 1 1 131 131 LYS H H 131 8.020 8.020 8.219 -0.199 25768 5166 1 6 . 1 1 132 132 ALA N N 132 124.110 124.110 123.379 0.731 25768 5167 1 6 . 1 1 132 132 ALA C C 132 177.680 177.680 178.923 -1.243 25768 5168 1 6 . 1 1 132 132 ALA CA C 132 53.070 53.070 53.945 -0.875 25768 5169 1 6 . 1 1 132 132 ALA CB C 132 19.250 19.250 18.450 0.800 25768 5170 1 6 . 1 1 132 132 ALA H H 132 8.010 8.010 8.060 -0.050 25768 5171 1 6 . 1 1 133 133 GLN N N 133 118.830 118.830 116.518 2.312 25768 5172 1 6 . 1 1 133 133 GLN C C 133 176.380 176.380 176.573 -0.193 25768 5173 1 6 . 1 1 133 133 GLN CA C 133 56.400 56.400 56.029 0.371 25768 5174 1 6 . 1 1 133 133 GLN CB C 133 29.670 29.670 29.728 -0.058 25768 5175 1 6 . 1 1 133 133 GLN H H 133 8.070 8.070 8.419 -0.349 25768 5176 1 6 . 1 1 134 134 GLY N N 134 109.400 109.400 108.300 1.100 25768 5177 1 6 . 1 1 134 134 GLY C C 134 174.060 174.060 173.323 0.737 25768 5178 1 6 . 1 1 134 134 GLY CA C 134 45.690 45.690 44.569 1.121 25768 5179 1 6 . 1 1 134 134 GLY H H 134 8.150 8.150 8.054 0.096 25768 5180 1 6 . 1 1 135 135 PHE N N 135 120.480 120.480 124.951 -4.471 25768 5181 1 6 . 1 1 135 135 PHE C C 135 176.000 176.000 176.271 -0.271 25768 5182 1 6 . 1 1 135 135 PHE CA C 135 58.370 58.370 59.771 -1.401 25768 5183 1 6 . 1 1 135 135 PHE CB C 135 39.710 39.710 40.083 -0.373 25768 5184 1 6 . 1 1 135 135 PHE H H 135 8.060 8.060 8.801 -0.741 25768 5185 1 6 . 1 1 136 136 SER N N 136 116.740 116.740 113.893 2.847 25768 5186 1 6 . 1 1 136 136 SER C C 136 174.620 174.620 172.871 1.749 25768 5187 1 6 . 1 1 136 136 SER CA C 136 58.870 58.870 57.721 1.149 25768 5188 1 6 . 1 1 136 136 SER CB C 136 64.200 64.200 64.314 -0.114 25768 5189 1 6 . 1 1 136 136 SER H H 136 8.160 8.160 8.001 0.159 25768 5190 1 6 . 1 1 137 137 SER N N 137 117.650 117.650 115.233 2.417 25768 5191 1 6 . 1 1 137 137 SER C C 137 174.410 174.410 173.231 1.179 25768 5192 1 6 . 1 1 137 137 SER CA C 137 58.880 58.880 58.082 0.798 25768 5193 1 6 . 1 1 137 137 SER CB C 137 64.140 64.140 64.794 -0.654 25768 5194 1 6 . 1 1 137 137 SER H H 137 8.140 8.140 8.288 -0.148 25768 5195 1 6 . 1 1 138 138 MET N N 138 121.980 121.980 125.048 -3.068 25768 5196 1 6 . 1 1 138 138 MET C C 138 175.680 175.680 175.436 0.244 25768 5197 1 6 . 1 1 138 138 MET CA C 138 56.180 56.180 56.226 -0.046 25768 5198 1 6 . 1 1 138 138 MET CB C 138 33.240 33.240 32.056 1.184 25768 5199 1 6 . 1 1 138 138 MET H H 138 8.110 8.110 8.675 -0.565 25768 5200 1 6 . 1 1 139 139 LYS N N 139 122.110 122.110 125.129 -3.019 25768 5201 1 6 . 1 1 139 139 LYS C C 139 176.220 176.220 175.465 0.755 25768 5202 1 6 . 1 1 139 139 LYS CA C 139 56.370 56.370 55.482 0.888 25768 5203 1 6 . 1 1 139 139 LYS CB C 139 33.220 33.220 34.634 -1.414 25768 5204 1 6 . 1 1 139 139 LYS H H 139 8.140 8.140 8.448 -0.308 25768 5205 1 6 . 1 1 140 140 LEU N N 140 123.860 123.860 123.444 0.416 25768 5206 1 6 . 1 1 140 140 LEU C C 140 177.100 177.100 175.580 1.520 25768 5207 1 6 . 1 1 140 140 LEU CA C 140 55.710 55.710 55.185 0.525 25768 5208 1 6 . 1 1 140 140 LEU CB C 140 42.460 42.460 43.393 -0.933 25768 5209 1 6 . 1 1 140 140 LEU H H 140 8.140 8.140 8.470 -0.330 25768 5210 1 6 . 1 1 141 141 GLN N N 141 120.350 120.350 124.082 -3.732 25768 5211 1 6 . 1 1 141 141 GLN C C 141 175.170 175.170 174.830 0.340 25768 5212 1 6 . 1 1 141 141 GLN CA C 141 56.200 56.200 55.707 0.493 25768 5213 1 6 . 1 1 141 141 GLN CB C 141 29.950 29.950 30.402 -0.452 25768 5214 1 6 . 1 1 141 141 GLN H H 141 8.210 8.210 8.473 -0.263 25768 5215 1 6 . 1 1 142 142 ASP N N 142 120.950 120.950 121.104 -0.154 25768 5216 1 6 . 1 1 142 142 ASP C C 142 175.840 175.840 174.886 0.954 25768 5217 1 6 . 1 1 142 142 ASP CA C 142 54.700 54.700 55.279 -0.578 25768 5218 1 6 . 1 1 142 142 ASP CB C 142 41.760 41.760 40.372 1.388 25768 5219 1 6 . 1 1 142 142 ASP H H 142 8.120 8.120 8.689 -0.569 25768 5220 1 6 . 1 1 143 143 SER N N 143 114.880 114.880 117.028 -2.148 25768 5221 1 6 . 1 1 143 143 SER C C 143 173.290 173.290 173.970 -0.680 25768 5222 1 6 . 1 1 143 143 SER CA C 143 58.450 58.450 57.412 1.038 25768 5223 1 6 . 1 1 143 143 SER CB C 143 64.760 64.760 63.408 1.352 25768 5224 1 6 . 1 1 143 143 SER H H 143 7.960 7.960 8.244 -0.284 25768 5225 1 6 . 1 1 144 144 TRP N N 144 123.110 123.110 125.990 -2.880 25768 5226 1 6 . 1 1 144 144 TRP C C 144 175.880 175.880 175.766 0.114 25768 5227 1 6 . 1 1 144 144 TRP CA C 144 56.420 56.420 56.097 0.323 25768 5228 1 6 . 1 1 144 144 TRP CB C 144 31.160 31.160 29.896 1.264 25768 5229 1 6 . 1 1 144 144 TRP H H 144 8.080 8.080 7.344 0.736 25768 5230 1 6 . 1 1 145 145 GLY N N 145 110.410 110.410 110.178 0.232 25768 5231 1 6 . 1 1 145 145 GLY C C 145 172.870 172.870 173.853 -0.983 25768 5232 1 6 . 1 1 145 145 GLY CA C 145 45.130 45.130 44.720 0.410 25768 5233 1 6 . 1 1 145 145 GLY H H 145 8.660 8.660 8.514 0.146 25768 5234 1 6 . 1 1 148 148 GLY C C 148 171.800 171.800 172.444 -0.644 25768 5235 1 6 . 1 1 148 148 GLY CA C 148 44.140 44.140 44.580 -0.440 25768 5236 1 6 . 1 1 149 149 GLU N N 149 123.070 123.070 122.599 0.471 25768 5237 1 6 . 1 1 149 149 GLU C C 149 174.210 174.210 174.646 -0.436 25768 5238 1 6 . 1 1 149 149 GLU CA C 149 55.120 55.120 54.138 0.982 25768 5239 1 6 . 1 1 149 149 GLU CB C 149 37.410 37.410 33.193 4.217 25768 5240 1 6 . 1 1 149 149 GLU H H 149 8.550 8.550 8.516 0.034 25768 5241 1 6 . 1 1 150 150 LEU N N 150 126.130 126.130 123.007 3.123 25768 5242 1 6 . 1 1 150 150 LEU C C 150 174.410 174.410 176.100 -1.690 25768 5243 1 6 . 1 1 150 150 LEU CA C 150 54.260 54.260 54.214 0.046 25768 5244 1 6 . 1 1 150 150 LEU CB C 150 47.510 47.510 44.304 3.206 25768 5245 1 6 . 1 1 150 150 LEU H H 150 8.550 8.550 8.105 0.445 25768 5246 1 6 . 1 1 151 151 GLY N N 151 109.500 109.500 109.323 0.177 25768 5247 1 6 . 1 1 151 151 GLY C C 151 170.610 170.610 171.957 -1.347 25768 5248 1 6 . 1 1 151 151 GLY CA C 151 45.980 45.980 42.888 3.092 25768 5249 1 6 . 1 1 151 151 GLY H H 151 8.090 8.090 8.796 -0.706 25768 5250 1 6 . 1 1 152 152 PHE N N 152 110.960 110.960 117.151 -6.191 25768 5251 1 6 . 1 1 152 152 PHE C C 152 171.510 171.510 174.293 -2.783 25768 5252 1 6 . 1 1 152 152 PHE CA C 152 58.170 58.170 56.246 1.924 25768 5253 1 6 . 1 1 152 152 PHE CB C 152 41.690 41.690 42.461 -0.771 25768 5254 1 6 . 1 1 152 152 PHE H H 152 8.380 8.380 8.083 0.297 25768 5255 1 6 . 1 1 153 153 ASP N N 153 118.880 118.880 123.618 -4.738 25768 5256 1 6 . 1 1 153 153 ASP C C 153 176.520 176.520 174.706 1.814 25768 5257 1 6 . 1 1 153 153 ASP CA C 153 52.940 52.940 52.579 0.361 25768 5258 1 6 . 1 1 153 153 ASP CB C 153 44.540 44.540 44.839 -0.299 25768 5259 1 6 . 1 1 153 153 ASP H H 153 7.970 7.970 8.458 -0.488 25768 5260 1 6 . 1 1 154 154 TYR N N 154 123.630 123.630 124.785 -1.155 25768 5261 1 6 . 1 1 154 154 TYR C C 154 175.610 175.610 174.003 1.607 25768 5262 1 6 . 1 1 154 154 TYR CA C 154 57.310 57.310 57.151 0.159 25768 5263 1 6 . 1 1 154 154 TYR CB C 154 42.040 42.040 42.518 -0.478 25768 5264 1 6 . 1 1 154 154 TYR H H 154 9.730 9.730 8.928 0.802 25768 5265 1 6 . 1 1 155 155 MET N N 155 126.190 126.190 126.273 -0.083 25768 5266 1 6 . 1 1 155 155 MET C C 155 174.970 174.970 174.592 0.378 25768 5267 1 6 . 1 1 155 155 MET CA C 155 54.720 54.720 55.088 -0.368 25768 5268 1 6 . 1 1 155 155 MET CB C 155 28.300 28.300 33.328 -5.028 25768 5269 1 6 . 1 1 155 155 MET H H 155 8.600 8.600 8.714 -0.114 25768 5270 1 6 . 1 1 156 156 LEU N N 156 125.290 125.290 124.876 0.414 25768 5271 1 6 . 1 1 156 156 LEU C C 156 177.680 177.680 177.602 0.078 25768 5272 1 6 . 1 1 156 156 LEU CA C 156 56.040 56.040 54.336 1.704 25768 5273 1 6 . 1 1 156 156 LEU CB C 156 43.040 43.040 43.445 -0.405 25768 5274 1 6 . 1 1 156 156 LEU H H 156 9.190 9.190 8.617 0.573 25768 5275 1 6 . 1 1 157 157 ASN N N 157 114.690 114.690 116.882 -2.192 25768 5276 1 6 . 1 1 157 157 ASN C C 157 173.640 173.640 177.310 -3.670 25768 5277 1 6 . 1 1 157 157 ASN CA C 157 52.650 52.650 56.238 -3.588 25768 5278 1 6 . 1 1 157 157 ASN CB C 157 37.270 37.270 36.870 0.400 25768 5279 1 6 . 1 1 157 157 ASN H H 157 8.060 8.060 8.339 -0.279 25768 5280 1 6 . 1 1 158 158 GLU N N 158 114.530 114.530 120.217 -5.687 25768 5281 1 6 . 1 1 158 158 GLU C C 158 176.090 176.090 176.863 -0.773 25768 5282 1 6 . 1 1 158 158 GLU CA C 158 60.010 60.010 57.657 2.353 25768 5283 1 6 . 1 1 158 158 GLU CB C 158 29.730 29.730 30.316 -0.586 25768 5284 1 6 . 1 1 158 158 GLU H H 158 8.560 8.560 8.289 0.271 25768 5285 1 6 . 1 1 159 159 HIS N N 159 110.480 110.480 118.850 -8.370 25768 5286 1 6 . 1 1 159 159 HIS C C 159 173.130 173.130 174.246 -1.116 25768 5287 1 6 . 1 1 159 159 HIS CA C 159 56.770 56.770 54.897 1.873 25768 5288 1 6 . 1 1 159 159 HIS CB C 159 32.630 32.630 29.915 2.715 25768 5289 1 6 . 1 1 159 159 HIS H H 159 8.190 8.190 7.556 0.634 25768 5290 1 6 . 1 1 160 160 ALA N N 160 122.890 122.890 119.930 2.960 25768 5291 1 6 . 1 1 160 160 ALA C C 160 176.200 176.200 174.993 1.207 25768 5292 1 6 . 1 1 160 160 ALA CA C 160 51.730 51.730 53.425 -1.695 25768 5293 1 6 . 1 1 160 160 ALA CB C 160 21.560 21.560 18.651 2.909 25768 5294 1 6 . 1 1 160 160 ALA H H 160 8.400 8.400 7.490 0.910 25768 5295 1 6 . 1 1 161 161 LEU N N 161 116.540 116.540 117.432 -0.892 25768 5296 1 6 . 1 1 161 161 LEU C C 161 174.930 174.930 176.167 -1.237 25768 5297 1 6 . 1 1 161 161 LEU CA C 161 54.280 54.280 53.960 0.320 25768 5298 1 6 . 1 1 161 161 LEU CB C 161 45.640 45.640 45.531 0.109 25768 5299 1 6 . 1 1 161 161 LEU H H 161 8.590 8.590 8.309 0.281 25768 5300 1 6 . 1 1 162 162 PHE N N 162 121.780 121.780 122.663 -0.883 25768 5301 1 6 . 1 1 162 162 PHE C C 162 171.960 171.960 174.146 -2.186 25768 5302 1 6 . 1 1 162 162 PHE CA C 162 56.420 56.420 56.609 -0.190 25768 5303 1 6 . 1 1 162 162 PHE CB C 162 43.340 43.340 42.543 0.797 25768 5304 1 6 . 1 1 162 162 PHE H H 162 9.180 9.180 9.344 -0.164 25768 5305 1 6 . 1 1 163 163 ASN N N 163 127.850 127.850 124.842 3.008 25768 5306 1 6 . 1 1 163 163 ASN C C 163 171.320 171.320 173.499 -2.179 25768 5307 1 6 . 1 1 163 163 ASN CA C 163 52.340 52.340 52.772 -0.432 25768 5308 1 6 . 1 1 163 163 ASN CB C 163 46.410 46.410 42.308 4.102 25768 5309 1 6 . 1 1 163 163 ASN H H 163 7.700 7.700 7.827 -0.127 25768 5310 1 6 . 1 1 164 164 MET N N 164 119.950 119.950 122.536 -2.586 25768 5311 1 6 . 1 1 164 164 MET C C 164 172.830 172.830 174.435 -1.605 25768 5312 1 6 . 1 1 164 164 MET CA C 164 55.180 55.180 54.042 1.138 25768 5313 1 6 . 1 1 164 164 MET CB C 164 37.770 37.770 37.736 0.034 25768 5314 1 6 . 1 1 164 164 MET H H 164 7.070 7.070 9.004 -1.934 25768 5315 1 6 . 1 1 165 165 ALA N N 165 120.600 120.600 122.789 -2.189 25768 5316 1 6 . 1 1 165 165 ALA C C 165 174.240 174.240 175.151 -0.911 25768 5317 1 6 . 1 1 165 165 ALA CA C 165 51.630 51.630 51.520 0.110 25768 5318 1 6 . 1 1 165 165 ALA CB C 165 22.330 22.330 22.384 -0.054 25768 5319 1 6 . 1 1 165 165 ALA H H 165 8.290 8.290 8.396 -0.106 25768 5320 1 6 . 1 1 166 166 VAL N N 166 117.900 117.900 114.385 3.515 25768 5321 1 6 . 1 1 166 166 VAL C C 166 172.950 172.950 173.850 -0.900 25768 5322 1 6 . 1 1 166 166 VAL CA C 166 59.710 59.710 60.522 -0.812 25768 5323 1 6 . 1 1 166 166 VAL CB C 166 35.290 35.290 35.774 -0.484 25768 5324 1 6 . 1 1 166 166 VAL H H 166 8.720 8.720 8.348 0.372 25768 5325 1 6 . 1 1 171 171 ILE C C 171 175.750 175.750 174.851 0.899 25768 5326 1 6 . 1 1 171 171 ILE CA C 171 61.720 61.720 61.529 0.192 25768 5327 1 6 . 1 1 171 171 ILE CB C 171 39.300 39.300 39.633 -0.333 25768 5328 1 6 . 1 1 172 172 ASP N N 172 124.070 124.070 125.578 -1.508 25768 5329 1 6 . 1 1 172 172 ASP C C 172 176.590 176.590 177.020 -0.430 25768 5330 1 6 . 1 1 172 172 ASP CA C 172 54.460 54.460 53.875 0.585 25768 5331 1 6 . 1 1 172 172 ASP CB C 172 41.410 41.410 41.515 -0.105 25768 5332 1 6 . 1 1 172 172 ASP H H 172 8.460 8.460 8.511 -0.051 25768 5333 1 6 . 1 1 173 173 THR N N 173 115.570 115.570 115.991 -0.421 25768 5334 1 6 . 1 1 173 173 THR C C 173 175.030 175.030 175.620 -0.590 25768 5335 1 6 . 1 1 173 173 THR CA C 173 62.680 62.680 63.301 -0.621 25768 5336 1 6 . 1 1 173 173 THR CB C 173 69.840 69.840 70.141 -0.301 25768 5337 1 6 . 1 1 173 173 THR H H 173 8.080 8.080 8.494 -0.414 25768 5338 1 6 . 1 1 174 174 LYS N N 174 122.680 122.680 121.970 0.710 25768 5339 1 6 . 1 1 174 174 LYS C C 174 176.340 176.340 176.403 -0.063 25768 5340 1 6 . 1 1 174 174 LYS CA C 174 56.820 56.820 56.522 0.298 25768 5341 1 6 . 1 1 174 174 LYS CB C 174 32.790 32.790 33.025 -0.235 25768 5342 1 6 . 1 1 174 174 LYS H H 174 8.180 8.180 8.387 -0.207 25768 5343 1 6 . 1 1 175 175 ALA N N 175 124.050 124.050 122.336 1.714 25768 5344 1 6 . 1 1 175 175 ALA C C 175 177.550 177.550 176.428 1.122 25768 5345 1 6 . 1 1 175 175 ALA CA C 175 52.840 52.840 52.205 0.635 25768 5346 1 6 . 1 1 175 175 ALA CB C 175 19.580 19.580 17.525 2.055 25768 5347 1 6 . 1 1 175 175 ALA H H 175 8.050 8.050 8.429 -0.379 25768 5348 1 6 . 1 1 176 176 SER N N 176 114.920 114.920 114.754 0.166 25768 5349 1 6 . 1 1 176 176 SER C C 176 174.240 174.240 174.263 -0.023 25768 5350 1 6 . 1 1 176 176 SER CA C 176 58.390 58.390 58.672 -0.283 25768 5351 1 6 . 1 1 176 176 SER CB C 176 64.370 64.370 62.362 2.008 25768 5352 1 6 . 1 1 176 176 SER H H 176 8.070 8.070 8.181 -0.111 25768 5353 1 6 . 1 1 177 177 ILE N N 177 121.650 121.650 122.946 -1.296 25768 5354 1 6 . 1 1 177 177 ILE C C 177 174.990 174.990 174.957 0.033 25768 5355 1 6 . 1 1 177 177 ILE CA C 177 61.570 61.570 60.693 0.877 25768 5356 1 6 . 1 1 177 177 ILE CB C 177 39.100 39.100 39.208 -0.108 25768 5357 1 6 . 1 1 177 177 ILE H H 177 7.960 7.960 7.680 0.280 25768 5358 1 6 . 1 1 178 178 ASN N N 178 127.040 127.040 125.098 1.942 25768 5359 1 6 . 1 1 178 178 ASN C C 178 179.160 179.160 175.655 3.505 25768 5360 1 6 . 1 1 178 178 ASN CA C 178 55.100 55.100 53.785 1.315 25768 5361 1 6 . 1 1 178 178 ASN CB C 178 41.300 41.300 39.214 2.086 25768 5362 1 6 . 1 1 178 178 ASN H H 178 7.850 7.850 8.749 -0.899 25768 5363 1 6 . 1 1 180 180 PRO C C 180 177.520 177.520 175.958 1.562 25768 5364 1 6 . 1 1 180 180 PRO CA C 180 63.980 63.980 62.942 1.038 25768 5365 1 6 . 1 1 180 180 PRO CB C 180 32.190 32.190 31.218 0.972 25768 5366 1 6 . 1 1 181 181 SER N N 181 115.600 115.600 117.889 -2.289 25768 5367 1 6 . 1 1 181 181 SER C C 181 174.710 174.710 173.753 0.957 25768 5368 1 6 . 1 1 181 181 SER CA C 181 58.900 58.900 58.327 0.573 25768 5369 1 6 . 1 1 181 181 SER CB C 181 64.070 64.070 64.057 0.013 25768 5370 1 6 . 1 1 181 181 SER H H 181 8.260 8.260 8.322 -0.062 25768 5371 1 6 . 1 1 182 182 ALA N N 182 125.880 125.880 124.943 0.937 25768 5372 1 6 . 1 1 182 182 ALA C C 182 177.560 177.560 175.933 1.627 25768 5373 1 6 . 1 1 182 182 ALA CA C 182 53.090 53.090 51.884 1.206 25768 5374 1 6 . 1 1 182 182 ALA CB C 182 19.310 19.310 20.504 -1.194 25768 5375 1 6 . 1 1 182 182 ALA H H 182 8.130 8.130 7.942 0.188 25768 5376 1 6 . 1 1 183 183 LEU N N 183 119.980 119.980 123.388 -3.408 25768 5377 1 6 . 1 1 183 183 LEU C C 183 177.850 177.850 176.982 0.868 25768 5378 1 6 . 1 1 183 183 LEU CA C 183 55.650 55.650 54.965 0.685 25768 5379 1 6 . 1 1 183 183 LEU CB C 183 42.530 42.530 41.320 1.210 25768 5380 1 6 . 1 1 183 183 LEU H H 183 7.940 7.940 8.458 -0.518 25768 5381 1 6 . 1 1 184 184 GLY N N 184 109.250 109.250 113.717 -4.467 25768 5382 1 6 . 1 1 184 184 GLY C C 184 174.250 174.250 173.512 0.738 25768 5383 1 6 . 1 1 184 184 GLY CA C 184 45.830 45.830 44.239 1.591 25768 5384 1 6 . 1 1 184 184 GLY H H 184 8.150 8.150 8.507 -0.357 25768 5385 1 6 . 1 1 185 185 VAL N N 185 118.830 118.830 117.993 0.837 25768 5386 1 6 . 1 1 185 185 VAL C C 185 175.890 175.890 174.545 1.345 25768 5387 1 6 . 1 1 185 185 VAL CA C 185 62.740 62.740 62.784 -0.044 25768 5388 1 6 . 1 1 185 185 VAL CB C 185 32.770 32.770 30.145 2.625 25768 5389 1 6 . 1 1 185 185 VAL H H 185 7.760 7.760 8.335 -0.575 25768 5390 1 6 . 1 1 186 186 ASN N N 186 121.850 121.850 124.618 -2.768 25768 5391 1 6 . 1 1 186 186 ASN C C 186 174.970 174.970 174.419 0.551 25768 5392 1 6 . 1 1 186 186 ASN CA C 186 53.590 53.590 53.110 0.480 25768 5393 1 6 . 1 1 186 186 ASN CB C 186 39.160 39.160 40.259 -1.099 25768 5394 1 6 . 1 1 186 186 ASN H H 186 8.380 8.380 8.688 -0.308 25768 5395 1 6 . 1 1 187 187 LYS N N 187 122.120 122.120 121.189 0.931 25768 5396 1 6 . 1 1 187 187 LYS C C 187 176.490 176.490 175.282 1.208 25768 5397 1 6 . 1 1 187 187 LYS CA C 187 56.750 56.750 55.951 0.799 25768 5398 1 6 . 1 1 187 187 LYS CB C 187 33.250 33.250 33.916 -0.666 25768 5399 1 6 . 1 1 187 187 LYS H H 187 8.140 8.140 8.022 0.118 25768 5400 1 6 . 1 1 188 188 THR N N 188 115.250 115.250 116.472 -1.222 25768 5401 1 6 . 1 1 188 188 THR C C 188 174.250 174.250 173.656 0.594 25768 5402 1 6 . 1 1 188 188 THR CA C 188 62.360 62.360 62.277 0.083 25768 5403 1 6 . 1 1 188 188 THR CB C 188 70.280 70.280 70.206 0.074 25768 5404 1 6 . 1 1 188 188 THR H H 188 8.100 8.100 8.313 -0.213 25768 5405 1 6 . 1 1 189 189 LYS N N 189 123.780 123.780 125.375 -1.595 25768 5406 1 6 . 1 1 189 189 LYS C C 189 176.090 176.090 174.962 1.128 25768 5407 1 6 . 1 1 189 189 LYS CA C 189 56.590 56.590 55.793 0.797 25768 5408 1 6 . 1 1 189 189 LYS CB C 189 33.350 33.350 33.754 -0.404 25768 5409 1 6 . 1 1 189 189 LYS H H 189 8.110 8.110 8.186 -0.076 25768 5410 1 6 . 1 1 190 190 VAL N N 190 120.920 120.920 119.219 1.701 25768 5411 1 6 . 1 1 190 190 VAL C C 190 175.590 175.590 174.203 1.387 25768 5412 1 6 . 1 1 190 190 VAL CA C 190 62.400 62.400 61.267 1.133 25768 5413 1 6 . 1 1 190 190 VAL CB C 190 32.990 32.990 34.352 -1.362 25768 5414 1 6 . 1 1 190 190 VAL H H 190 8.040 8.040 8.172 -0.132 25768 5415 1 6 . 1 1 191 191 ASP N N 191 123.790 123.790 120.252 3.538 25768 5416 1 6 . 1 1 191 191 ASP C C 191 175.750 175.750 177.020 -1.270 25768 5417 1 6 . 1 1 191 191 ASP CA C 191 54.650 54.650 54.803 -0.153 25768 5418 1 6 . 1 1 191 191 ASP CB C 191 41.450 41.450 41.361 0.089 25768 5419 1 6 . 1 1 191 191 ASP H H 191 8.240 8.240 8.362 -0.122 25768 5420 1 6 . 1 1 192 192 VAL N N 192 118.850 118.850 116.853 1.997 25768 5421 1 6 . 1 1 192 192 VAL C C 192 175.380 175.380 175.348 0.032 25768 5422 1 6 . 1 1 192 192 VAL CA C 192 62.110 62.110 63.513 -1.403 25768 5423 1 6 . 1 1 192 192 VAL CB C 192 33.290 33.290 31.701 1.589 25768 5424 1 6 . 1 1 192 192 VAL H H 192 7.860 7.860 7.628 0.232 25768 5425 1 6 . 1 1 193 193 ASP N N 193 124.190 124.190 117.905 6.285 25768 5426 1 6 . 1 1 193 193 ASP C C 193 175.630 175.630 176.119 -0.489 25768 5427 1 6 . 1 1 193 193 ASP CA C 193 54.540 54.540 54.648 -0.108 25768 5428 1 6 . 1 1 193 193 ASP CB C 193 41.410 41.410 40.497 0.913 25768 5429 1 6 . 1 1 193 193 ASP H H 193 8.310 8.310 8.155 0.155 25768 5430 1 6 . 1 1 194 194 VAL N N 194 119.580 119.580 117.344 2.236 25768 5431 1 6 . 1 1 194 194 VAL C C 194 174.950 174.950 176.142 -1.192 25768 5432 1 6 . 1 1 194 194 VAL CA C 194 61.770 61.770 63.303 -1.533 25768 5433 1 6 . 1 1 194 194 VAL CB C 194 33.680 33.680 31.899 1.781 25768 5434 1 6 . 1 1 194 194 VAL H H 194 7.890 7.890 8.088 -0.198 25768 5435 1 6 . 1 1 195 195 ASP N N 195 125.660 125.660 122.465 3.195 25768 5436 1 6 . 1 1 195 195 ASP C C 195 174.290 174.290 175.985 -1.695 25768 5437 1 6 . 1 1 195 195 ASP CA C 195 51.940 51.940 53.018 -1.078 25768 5438 1 6 . 1 1 195 195 ASP CB C 195 40.950 40.950 41.807 -0.857 25768 5439 1 6 . 1 1 195 195 ASP H H 195 8.410 8.410 8.225 0.185 25768 5440 1 6 . 1 1 198 198 VAL C C 198 173.940 173.940 174.556 -0.616 25768 5441 1 6 . 1 1 198 198 VAL CA C 198 61.270 61.270 60.876 0.394 25768 5442 1 6 . 1 1 198 198 VAL CB C 198 35.910 35.910 32.307 3.603 25768 5443 1 6 . 1 1 199 199 TYR N N 199 123.780 123.780 124.534 -0.754 25768 5444 1 6 . 1 1 199 199 TYR C C 199 174.150 174.150 174.823 -0.673 25768 5445 1 6 . 1 1 199 199 TYR CA C 199 56.220 56.220 56.277 -0.057 25768 5446 1 6 . 1 1 199 199 TYR CB C 199 41.660 41.660 42.815 -1.155 25768 5447 1 6 . 1 1 199 199 TYR H H 199 8.540 8.540 7.870 0.670 25768 5448 1 6 . 1 1 200 200 MET N N 200 123.920 123.920 120.044 3.876 25768 5449 1 6 . 1 1 200 200 MET C C 200 173.810 173.810 174.145 -0.335 25768 5450 1 6 . 1 1 200 200 MET CA C 200 54.710 54.710 55.297 -0.587 25768 5451 1 6 . 1 1 200 200 MET CB C 200 37.110 37.110 36.109 1.001 25768 5452 1 6 . 1 1 200 200 MET H H 200 9.130 9.130 8.344 0.786 25768 5453 1 6 . 1 1 201 201 ILE N N 201 123.670 123.670 121.574 2.096 25768 5454 1 6 . 1 1 201 201 ILE C C 201 174.030 174.030 174.668 -0.638 25768 5455 1 6 . 1 1 201 201 ILE CA C 201 59.820 59.820 60.175 -0.355 25768 5456 1 6 . 1 1 201 201 ILE CB C 201 41.720 41.720 40.919 0.801 25768 5457 1 6 . 1 1 201 201 ILE H H 201 8.030 8.030 8.197 -0.167 25768 5458 1 6 . 1 1 202 202 GLY N N 202 112.910 112.910 112.794 0.116 25768 5459 1 6 . 1 1 202 202 GLY C C 202 170.280 170.280 171.804 -1.524 25768 5460 1 6 . 1 1 202 202 GLY CA C 202 46.800 46.800 45.386 1.414 25768 5461 1 6 . 1 1 202 202 GLY H H 202 8.580 8.580 7.875 0.705 25768 5462 1 6 . 1 1 203 203 PHE N N 203 116.240 116.240 117.125 -0.885 25768 5463 1 6 . 1 1 203 203 PHE C C 203 173.940 173.940 174.678 -0.738 25768 5464 1 6 . 1 1 203 203 PHE CA C 203 55.890 55.890 55.493 0.397 25768 5465 1 6 . 1 1 203 203 PHE CB C 203 45.060 45.060 43.667 1.393 25768 5466 1 6 . 1 1 203 203 PHE H H 203 8.620 8.620 9.083 -0.463 25768 5467 1 6 . 1 1 204 204 GLY N N 204 105.610 105.610 105.527 0.083 25768 5468 1 6 . 1 1 204 204 GLY C C 204 171.190 171.190 171.717 -0.527 25768 5469 1 6 . 1 1 204 204 GLY CA C 204 46.720 46.720 44.594 2.126 25768 5470 1 6 . 1 1 204 204 GLY H H 204 8.960 8.960 8.922 0.038 25768 5471 1 6 . 1 1 205 205 TYR N N 205 121.160 121.160 120.088 1.072 25768 5472 1 6 . 1 1 205 205 TYR C C 205 173.030 173.030 174.381 -1.351 25768 5473 1 6 . 1 1 205 205 TYR CA C 205 57.190 57.190 57.111 0.079 25768 5474 1 6 . 1 1 205 205 TYR CB C 205 44.400 44.400 43.205 1.195 25768 5475 1 6 . 1 1 205 205 TYR H H 205 9.380 9.380 9.168 0.212 25768 5476 1 6 . 1 1 206 206 LYS N N 206 126.970 126.970 123.986 2.984 25768 5477 1 6 . 1 1 206 206 LYS C C 206 174.210 174.210 175.970 -1.760 25768 5478 1 6 . 1 1 206 206 LYS CA C 206 54.770 54.770 54.872 -0.102 25768 5479 1 6 . 1 1 206 206 LYS CB C 206 34.440 34.440 34.291 0.149 25768 5480 1 6 . 1 1 206 206 LYS H H 206 8.380 8.380 8.058 0.322 25768 5481 1 6 . 1 1 207 207 PHE N N 207 126.330 126.330 125.284 1.046 25768 5482 1 6 . 1 1 207 207 PHE C C 207 175.020 175.020 176.024 -1.004 25768 5483 1 6 . 1 1 207 207 PHE CA C 207 58.170 58.170 59.354 -1.184 25768 5484 1 6 . 1 1 207 207 PHE CB C 207 40.920 40.920 39.595 1.325 25768 5485 1 6 . 1 1 207 207 PHE H H 207 9.290 9.290 8.601 0.689 25768 5486 1 6 . 1 1 208 208 LEU N N 208 122.740 122.740 125.772 -3.032 25768 5487 1 6 . 1 1 208 208 LEU C C 208 176.510 176.510 176.264 0.246 25768 5488 1 6 . 1 1 208 208 LEU CA C 208 54.910 54.910 54.626 0.284 25768 5489 1 6 . 1 1 208 208 LEU CB C 208 43.830 43.830 42.771 1.059 25768 5490 1 6 . 1 1 208 208 LEU H H 208 8.310 8.310 8.372 -0.062 25768 5491 1 7 . 1 1 2 2 HIS C C 2 175.310 175.310 174.719 0.591 25768 5492 1 7 . 1 1 3 3 LYS N N 3 122.080 122.080 124.699 -2.619 25768 5493 1 7 . 1 1 3 3 LYS C C 3 173.490 173.490 175.045 -1.555 25768 5494 1 7 . 1 1 3 3 LYS CA C 3 55.050 55.050 54.904 0.146 25768 5495 1 7 . 1 1 3 3 LYS CB C 3 35.380 35.380 35.175 0.205 25768 5496 1 7 . 1 1 3 3 LYS H H 3 8.620 8.620 8.012 0.608 25768 5497 1 7 . 1 1 4 4 ALA N N 4 120.860 120.860 126.136 -5.276 25768 5498 1 7 . 1 1 4 4 ALA C C 4 178.190 178.190 177.772 0.418 25768 5499 1 7 . 1 1 4 4 ALA CA C 4 53.480 53.480 52.853 0.627 25768 5500 1 7 . 1 1 4 4 ALA CB C 4 18.140 18.140 17.970 0.170 25768 5501 1 7 . 1 1 4 4 ALA H H 4 8.580 8.580 8.424 0.156 25768 5502 1 7 . 1 1 5 5 GLY N N 5 112.890 112.890 113.160 -0.270 25768 5503 1 7 . 1 1 5 5 GLY C C 5 173.830 173.830 173.741 0.089 25768 5504 1 7 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.510 0.370 25768 5505 1 7 . 1 1 5 5 GLY H H 5 9.210 9.210 8.804 0.406 25768 5506 1 7 . 1 1 6 6 ASP N N 6 121.590 121.590 120.757 0.833 25768 5507 1 7 . 1 1 6 6 ASP C C 6 174.380 174.380 175.031 -0.651 25768 5508 1 7 . 1 1 6 6 ASP CA C 6 55.790 55.790 54.910 0.880 25768 5509 1 7 . 1 1 6 6 ASP CB C 6 41.760 41.760 42.159 -0.399 25768 5510 1 7 . 1 1 6 6 ASP H H 6 7.620 7.620 7.468 0.152 25768 5511 1 7 . 1 1 7 7 PHE N N 7 120.860 120.860 122.076 -1.216 25768 5512 1 7 . 1 1 7 7 PHE C C 7 174.050 174.050 174.530 -0.480 25768 5513 1 7 . 1 1 7 7 PHE CA C 7 56.110 56.110 58.167 -2.057 25768 5514 1 7 . 1 1 7 7 PHE CB C 7 42.550 42.550 42.086 0.465 25768 5515 1 7 . 1 1 7 7 PHE H H 7 8.250 8.250 8.842 -0.592 25768 5516 1 7 . 1 1 8 8 ILE N N 8 127.950 127.950 124.197 3.753 25768 5517 1 7 . 1 1 8 8 ILE C C 8 174.000 174.000 174.533 -0.533 25768 5518 1 7 . 1 1 8 8 ILE CA C 8 61.160 61.160 60.161 0.999 25768 5519 1 7 . 1 1 8 8 ILE CB C 8 42.660 42.660 42.166 0.494 25768 5520 1 7 . 1 1 8 8 ILE H H 8 9.230 9.230 8.283 0.947 25768 5521 1 7 . 1 1 9 9 ILE N N 9 125.380 125.380 119.550 5.830 25768 5522 1 7 . 1 1 9 9 ILE C C 9 173.630 173.630 174.211 -0.581 25768 5523 1 7 . 1 1 9 9 ILE CA C 9 59.600 59.600 59.322 0.278 25768 5524 1 7 . 1 1 9 9 ILE CB C 9 41.180 41.180 41.548 -0.368 25768 5525 1 7 . 1 1 9 9 ILE H H 9 8.580 8.580 9.226 -0.646 25768 5526 1 7 . 1 1 10 10 ARG N N 10 124.950 124.950 123.556 1.394 25768 5527 1 7 . 1 1 10 10 ARG C C 10 175.030 175.030 174.289 0.741 25768 5528 1 7 . 1 1 10 10 ARG CA C 10 53.920 53.920 55.235 -1.315 25768 5529 1 7 . 1 1 10 10 ARG CB C 10 31.880 31.880 35.310 -3.430 25768 5530 1 7 . 1 1 10 10 ARG H H 10 9.230 9.230 8.217 1.013 25768 5531 1 7 . 1 1 11 11 GLY N N 11 105.650 105.650 107.597 -1.947 25768 5532 1 7 . 1 1 11 11 GLY C C 11 172.090 172.090 171.526 0.564 25768 5533 1 7 . 1 1 11 11 GLY CA C 11 44.460 44.460 45.419 -0.959 25768 5534 1 7 . 1 1 11 11 GLY H H 11 8.780 8.780 8.404 0.376 25768 5535 1 7 . 1 1 12 12 GLY N N 12 107.800 107.800 108.056 -0.256 25768 5536 1 7 . 1 1 12 12 GLY C C 12 171.460 171.460 171.642 -0.182 25768 5537 1 7 . 1 1 12 12 GLY CA C 12 46.630 46.630 44.041 2.589 25768 5538 1 7 . 1 1 12 12 GLY H H 12 8.510 8.510 8.676 -0.166 25768 5539 1 7 . 1 1 13 13 PHE N N 13 119.900 119.900 117.844 2.056 25768 5540 1 7 . 1 1 13 13 PHE C C 13 174.190 174.190 174.113 0.077 25768 5541 1 7 . 1 1 13 13 PHE CA C 13 56.340 56.340 55.995 0.345 25768 5542 1 7 . 1 1 13 13 PHE CB C 13 41.090 41.090 44.205 -3.115 25768 5543 1 7 . 1 1 13 13 PHE H H 13 8.610 8.610 8.855 -0.245 25768 5544 1 7 . 1 1 14 14 ALA N N 14 128.030 128.030 123.000 5.030 25768 5545 1 7 . 1 1 14 14 ALA C C 14 176.560 176.560 177.115 -0.555 25768 5546 1 7 . 1 1 14 14 ALA CA C 14 49.940 49.940 50.998 -1.058 25768 5547 1 7 . 1 1 14 14 ALA CB C 14 20.360 20.360 20.283 0.077 25768 5548 1 7 . 1 1 14 14 ALA H H 14 9.220 9.220 8.528 0.692 25768 5549 1 7 . 1 1 15 15 THR N N 15 118.620 118.620 118.934 -0.314 25768 5550 1 7 . 1 1 15 15 THR CA C 15 61.440 61.440 62.044 -0.604 25768 5551 1 7 . 1 1 15 15 THR CB C 15 71.370 71.370 69.440 1.930 25768 5552 1 7 . 1 1 15 15 THR H H 15 9.220 9.220 8.170 1.050 25768 5553 1 7 . 1 1 18 18 PRO C C 18 176.690 176.690 175.886 0.804 25768 5554 1 7 . 1 1 18 18 PRO CA C 18 63.610 63.610 63.027 0.583 25768 5555 1 7 . 1 1 18 18 PRO CB C 18 32.440 32.440 33.247 -0.807 25768 5556 1 7 . 1 1 19 19 ASP N N 19 120.320 120.320 118.107 2.213 25768 5557 1 7 . 1 1 19 19 ASP C C 19 175.950 175.950 177.592 -1.642 25768 5558 1 7 . 1 1 19 19 ASP CA C 19 54.710 54.710 55.299 -0.589 25768 5559 1 7 . 1 1 19 19 ASP CB C 19 41.450 41.450 41.667 -0.217 25768 5560 1 7 . 1 1 19 19 ASP H H 19 8.330 8.330 8.688 -0.358 25768 5561 1 7 . 1 1 20 20 ASP N N 20 121.990 121.990 121.257 0.733 25768 5562 1 7 . 1 1 20 20 ASP C C 20 176.760 176.760 177.612 -0.852 25768 5563 1 7 . 1 1 20 20 ASP CA C 20 54.470 54.470 56.161 -1.691 25768 5564 1 7 . 1 1 20 20 ASP CB C 20 41.310 41.310 40.940 0.370 25768 5565 1 7 . 1 1 20 20 ASP H H 20 8.240 8.240 8.477 -0.237 25768 5566 1 7 . 1 1 21 21 SER N N 21 117.050 117.050 113.957 3.093 25768 5567 1 7 . 1 1 21 21 SER C C 21 175.170 175.170 174.416 0.754 25768 5568 1 7 . 1 1 21 21 SER CA C 21 59.490 59.490 59.647 -0.157 25768 5569 1 7 . 1 1 21 21 SER CB C 21 64.080 64.080 63.417 0.663 25768 5570 1 7 . 1 1 21 21 SER H H 21 8.360 8.360 8.494 -0.134 25768 5571 1 7 . 1 1 22 22 SER N N 22 117.820 117.820 115.029 2.791 25768 5572 1 7 . 1 1 22 22 SER C C 22 174.940 174.940 173.045 1.895 25768 5573 1 7 . 1 1 22 22 SER CA C 22 59.160 59.160 57.518 1.642 25768 5574 1 7 . 1 1 22 22 SER CB C 22 64.110 64.110 65.872 -1.762 25768 5575 1 7 . 1 1 22 22 SER H H 22 8.310 8.310 7.668 0.642 25768 5576 1 7 . 1 1 23 23 SER N N 23 117.660 117.660 113.538 4.122 25768 5577 1 7 . 1 1 23 23 SER C C 23 174.340 174.340 172.493 1.847 25768 5578 1 7 . 1 1 23 23 SER CA C 23 59.050 59.050 57.613 1.437 25768 5579 1 7 . 1 1 23 23 SER CB C 23 64.210 64.210 64.972 -0.762 25768 5580 1 7 . 1 1 23 23 SER H H 23 8.120 8.120 8.168 -0.048 25768 5581 1 7 . 1 1 24 24 ASP N N 24 122.590 122.590 118.962 3.628 25768 5582 1 7 . 1 1 24 24 ASP C C 24 176.250 176.250 175.174 1.076 25768 5583 1 7 . 1 1 24 24 ASP CA C 24 54.910 54.910 53.611 1.299 25768 5584 1 7 . 1 1 24 24 ASP CB C 24 41.270 41.270 41.754 -0.484 25768 5585 1 7 . 1 1 24 24 ASP H H 24 8.230 8.230 8.226 0.004 25768 5586 1 7 . 1 1 25 25 ILE N N 25 120.650 120.650 116.069 4.581 25768 5587 1 7 . 1 1 25 25 ILE C C 25 176.190 176.190 175.845 0.345 25768 5588 1 7 . 1 1 25 25 ILE CA C 25 61.880 61.880 61.557 0.323 25768 5589 1 7 . 1 1 25 25 ILE CB C 25 38.730 38.730 39.070 -0.340 25768 5590 1 7 . 1 1 25 25 ILE H H 25 7.860 7.860 8.059 -0.199 25768 5591 1 7 . 1 1 26 26 LYS N N 26 124.420 124.420 121.565 2.855 25768 5592 1 7 . 1 1 26 26 LYS C C 26 176.640 176.640 174.931 1.709 25768 5593 1 7 . 1 1 26 26 LYS CA C 26 56.520 56.520 56.179 0.341 25768 5594 1 7 . 1 1 26 26 LYS CB C 26 32.890 32.890 33.391 -0.501 25768 5595 1 7 . 1 1 26 26 LYS H H 26 8.140 8.140 7.804 0.336 25768 5596 1 7 . 1 1 27 27 LEU N N 27 123.120 123.120 124.985 -1.865 25768 5597 1 7 . 1 1 27 27 LEU C C 27 177.110 177.110 175.897 1.213 25768 5598 1 7 . 1 1 27 27 LEU CA C 27 55.590 55.590 54.863 0.727 25768 5599 1 7 . 1 1 27 27 LEU CB C 27 42.500 42.500 42.744 -0.244 25768 5600 1 7 . 1 1 27 27 LEU H H 27 8.080 8.080 8.428 -0.348 25768 5601 1 7 . 1 1 28 28 ASP N N 28 120.850 120.850 126.499 -5.649 25768 5602 1 7 . 1 1 28 28 ASP C C 28 176.960 176.960 175.531 1.429 25768 5603 1 7 . 1 1 28 28 ASP CA C 28 54.800 54.800 54.706 0.094 25768 5604 1 7 . 1 1 28 28 ASP CB C 28 41.380 41.380 41.732 -0.352 25768 5605 1 7 . 1 1 28 28 ASP H H 28 8.180 8.180 8.737 -0.557 25768 5606 1 7 . 1 1 29 29 GLY N N 29 109.800 109.800 108.975 0.825 25768 5607 1 7 . 1 1 29 29 GLY C C 29 174.370 174.370 173.842 0.528 25768 5608 1 7 . 1 1 29 29 GLY CA C 29 46.150 46.150 45.531 0.619 25768 5609 1 7 . 1 1 29 29 GLY H H 29 8.230 8.230 8.254 -0.024 25768 5610 1 7 . 1 1 30 30 ALA N N 30 123.880 123.880 121.607 2.273 25768 5611 1 7 . 1 1 30 30 ALA C C 30 178.040 178.040 177.622 0.418 25768 5612 1 7 . 1 1 30 30 ALA CA C 30 53.140 53.140 53.790 -0.650 25768 5613 1 7 . 1 1 30 30 ALA CB C 30 19.350 19.350 19.568 -0.218 25768 5614 1 7 . 1 1 30 30 ALA H H 30 8.040 8.040 8.585 -0.545 25768 5615 1 7 . 1 1 31 31 LYS N N 31 119.800 119.800 119.200 0.600 25768 5616 1 7 . 1 1 31 31 LYS C C 31 176.770 176.770 175.137 1.633 25768 5617 1 7 . 1 1 31 31 LYS CA C 31 56.870 56.870 55.691 1.179 25768 5618 1 7 . 1 1 31 31 LYS CB C 31 32.980 32.980 33.597 -0.617 25768 5619 1 7 . 1 1 31 31 LYS H H 31 8.060 8.060 8.042 0.018 25768 5620 1 7 . 1 1 32 32 GLN N N 32 120.930 120.930 119.377 1.553 25768 5621 1 7 . 1 1 32 32 GLN C C 32 176.000 176.000 175.016 0.984 25768 5622 1 7 . 1 1 32 32 GLN CA C 32 56.280 56.280 55.534 0.746 25768 5623 1 7 . 1 1 32 32 GLN CB C 32 29.580 29.580 30.883 -1.303 25768 5624 1 7 . 1 1 32 32 GLN H H 32 8.170 8.170 8.518 -0.348 25768 5625 1 7 . 1 1 33 33 ARG N N 33 122.370 122.370 118.565 3.805 25768 5626 1 7 . 1 1 33 33 ARG C C 33 176.820 176.820 176.983 -0.163 25768 5627 1 7 . 1 1 33 33 ARG CA C 33 56.680 56.680 56.438 0.242 25768 5628 1 7 . 1 1 33 33 ARG CB C 33 31.040 31.040 30.710 0.330 25768 5629 1 7 . 1 1 33 33 ARG H H 33 8.270 8.270 8.439 -0.169 25768 5630 1 7 . 1 1 34 34 GLY N N 34 110.210 110.210 111.139 -0.929 25768 5631 1 7 . 1 1 34 34 GLY C C 34 174.280 174.280 174.412 -0.132 25768 5632 1 7 . 1 1 34 34 GLY CA C 34 45.770 45.770 44.651 1.119 25768 5633 1 7 . 1 1 34 34 GLY H H 34 8.360 8.360 8.474 -0.114 25768 5634 1 7 . 1 1 35 35 THR N N 35 114.100 114.100 111.956 2.144 25768 5635 1 7 . 1 1 35 35 THR C C 35 174.550 174.550 173.977 0.573 25768 5636 1 7 . 1 1 35 35 THR CA C 35 62.140 62.140 62.321 -0.180 25768 5637 1 7 . 1 1 35 35 THR CB C 35 70.330 70.330 69.494 0.836 25768 5638 1 7 . 1 1 35 35 THR H H 35 7.970 7.970 8.063 -0.093 25768 5639 1 7 . 1 1 36 36 LYS N N 36 123.850 123.850 123.869 -0.019 25768 5640 1 7 . 1 1 36 36 LYS C C 36 176.040 176.040 175.390 0.650 25768 5641 1 7 . 1 1 36 36 LYS CA C 36 56.600 56.600 56.099 0.501 25768 5642 1 7 . 1 1 36 36 LYS CB C 36 33.280 33.280 31.729 1.552 25768 5643 1 7 . 1 1 36 36 LYS H H 36 8.230 8.230 8.559 -0.329 25768 5644 1 7 . 1 1 37 37 ALA N N 37 125.650 125.650 127.239 -1.589 25768 5645 1 7 . 1 1 37 37 ALA C C 37 177.570 177.570 177.036 0.534 25768 5646 1 7 . 1 1 37 37 ALA CA C 37 52.860 52.860 52.633 0.227 25768 5647 1 7 . 1 1 37 37 ALA CB C 37 19.610 19.610 20.575 -0.965 25768 5648 1 7 . 1 1 37 37 ALA H H 37 8.290 8.290 8.253 0.037 25768 5649 1 7 . 1 1 38 38 THR N N 38 113.350 113.350 112.145 1.205 25768 5650 1 7 . 1 1 38 38 THR C C 38 174.540 174.540 173.496 1.044 25768 5651 1 7 . 1 1 38 38 THR CA C 38 62.010 62.010 62.039 -0.030 25768 5652 1 7 . 1 1 38 38 THR CB C 38 70.350 70.350 70.812 -0.462 25768 5653 1 7 . 1 1 38 38 THR H H 38 7.970 7.970 7.888 0.082 25768 5654 1 7 . 1 1 39 39 VAL N N 39 120.790 120.790 123.605 -2.815 25768 5655 1 7 . 1 1 39 39 VAL C C 39 175.620 175.620 174.344 1.276 25768 5656 1 7 . 1 1 39 39 VAL CA C 39 62.470 62.470 62.259 0.211 25768 5657 1 7 . 1 1 39 39 VAL CB C 39 32.940 32.940 32.499 0.441 25768 5658 1 7 . 1 1 39 39 VAL H H 39 8.020 8.020 8.238 -0.218 25768 5659 1 7 . 1 1 40 40 ASP N N 40 123.690 123.690 124.796 -1.106 25768 5660 1 7 . 1 1 40 40 ASP C C 40 176.190 176.190 175.400 0.790 25768 5661 1 7 . 1 1 40 40 ASP CA C 40 54.780 54.780 54.139 0.641 25768 5662 1 7 . 1 1 40 40 ASP CB C 40 41.590 41.590 42.400 -0.810 25768 5663 1 7 . 1 1 40 40 ASP H H 40 8.310 8.310 8.338 -0.028 25768 5664 1 7 . 1 1 41 41 SER N N 41 115.470 115.470 118.444 -2.974 25768 5665 1 7 . 1 1 41 41 SER C C 41 174.170 174.170 174.325 -0.155 25768 5666 1 7 . 1 1 41 41 SER CA C 41 59.000 59.000 59.009 -0.009 25768 5667 1 7 . 1 1 41 41 SER CB C 41 64.420 64.420 63.740 0.680 25768 5668 1 7 . 1 1 41 41 SER H H 41 8.130 8.130 8.742 -0.612 25768 5669 1 7 . 1 1 42 42 ASP N N 42 122.430 122.430 118.069 4.361 25768 5670 1 7 . 1 1 42 42 ASP C C 42 175.740 175.740 174.782 0.958 25768 5671 1 7 . 1 1 42 42 ASP CA C 42 54.780 54.780 55.005 -0.225 25768 5672 1 7 . 1 1 42 42 ASP CB C 42 41.620 41.620 40.175 1.446 25768 5673 1 7 . 1 1 42 42 ASP H H 42 8.410 8.410 8.600 -0.190 25768 5674 1 7 . 1 1 43 43 THR N N 43 117.580 117.580 113.665 3.915 25768 5675 1 7 . 1 1 43 43 THR C C 43 173.630 173.630 173.622 0.008 25768 5676 1 7 . 1 1 43 43 THR CA C 43 63.120 63.120 62.197 0.923 25768 5677 1 7 . 1 1 43 43 THR CB C 43 70.650 70.650 69.667 0.983 25768 5678 1 7 . 1 1 43 43 THR H H 43 8.010 8.010 7.737 0.273 25768 5679 1 7 . 1 1 44 44 GLN N N 44 125.420 125.420 121.140 4.280 25768 5680 1 7 . 1 1 44 44 GLN C C 44 174.080 174.080 174.069 0.011 25768 5681 1 7 . 1 1 44 44 GLN CA C 44 55.110 55.110 54.593 0.517 25768 5682 1 7 . 1 1 44 44 GLN CB C 44 31.570 31.570 31.848 -0.278 25768 5683 1 7 . 1 1 44 44 GLN H H 44 9.260 9.260 8.078 1.182 25768 5684 1 7 . 1 1 45 45 LEU N N 45 124.190 124.190 122.755 1.435 25768 5685 1 7 . 1 1 45 45 LEU C C 45 175.970 175.970 175.896 0.074 25768 5686 1 7 . 1 1 45 45 LEU CA C 45 54.690 54.690 55.364 -0.674 25768 5687 1 7 . 1 1 45 45 LEU CB C 45 42.270 42.270 43.488 -1.218 25768 5688 1 7 . 1 1 45 45 LEU H H 45 8.550 8.550 8.237 0.313 25768 5689 1 7 . 1 1 46 46 GLY N N 46 113.310 113.310 113.216 0.094 25768 5690 1 7 . 1 1 46 46 GLY C C 46 171.180 171.180 172.157 -0.977 25768 5691 1 7 . 1 1 46 46 GLY CA C 46 44.400 44.400 44.149 0.251 25768 5692 1 7 . 1 1 46 46 GLY H H 46 8.810 8.810 8.398 0.412 25768 5693 1 7 . 1 1 47 47 LEU N N 47 123.890 123.890 128.430 -4.540 25768 5694 1 7 . 1 1 47 47 LEU C C 47 175.400 175.400 175.110 0.290 25768 5695 1 7 . 1 1 47 47 LEU CA C 47 53.750 53.750 53.552 0.198 25768 5696 1 7 . 1 1 47 47 LEU CB C 47 46.800 46.800 45.760 1.040 25768 5697 1 7 . 1 1 47 47 LEU H H 47 8.590 8.590 8.184 0.406 25768 5698 1 7 . 1 1 48 48 THR N N 48 111.210 111.210 112.839 -1.629 25768 5699 1 7 . 1 1 48 48 THR C C 48 172.520 172.520 172.706 -0.186 25768 5700 1 7 . 1 1 48 48 THR CA C 48 58.950 58.950 60.193 -1.243 25768 5701 1 7 . 1 1 48 48 THR CB C 48 72.360 72.360 71.737 0.623 25768 5702 1 7 . 1 1 48 48 THR H H 48 8.620 8.620 8.456 0.164 25768 5703 1 7 . 1 1 49 49 PHE N N 49 118.810 118.810 120.112 -1.302 25768 5704 1 7 . 1 1 49 49 PHE C C 49 174.700 174.700 175.796 -1.096 25768 5705 1 7 . 1 1 49 49 PHE CA C 49 55.080 55.080 56.496 -1.416 25768 5706 1 7 . 1 1 49 49 PHE CB C 49 42.360 42.360 42.246 0.114 25768 5707 1 7 . 1 1 49 49 PHE H H 49 8.410 8.410 8.261 0.149 25768 5708 1 7 . 1 1 50 50 THR N N 50 121.230 121.230 122.079 -0.849 25768 5709 1 7 . 1 1 50 50 THR C C 50 173.250 173.250 173.132 0.118 25768 5710 1 7 . 1 1 50 50 THR CA C 50 62.740 62.740 62.085 0.655 25768 5711 1 7 . 1 1 50 50 THR CB C 50 73.740 73.740 69.521 4.219 25768 5712 1 7 . 1 1 50 50 THR H H 50 9.330 9.330 8.538 0.792 25768 5713 1 7 . 1 1 51 51 TYR N N 51 126.010 126.010 129.552 -3.542 25768 5714 1 7 . 1 1 51 51 TYR C C 51 174.850 174.850 174.495 0.355 25768 5715 1 7 . 1 1 51 51 TYR CA C 51 56.240 56.240 55.486 0.754 25768 5716 1 7 . 1 1 51 51 TYR CB C 51 41.630 41.630 39.525 2.105 25768 5717 1 7 . 1 1 51 51 TYR H H 51 9.150 9.150 9.275 -0.125 25768 5718 1 7 . 1 1 52 52 MET N N 52 127.390 127.390 126.502 0.888 25768 5719 1 7 . 1 1 52 52 MET C C 52 174.490 174.490 174.667 -0.177 25768 5720 1 7 . 1 1 52 52 MET CA C 52 52.450 52.450 55.897 -3.447 25768 5721 1 7 . 1 1 52 52 MET CB C 52 28.590 28.590 32.205 -3.615 25768 5722 1 7 . 1 1 52 52 MET H H 52 7.950 7.950 8.077 -0.127 25768 5723 1 7 . 1 1 53 53 PHE N N 53 123.830 123.830 125.892 -2.062 25768 5724 1 7 . 1 1 53 53 PHE C C 53 173.720 173.720 173.795 -0.075 25768 5725 1 7 . 1 1 53 53 PHE CA C 53 57.110 57.110 56.708 0.402 25768 5726 1 7 . 1 1 53 53 PHE CB C 53 39.420 39.420 41.048 -1.628 25768 5727 1 7 . 1 1 53 53 PHE H H 53 7.720 7.720 8.190 -0.470 25768 5728 1 7 . 1 1 54 54 ALA N N 54 125.650 125.650 126.786 -1.136 25768 5729 1 7 . 1 1 54 54 ALA C C 54 175.020 175.020 175.614 -0.594 25768 5730 1 7 . 1 1 54 54 ALA CA C 54 50.740 50.740 52.635 -1.895 25768 5731 1 7 . 1 1 54 54 ALA CB C 54 22.700 22.700 18.516 4.184 25768 5732 1 7 . 1 1 54 54 ALA H H 54 8.360 8.360 8.038 0.322 25768 5733 1 7 . 1 1 55 55 ASP N N 55 118.790 118.790 120.793 -2.003 25768 5734 1 7 . 1 1 55 55 ASP C C 55 174.780 174.780 175.861 -1.081 25768 5735 1 7 . 1 1 55 55 ASP CA C 55 58.590 58.590 54.825 3.765 25768 5736 1 7 . 1 1 55 55 ASP CB C 55 40.430 40.430 40.190 0.240 25768 5737 1 7 . 1 1 55 55 ASP H H 55 8.590 8.590 8.572 0.018 25768 5738 1 7 . 1 1 56 56 LYS N N 56 106.200 106.200 117.489 -11.289 25768 5739 1 7 . 1 1 56 56 LYS C C 56 174.940 174.940 174.767 0.173 25768 5740 1 7 . 1 1 56 56 LYS CA C 56 55.260 55.260 56.325 -1.065 25768 5741 1 7 . 1 1 56 56 LYS CB C 56 34.510 34.510 35.003 -0.493 25768 5742 1 7 . 1 1 56 56 LYS H H 56 7.260 7.260 7.510 -0.250 25768 5743 1 7 . 1 1 57 57 TRP N N 57 115.680 115.680 121.195 -5.515 25768 5744 1 7 . 1 1 57 57 TRP C C 57 173.940 173.940 175.237 -1.297 25768 5745 1 7 . 1 1 57 57 TRP CA C 57 55.410 55.410 57.521 -2.111 25768 5746 1 7 . 1 1 57 57 TRP CB C 57 34.470 34.470 32.234 2.236 25768 5747 1 7 . 1 1 57 57 TRP H H 57 6.570 6.570 7.906 -1.336 25768 5748 1 7 . 1 1 58 58 GLY N N 58 107.610 107.610 110.216 -2.606 25768 5749 1 7 . 1 1 58 58 GLY C C 58 172.730 172.730 171.583 1.147 25768 5750 1 7 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.283 -0.233 25768 5751 1 7 . 1 1 58 58 GLY H H 58 9.260 9.260 7.686 1.574 25768 5752 1 7 . 1 1 59 59 VAL N N 59 118.130 118.130 124.099 -5.969 25768 5753 1 7 . 1 1 59 59 VAL C C 59 173.000 173.000 174.650 -1.650 25768 5754 1 7 . 1 1 59 59 VAL CA C 59 59.950 59.950 60.273 -0.323 25768 5755 1 7 . 1 1 59 59 VAL CB C 59 35.170 35.170 33.649 1.521 25768 5756 1 7 . 1 1 59 59 VAL H H 59 9.030 9.030 8.465 0.565 25768 5757 1 7 . 1 1 60 60 GLU N N 60 127.900 127.900 123.537 4.363 25768 5758 1 7 . 1 1 60 60 GLU C C 60 174.470 174.470 174.924 -0.454 25768 5759 1 7 . 1 1 60 60 GLU CA C 60 52.940 52.940 54.731 -1.791 25768 5760 1 7 . 1 1 60 60 GLU CB C 60 35.100 35.100 34.103 0.996 25768 5761 1 7 . 1 1 60 60 GLU H H 60 9.440 9.440 8.887 0.553 25768 5762 1 7 . 1 1 61 61 LEU N N 61 127.410 127.410 122.971 4.439 25768 5763 1 7 . 1 1 61 61 LEU C C 61 174.950 174.950 176.117 -1.167 25768 5764 1 7 . 1 1 61 61 LEU CA C 61 53.390 53.390 53.416 -0.026 25768 5765 1 7 . 1 1 61 61 LEU CB C 61 45.980 45.980 44.479 1.501 25768 5766 1 7 . 1 1 61 61 LEU H H 61 8.740 8.740 8.568 0.172 25768 5767 1 7 . 1 1 62 62 VAL N N 62 125.750 125.750 120.569 5.181 25768 5768 1 7 . 1 1 62 62 VAL C C 62 173.960 173.960 174.815 -0.855 25768 5769 1 7 . 1 1 62 62 VAL CA C 62 61.350 61.350 60.982 0.368 25768 5770 1 7 . 1 1 62 62 VAL CB C 62 34.740 34.740 34.166 0.575 25768 5771 1 7 . 1 1 62 62 VAL H H 62 8.790 8.790 7.817 0.973 25768 5772 1 7 . 1 1 63 63 ALA N N 63 127.230 127.230 128.102 -0.872 25768 5773 1 7 . 1 1 63 63 ALA C C 63 173.930 173.930 175.374 -1.444 25768 5774 1 7 . 1 1 63 63 ALA CA C 63 51.140 51.140 51.083 0.057 25768 5775 1 7 . 1 1 63 63 ALA CB C 63 22.500 22.500 22.392 0.108 25768 5776 1 7 . 1 1 63 63 ALA H H 63 8.740 8.740 8.403 0.337 25768 5777 1 7 . 1 1 64 64 ALA N N 64 120.410 120.410 124.505 -4.095 25768 5778 1 7 . 1 1 64 64 ALA C C 64 176.770 176.770 176.608 0.162 25768 5779 1 7 . 1 1 64 64 ALA CA C 64 51.420 51.420 50.550 0.870 25768 5780 1 7 . 1 1 64 64 ALA CB C 64 22.590 22.590 22.628 -0.038 25768 5781 1 7 . 1 1 64 64 ALA H H 64 8.290 8.290 8.226 0.064 25768 5782 1 7 . 1 1 65 65 THR N N 65 116.130 116.130 113.630 2.500 25768 5783 1 7 . 1 1 65 65 THR C C 65 171.220 171.220 173.162 -1.942 25768 5784 1 7 . 1 1 65 65 THR CA C 65 58.860 58.860 59.271 -0.411 25768 5785 1 7 . 1 1 65 65 THR CB C 65 72.020 72.020 68.126 3.894 25768 5786 1 7 . 1 1 65 65 THR H H 65 8.760 8.760 8.581 0.179 25768 5787 1 7 . 1 1 66 66 PRO C C 66 176.720 176.720 176.203 0.517 25768 5788 1 7 . 1 1 66 66 PRO CA C 66 63.610 63.610 63.222 0.388 25768 5789 1 7 . 1 1 66 66 PRO CB C 66 32.550 32.550 32.378 0.172 25768 5790 1 7 . 1 1 67 67 PHE N N 67 120.360 120.360 118.429 1.931 25768 5791 1 7 . 1 1 67 67 PHE C C 67 175.480 175.480 173.965 1.515 25768 5792 1 7 . 1 1 67 67 PHE CA C 67 58.840 58.840 57.174 1.666 25768 5793 1 7 . 1 1 67 67 PHE CB C 67 40.170 40.170 41.265 -1.095 25768 5794 1 7 . 1 1 67 67 PHE H H 67 8.590 8.590 8.238 0.352 25768 5795 1 7 . 1 1 68 68 ASN N N 68 119.030 119.030 123.763 -4.733 25768 5796 1 7 . 1 1 68 68 ASN C C 68 174.740 174.740 174.473 0.267 25768 5797 1 7 . 1 1 68 68 ASN CA C 68 53.430 53.430 53.257 0.173 25768 5798 1 7 . 1 1 68 68 ASN CB C 68 39.420 39.420 38.975 0.445 25768 5799 1 7 . 1 1 68 68 ASN H H 68 8.340 8.340 8.251 0.089 25768 5800 1 7 . 1 1 69 69 HIS N N 69 119.590 119.590 119.942 -0.352 25768 5801 1 7 . 1 1 69 69 HIS C C 69 174.370 174.370 174.786 -0.416 25768 5802 1 7 . 1 1 69 69 HIS CA C 69 55.950 55.950 56.489 -0.539 25768 5803 1 7 . 1 1 69 69 HIS CB C 69 29.960 29.960 31.114 -1.154 25768 5804 1 7 . 1 1 69 69 HIS H H 69 8.350 8.350 8.579 -0.229 25768 5805 1 7 . 1 1 70 70 GLN N N 70 121.980 121.980 118.358 3.622 25768 5806 1 7 . 1 1 70 70 GLN C C 70 175.740 175.740 174.994 0.746 25768 5807 1 7 . 1 1 70 70 GLN CA C 70 56.340 56.340 54.990 1.350 25768 5808 1 7 . 1 1 70 70 GLN CB C 70 29.660 29.660 30.615 -0.955 25768 5809 1 7 . 1 1 70 70 GLN H H 70 8.350 8.350 7.874 0.476 25768 5810 1 7 . 1 1 71 71 VAL N N 71 120.530 120.530 120.363 0.167 25768 5811 1 7 . 1 1 71 71 VAL C C 71 175.500 175.500 174.874 0.626 25768 5812 1 7 . 1 1 71 71 VAL CA C 71 62.540 62.540 60.789 1.751 25768 5813 1 7 . 1 1 71 71 VAL CB C 71 33.090 33.090 33.425 -0.335 25768 5814 1 7 . 1 1 71 71 VAL H H 71 8.020 8.020 8.288 -0.268 25768 5815 1 7 . 1 1 72 72 ASP N N 72 123.910 123.910 127.949 -4.039 25768 5816 1 7 . 1 1 72 72 ASP C C 72 176.300 176.300 175.537 0.763 25768 5817 1 7 . 1 1 72 72 ASP CA C 72 54.340 54.340 53.886 0.453 25768 5818 1 7 . 1 1 72 72 ASP CB C 72 41.480 41.480 41.514 -0.034 25768 5819 1 7 . 1 1 72 72 ASP H H 72 8.280 8.280 8.606 -0.326 25768 5820 1 7 . 1 1 73 73 VAL N N 73 120.580 120.580 117.632 2.948 25768 5821 1 7 . 1 1 73 73 VAL C C 73 176.350 176.350 175.422 0.928 25768 5822 1 7 . 1 1 73 73 VAL CA C 73 62.970 62.970 63.279 -0.309 25768 5823 1 7 . 1 1 73 73 VAL CB C 73 32.550 32.550 33.115 -0.565 25768 5824 1 7 . 1 1 73 73 VAL H H 73 7.960 7.960 8.525 -0.565 25768 5825 1 7 . 1 1 74 74 LYS N N 74 123.620 123.620 120.643 2.977 25768 5826 1 7 . 1 1 74 74 LYS C C 74 177.130 177.130 176.982 0.148 25768 5827 1 7 . 1 1 74 74 LYS CA C 74 57.060 57.060 56.145 0.915 25768 5828 1 7 . 1 1 74 74 LYS CB C 74 32.860 32.860 34.153 -1.293 25768 5829 1 7 . 1 1 74 74 LYS H H 74 8.230 8.230 7.574 0.656 25768 5830 1 7 . 1 1 75 75 GLY N N 75 109.370 109.370 108.732 0.638 25768 5831 1 7 . 1 1 75 75 GLY C C 75 174.030 174.030 174.656 -0.626 25768 5832 1 7 . 1 1 75 75 GLY CA C 75 45.800 45.800 45.058 0.742 25768 5833 1 7 . 1 1 75 75 GLY H H 75 8.160 8.160 8.285 -0.125 25768 5834 1 7 . 1 1 76 76 LEU N N 76 121.660 121.660 121.594 0.066 25768 5835 1 7 . 1 1 76 76 LEU C C 76 177.410 177.410 178.265 -0.855 25768 5836 1 7 . 1 1 76 76 LEU CA C 76 55.410 55.410 59.253 -3.843 25768 5837 1 7 . 1 1 76 76 LEU CB C 76 42.790 42.790 42.152 0.638 25768 5838 1 7 . 1 1 76 76 LEU H H 76 8.030 8.030 8.566 -0.536 25768 5839 1 7 . 1 1 77 77 GLY N N 77 109.330 109.330 105.513 3.817 25768 5840 1 7 . 1 1 77 77 GLY C C 77 171.800 171.800 173.076 -1.276 25768 5841 1 7 . 1 1 77 77 GLY CA C 77 44.990 44.990 44.588 0.402 25768 5842 1 7 . 1 1 77 77 GLY H H 77 8.100 8.100 7.768 0.332 25768 5843 1 7 . 1 1 78 78 PRO C C 78 177.740 177.740 176.980 0.760 25768 5844 1 7 . 1 1 78 78 PRO CA C 78 63.890 63.890 63.379 0.511 25768 5845 1 7 . 1 1 78 78 PRO CB C 78 32.170 32.170 32.064 0.106 25768 5846 1 7 . 1 1 79 79 GLY N N 79 109.530 109.530 107.992 1.538 25768 5847 1 7 . 1 1 79 79 GLY C C 79 174.460 174.460 174.253 0.207 25768 5848 1 7 . 1 1 79 79 GLY CA C 79 45.780 45.780 45.029 0.751 25768 5849 1 7 . 1 1 79 79 GLY H H 79 8.410 8.410 8.027 0.383 25768 5850 1 7 . 1 1 80 80 LEU N N 80 121.880 121.880 122.380 -0.500 25768 5851 1 7 . 1 1 80 80 LEU C C 80 177.100 177.100 174.983 2.117 25768 5852 1 7 . 1 1 80 80 LEU CA C 80 55.720 55.720 54.298 1.422 25768 5853 1 7 . 1 1 80 80 LEU CB C 80 42.580 42.580 42.822 -0.242 25768 5854 1 7 . 1 1 80 80 LEU H H 80 8.010 8.010 8.039 -0.029 25768 5855 1 7 . 1 1 81 81 ASP N N 81 119.990 119.990 119.202 0.788 25768 5856 1 7 . 1 1 81 81 ASP C C 81 176.880 176.880 175.210 1.670 25768 5857 1 7 . 1 1 81 81 ASP CA C 81 54.770 54.770 53.504 1.266 25768 5858 1 7 . 1 1 81 81 ASP CB C 81 41.390 41.390 42.804 -1.415 25768 5859 1 7 . 1 1 81 81 ASP H H 81 8.220 8.220 7.850 0.370 25768 5860 1 7 . 1 1 82 82 GLY N N 82 109.270 109.270 108.628 0.642 25768 5861 1 7 . 1 1 82 82 GLY C C 82 174.190 174.190 174.322 -0.132 25768 5862 1 7 . 1 1 82 82 GLY CA C 82 45.990 45.990 44.605 1.385 25768 5863 1 7 . 1 1 82 82 GLY H H 82 8.170 8.170 8.117 0.053 25768 5864 1 7 . 1 1 83 83 LYS N N 83 121.000 121.000 118.090 2.910 25768 5865 1 7 . 1 1 83 83 LYS C C 83 176.610 176.610 176.737 -0.127 25768 5866 1 7 . 1 1 83 83 LYS CA C 83 56.620 56.620 56.531 0.089 25768 5867 1 7 . 1 1 83 83 LYS CB C 83 33.020 33.020 31.552 1.468 25768 5868 1 7 . 1 1 83 83 LYS H H 83 7.970 7.970 8.206 -0.236 25768 5869 1 7 . 1 1 84 84 LEU N N 84 123.120 123.120 120.219 2.901 25768 5870 1 7 . 1 1 84 84 LEU C C 84 176.920 176.920 177.973 -1.053 25768 5871 1 7 . 1 1 84 84 LEU CA C 84 55.550 55.550 57.360 -1.810 25768 5872 1 7 . 1 1 84 84 LEU CB C 84 42.430 42.430 41.986 0.444 25768 5873 1 7 . 1 1 84 84 LEU H H 84 8.130 8.130 7.884 0.246 25768 5874 1 7 . 1 1 85 85 ALA N N 85 123.930 123.930 118.158 5.772 25768 5875 1 7 . 1 1 85 85 ALA C C 85 177.060 177.060 176.388 0.672 25768 5876 1 7 . 1 1 85 85 ALA CA C 85 52.790 52.790 51.686 1.104 25768 5877 1 7 . 1 1 85 85 ALA CB C 85 19.670 19.670 19.227 0.443 25768 5878 1 7 . 1 1 85 85 ALA H H 85 8.040 8.040 7.783 0.257 25768 5879 1 7 . 1 1 86 86 ASP N N 86 119.760 119.760 119.502 0.258 25768 5880 1 7 . 1 1 86 86 ASP C C 86 175.820 175.820 175.736 0.084 25768 5881 1 7 . 1 1 86 86 ASP CA C 86 54.520 54.520 53.664 0.856 25768 5882 1 7 . 1 1 86 86 ASP CB C 86 41.390 41.390 41.915 -0.525 25768 5883 1 7 . 1 1 86 86 ASP H H 86 8.110 8.110 7.741 0.369 25768 5884 1 7 . 1 1 87 87 ILE N N 87 120.620 120.620 118.952 1.668 25768 5885 1 7 . 1 1 87 87 ILE C C 87 175.740 175.740 175.968 -0.228 25768 5886 1 7 . 1 1 87 87 ILE CA C 87 61.160 61.160 62.788 -1.628 25768 5887 1 7 . 1 1 87 87 ILE CB C 87 39.260 39.260 39.078 0.182 25768 5888 1 7 . 1 1 87 87 ILE H H 87 7.800 7.800 8.505 -0.705 25768 5889 1 7 . 1 1 88 88 LYS N N 88 125.820 125.820 119.709 6.111 25768 5890 1 7 . 1 1 88 88 LYS C C 88 175.340 175.340 176.202 -0.862 25768 5891 1 7 . 1 1 88 88 LYS CA C 88 56.300 56.300 56.488 -0.188 25768 5892 1 7 . 1 1 88 88 LYS CB C 88 32.900 32.900 33.890 -0.990 25768 5893 1 7 . 1 1 88 88 LYS H H 88 8.250 8.250 8.171 0.079 25768 5894 1 7 . 1 1 89 89 GLN N N 89 121.750 121.750 120.694 1.056 25768 5895 1 7 . 1 1 89 89 GLN C C 89 175.000 175.000 174.940 0.060 25768 5896 1 7 . 1 1 89 89 GLN CA C 89 55.210 55.210 55.212 -0.002 25768 5897 1 7 . 1 1 89 89 GLN CB C 89 30.570 30.570 29.805 0.765 25768 5898 1 7 . 1 1 89 89 GLN H H 89 8.000 8.000 8.001 -0.001 25768 5899 1 7 . 1 1 90 90 LEU N N 90 126.660 126.660 123.538 3.122 25768 5900 1 7 . 1 1 90 90 LEU C C 90 174.240 174.240 175.342 -1.102 25768 5901 1 7 . 1 1 90 90 LEU CA C 90 52.720 52.720 51.989 0.731 25768 5902 1 7 . 1 1 90 90 LEU CB C 90 42.350 42.350 42.026 0.324 25768 5903 1 7 . 1 1 90 90 LEU H H 90 8.630 8.630 8.373 0.257 25768 5904 1 7 . 1 1 92 92 PRO C C 92 173.900 173.900 176.464 -2.564 25768 5905 1 7 . 1 1 92 92 PRO CA C 92 63.320 63.320 63.236 0.084 25768 5906 1 7 . 1 1 92 92 PRO CB C 92 31.920 31.920 32.112 -0.192 25768 5907 1 7 . 1 1 93 93 THR N N 93 119.770 119.770 114.356 5.414 25768 5908 1 7 . 1 1 93 93 THR C C 93 171.360 171.360 173.419 -2.059 25768 5909 1 7 . 1 1 93 93 THR CA C 93 62.610 62.610 62.265 0.345 25768 5910 1 7 . 1 1 93 93 THR CB C 93 72.680 72.680 70.915 1.765 25768 5911 1 7 . 1 1 93 93 THR H H 93 8.290 8.290 8.254 0.036 25768 5912 1 7 . 1 1 94 94 LEU N N 94 128.880 128.880 128.834 0.046 25768 5913 1 7 . 1 1 94 94 LEU C C 94 175.130 175.130 174.290 0.840 25768 5914 1 7 . 1 1 94 94 LEU CA C 94 53.520 53.520 54.457 -0.937 25768 5915 1 7 . 1 1 94 94 LEU CB C 94 46.140 46.140 44.313 1.827 25768 5916 1 7 . 1 1 94 94 LEU H H 94 8.680 8.680 9.011 -0.331 25768 5917 1 7 . 1 1 95 95 LEU N N 95 123.630 123.630 125.493 -1.863 25768 5918 1 7 . 1 1 95 95 LEU C C 95 175.540 175.540 174.752 0.788 25768 5919 1 7 . 1 1 95 95 LEU CA C 95 55.190 55.190 53.918 1.272 25768 5920 1 7 . 1 1 95 95 LEU CB C 95 45.300 45.300 46.184 -0.884 25768 5921 1 7 . 1 1 95 95 LEU H H 95 9.580 9.580 8.349 1.231 25768 5922 1 7 . 1 1 96 96 LEU N N 96 123.150 123.150 125.874 -2.724 25768 5923 1 7 . 1 1 96 96 LEU C C 96 174.960 174.960 175.174 -0.214 25768 5924 1 7 . 1 1 96 96 LEU CA C 96 54.420 54.420 54.998 -0.578 25768 5925 1 7 . 1 1 96 96 LEU CB C 96 44.560 44.560 43.103 1.457 25768 5926 1 7 . 1 1 96 96 LEU H H 96 8.770 8.770 8.171 0.599 25768 5927 1 7 . 1 1 97 97 GLN N N 97 121.290 121.290 120.689 0.601 25768 5928 1 7 . 1 1 97 97 GLN C C 97 174.380 174.380 173.782 0.598 25768 5929 1 7 . 1 1 97 97 GLN CA C 97 54.740 54.740 53.688 1.052 25768 5930 1 7 . 1 1 97 97 GLN CB C 97 36.600 36.600 32.736 3.864 25768 5931 1 7 . 1 1 97 97 GLN H H 97 9.480 9.480 8.415 1.065 25768 5932 1 7 . 1 1 98 98 TYR N N 98 122.250 122.250 121.660 0.590 25768 5933 1 7 . 1 1 98 98 TYR C C 98 173.460 173.460 174.223 -0.763 25768 5934 1 7 . 1 1 98 98 TYR CA C 98 55.160 55.160 56.599 -1.439 25768 5935 1 7 . 1 1 98 98 TYR CB C 98 42.420 42.420 43.281 -0.861 25768 5936 1 7 . 1 1 98 98 TYR H H 98 9.010 9.010 8.957 0.053 25768 5937 1 7 . 1 1 99 99 TYR N N 99 126.860 126.860 122.850 4.010 25768 5938 1 7 . 1 1 99 99 TYR C C 99 175.380 175.380 175.442 -0.062 25768 5939 1 7 . 1 1 99 99 TYR CA C 99 54.220 54.220 56.136 -1.915 25768 5940 1 7 . 1 1 99 99 TYR CB C 99 38.890 38.890 38.229 0.661 25768 5941 1 7 . 1 1 99 99 TYR H H 99 8.300 8.300 8.222 0.078 25768 5942 1 7 . 1 1 100 100 PRO C C 100 178.330 178.330 177.008 1.322 25768 5943 1 7 . 1 1 100 100 PRO CA C 100 64.750 64.750 65.451 -0.701 25768 5944 1 7 . 1 1 100 100 PRO CB C 100 32.130 32.130 32.082 0.048 25768 5945 1 7 . 1 1 101 101 MET N N 101 114.520 114.520 115.832 -1.312 25768 5946 1 7 . 1 1 101 101 MET C C 101 178.240 178.240 175.276 2.964 25768 5947 1 7 . 1 1 101 101 MET CA C 101 53.500 53.500 54.459 -0.959 25768 5948 1 7 . 1 1 101 101 MET CB C 101 30.160 30.160 32.985 -2.825 25768 5949 1 7 . 1 1 101 101 MET H H 101 9.390 9.390 8.342 1.048 25768 5950 1 7 . 1 1 102 102 GLY N N 102 117.500 117.500 108.520 8.980 25768 5951 1 7 . 1 1 102 102 GLY C C 102 175.690 175.690 174.970 0.720 25768 5952 1 7 . 1 1 102 102 GLY CA C 102 46.760 46.760 45.750 1.010 25768 5953 1 7 . 1 1 102 102 GLY H H 102 8.640 8.640 7.545 1.095 25768 5954 1 7 . 1 1 103 103 GLY N N 103 111.030 111.030 112.414 -1.384 25768 5955 1 7 . 1 1 103 103 GLY C C 103 174.070 174.070 174.004 0.066 25768 5956 1 7 . 1 1 103 103 GLY CA C 103 46.140 46.140 44.707 1.433 25768 5957 1 7 . 1 1 103 103 GLY H H 103 9.390 9.390 8.531 0.859 25768 5958 1 7 . 1 1 104 104 THR N N 104 109.290 109.290 111.034 -1.744 25768 5959 1 7 . 1 1 104 104 THR C C 104 174.290 174.290 174.199 0.091 25768 5960 1 7 . 1 1 104 104 THR CA C 104 60.900 60.900 60.350 0.550 25768 5961 1 7 . 1 1 104 104 THR CB C 104 72.070 72.070 70.576 1.494 25768 5962 1 7 . 1 1 104 104 THR H H 104 7.290 7.290 7.922 -0.632 25768 5963 1 7 . 1 1 105 105 ASN C C 105 175.050 175.050 174.762 0.288 25768 5964 1 7 . 1 1 105 105 ASN CA C 105 52.880 52.880 52.921 -0.041 25768 5965 1 7 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.673 -0.413 25768 5966 1 7 . 1 1 106 106 SER N N 106 113.000 113.000 117.658 -4.658 25768 5967 1 7 . 1 1 106 106 SER C C 106 176.000 176.000 175.040 0.960 25768 5968 1 7 . 1 1 106 106 SER CA C 106 58.700 58.700 58.415 0.285 25768 5969 1 7 . 1 1 106 106 SER CB C 106 64.540 64.540 64.422 0.118 25768 5970 1 7 . 1 1 106 106 SER H H 106 7.450 7.450 7.586 -0.136 25768 5971 1 7 . 1 1 107 107 ALA N N 107 132.220 132.220 127.273 4.947 25768 5972 1 7 . 1 1 107 107 ALA C C 107 176.610 176.610 177.647 -1.037 25768 5973 1 7 . 1 1 107 107 ALA CA C 107 54.380 54.380 53.213 1.167 25768 5974 1 7 . 1 1 107 107 ALA CB C 107 18.690 18.690 18.658 0.032 25768 5975 1 7 . 1 1 107 107 ALA H H 107 8.870 8.870 8.484 0.386 25768 5976 1 7 . 1 1 108 108 PHE N N 108 116.050 116.050 116.508 -0.458 25768 5977 1 7 . 1 1 108 108 PHE C C 108 174.270 174.270 176.030 -1.760 25768 5978 1 7 . 1 1 108 108 PHE CA C 108 56.140 56.140 56.908 -0.768 25768 5979 1 7 . 1 1 108 108 PHE CB C 108 40.520 40.520 40.028 0.492 25768 5980 1 7 . 1 1 108 108 PHE H H 108 7.550 7.550 7.712 -0.162 25768 5981 1 7 . 1 1 109 109 GLN N N 109 128.260 128.260 122.206 6.054 25768 5982 1 7 . 1 1 109 109 GLN C C 109 172.300 172.300 174.178 -1.878 25768 5983 1 7 . 1 1 109 109 GLN CA C 109 52.310 52.310 52.800 -0.490 25768 5984 1 7 . 1 1 109 109 GLN CB C 109 29.050 29.050 30.247 -1.197 25768 5985 1 7 . 1 1 109 109 GLN H H 109 9.060 9.060 8.944 0.116 25768 5986 1 7 . 1 1 110 110 PRO C C 110 175.020 175.020 176.129 -1.109 25768 5987 1 7 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.389 -0.839 25768 5988 1 7 . 1 1 110 110 PRO CB C 110 33.280 33.280 32.300 0.980 25768 5989 1 7 . 1 1 111 111 TYR N N 111 115.730 115.730 120.773 -5.043 25768 5990 1 7 . 1 1 111 111 TYR C C 111 173.850 173.850 173.692 0.158 25768 5991 1 7 . 1 1 111 111 TYR CA C 111 56.470 56.470 55.507 0.963 25768 5992 1 7 . 1 1 111 111 TYR CB C 111 38.650 38.650 40.015 -1.365 25768 5993 1 7 . 1 1 111 111 TYR H H 111 8.500 8.500 8.370 0.130 25768 5994 1 7 . 1 1 112 112 GLY N N 112 103.570 103.570 108.453 -4.883 25768 5995 1 7 . 1 1 112 112 GLY C C 112 172.020 172.020 172.733 -0.713 25768 5996 1 7 . 1 1 112 112 GLY CA C 112 43.950 43.950 43.421 0.529 25768 5997 1 7 . 1 1 112 112 GLY H H 112 8.110 8.110 8.853 -0.743 25768 5998 1 7 . 1 1 113 113 GLY N N 113 108.510 108.510 108.485 0.025 25768 5999 1 7 . 1 1 113 113 GLY C C 113 171.540 171.540 172.144 -0.604 25768 6000 1 7 . 1 1 113 113 GLY CA C 113 46.120 46.120 45.986 0.134 25768 6001 1 7 . 1 1 113 113 GLY H H 113 9.080 9.080 8.050 1.030 25768 6002 1 7 . 1 1 114 114 LEU N N 114 120.270 120.270 119.469 0.801 25768 6003 1 7 . 1 1 114 114 LEU C C 114 175.810 175.810 175.666 0.144 25768 6004 1 7 . 1 1 114 114 LEU CA C 114 53.920 53.920 54.529 -0.609 25768 6005 1 7 . 1 1 114 114 LEU CB C 114 47.940 47.940 47.303 0.637 25768 6006 1 7 . 1 1 114 114 LEU H H 114 8.620 8.620 8.042 0.578 25768 6007 1 7 . 1 1 115 115 GLY N N 115 110.620 110.620 107.975 2.645 25768 6008 1 7 . 1 1 115 115 GLY C C 115 171.560 171.560 172.784 -1.224 25768 6009 1 7 . 1 1 115 115 GLY CA C 115 46.940 46.940 43.461 3.479 25768 6010 1 7 . 1 1 115 115 GLY H H 115 9.000 9.000 8.088 0.912 25768 6011 1 7 . 1 1 116 116 VAL N N 116 113.600 113.600 114.105 -0.505 25768 6012 1 7 . 1 1 116 116 VAL C C 116 174.120 174.120 173.945 0.175 25768 6013 1 7 . 1 1 116 116 VAL CA C 116 58.970 58.970 60.839 -1.869 25768 6014 1 7 . 1 1 116 116 VAL CB C 116 36.600 36.600 33.882 2.718 25768 6015 1 7 . 1 1 116 116 VAL H H 116 8.680 8.680 7.807 0.873 25768 6016 1 7 . 1 1 117 117 ASN N N 117 120.020 120.020 122.577 -2.557 25768 6017 1 7 . 1 1 117 117 ASN CA C 117 52.190 52.190 51.992 0.198 25768 6018 1 7 . 1 1 117 117 ASN CB C 117 42.450 42.450 39.464 2.986 25768 6019 1 7 . 1 1 117 117 ASN H H 117 8.840 8.840 8.592 0.248 25768 6020 1 7 . 1 1 119 119 THR C C 119 174.350 174.350 173.449 0.901 25768 6021 1 7 . 1 1 119 119 THR CA C 119 63.140 63.140 61.473 1.667 25768 6022 1 7 . 1 1 119 119 THR CB C 119 70.170 70.170 69.071 1.099 25768 6023 1 7 . 1 1 120 120 THR N N 120 114.120 114.120 115.575 -1.455 25768 6024 1 7 . 1 1 120 120 THR C C 120 174.220 174.220 174.388 -0.168 25768 6025 1 7 . 1 1 120 120 THR CA C 120 61.900 61.900 61.150 0.750 25768 6026 1 7 . 1 1 120 120 THR CB C 120 70.140 70.140 69.982 0.158 25768 6027 1 7 . 1 1 120 120 THR H H 120 7.570 7.570 7.834 -0.264 25768 6028 1 7 . 1 1 121 121 PHE N N 121 121.230 121.230 123.230 -2.000 25768 6029 1 7 . 1 1 121 121 PHE C C 121 174.910 174.910 175.145 -0.235 25768 6030 1 7 . 1 1 121 121 PHE CA C 121 58.720 58.720 57.228 1.492 25768 6031 1 7 . 1 1 121 121 PHE CB C 121 40.470 40.470 40.073 0.397 25768 6032 1 7 . 1 1 121 121 PHE H H 121 7.830 7.830 8.091 -0.261 25768 6033 1 7 . 1 1 122 122 PHE C C 122 175.070 175.070 175.007 0.063 25768 6034 1 7 . 1 1 122 122 PHE CA C 122 57.890 57.890 58.415 -0.525 25768 6035 1 7 . 1 1 122 122 PHE CB C 122 39.870 39.870 39.898 -0.028 25768 6036 1 7 . 1 1 123 123 ASP N N 123 122.170 122.170 120.344 1.826 25768 6037 1 7 . 1 1 123 123 ASP C C 123 176.150 176.150 176.134 0.016 25768 6038 1 7 . 1 1 123 123 ASP CA C 123 54.530 54.530 53.792 0.738 25768 6039 1 7 . 1 1 123 123 ASP CB C 123 41.830 41.830 41.478 0.352 25768 6040 1 7 . 1 1 123 123 ASP H H 123 7.950 7.950 8.440 -0.490 25768 6041 1 7 . 1 1 124 124 GLU N N 124 122.690 122.690 122.544 0.146 25768 6042 1 7 . 1 1 124 124 GLU C C 124 176.630 176.630 177.440 -0.810 25768 6043 1 7 . 1 1 124 124 GLU CA C 124 57.620 57.620 58.074 -0.454 25768 6044 1 7 . 1 1 124 124 GLU CB C 124 30.450 30.450 30.052 0.398 25768 6045 1 7 . 1 1 124 124 GLU H H 124 8.340 8.340 8.928 -0.588 25768 6046 1 7 . 1 1 125 125 ASP N N 125 121.280 121.280 122.383 -1.103 25768 6047 1 7 . 1 1 125 125 ASP C C 125 176.940 176.940 177.936 -0.996 25768 6048 1 7 . 1 1 125 125 ASP CA C 125 55.180 55.180 57.156 -1.976 25768 6049 1 7 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.187 1.033 25768 6050 1 7 . 1 1 125 125 ASP H H 125 8.310 8.310 8.605 -0.295 25768 6051 1 7 . 1 1 126 126 LEU N N 126 122.830 122.830 118.342 4.488 25768 6052 1 7 . 1 1 126 126 LEU C C 126 178.020 178.020 178.139 -0.119 25768 6053 1 7 . 1 1 126 126 LEU CA C 126 56.450 56.450 56.976 -0.526 25768 6054 1 7 . 1 1 126 126 LEU CB C 126 42.150 42.150 41.578 0.572 25768 6055 1 7 . 1 1 126 126 LEU H H 126 8.010 8.010 8.051 -0.041 25768 6056 1 7 . 1 1 127 127 ALA N N 127 122.660 122.660 119.733 2.927 25768 6057 1 7 . 1 1 127 127 ALA C C 127 178.600 178.600 177.808 0.792 25768 6058 1 7 . 1 1 127 127 ALA CA C 127 53.780 53.780 52.570 1.210 25768 6059 1 7 . 1 1 127 127 ALA CB C 127 19.000 19.000 19.430 -0.430 25768 6060 1 7 . 1 1 127 127 ALA H H 127 8.100 8.100 7.751 0.349 25768 6061 1 7 . 1 1 128 128 SER N N 128 113.740 113.740 113.351 0.389 25768 6062 1 7 . 1 1 128 128 SER C C 128 175.010 175.010 173.810 1.200 25768 6063 1 7 . 1 1 128 128 SER CA C 128 59.580 59.580 56.893 2.687 25768 6064 1 7 . 1 1 128 128 SER CB C 128 63.800 63.800 63.906 -0.106 25768 6065 1 7 . 1 1 128 128 SER H H 128 7.920 7.920 7.754 0.166 25768 6066 1 7 . 1 1 129 129 ASN N N 129 120.300 120.300 120.798 -0.498 25768 6067 1 7 . 1 1 129 129 ASN C C 129 175.590 175.590 174.233 1.357 25768 6068 1 7 . 1 1 129 129 ASN CA C 129 54.180 54.180 52.787 1.393 25768 6069 1 7 . 1 1 129 129 ASN CB C 129 38.900 38.900 38.181 0.719 25768 6070 1 7 . 1 1 129 129 ASN H H 129 8.120 8.120 8.661 -0.541 25768 6071 1 7 . 1 1 130 130 ARG N N 130 120.630 120.630 121.733 -1.103 25768 6072 1 7 . 1 1 130 130 ARG C C 130 176.720 176.720 174.825 1.895 25768 6073 1 7 . 1 1 130 130 ARG CA C 130 57.240 57.240 54.902 2.338 25768 6074 1 7 . 1 1 130 130 ARG CB C 130 30.500 30.500 31.761 -1.261 25768 6075 1 7 . 1 1 130 130 ARG H H 130 8.050 8.050 8.211 -0.161 25768 6076 1 7 . 1 1 131 131 LYS N N 131 121.150 121.150 121.926 -0.776 25768 6077 1 7 . 1 1 131 131 LYS C C 131 176.750 176.750 175.726 1.024 25768 6078 1 7 . 1 1 131 131 LYS CA C 131 57.050 57.050 55.833 1.217 25768 6079 1 7 . 1 1 131 131 LYS CB C 131 32.870 32.870 32.565 0.305 25768 6080 1 7 . 1 1 131 131 LYS H H 131 8.020 8.020 8.435 -0.415 25768 6081 1 7 . 1 1 132 132 ALA N N 132 124.110 124.110 122.195 1.915 25768 6082 1 7 . 1 1 132 132 ALA C C 132 177.680 177.680 176.733 0.947 25768 6083 1 7 . 1 1 132 132 ALA CA C 132 53.070 53.070 52.643 0.427 25768 6084 1 7 . 1 1 132 132 ALA CB C 132 19.250 19.250 18.396 0.854 25768 6085 1 7 . 1 1 132 132 ALA H H 132 8.010 8.010 7.930 0.080 25768 6086 1 7 . 1 1 133 133 GLN N N 133 118.830 118.830 119.159 -0.329 25768 6087 1 7 . 1 1 133 133 GLN C C 133 176.380 176.380 175.691 0.689 25768 6088 1 7 . 1 1 133 133 GLN CA C 133 56.400 56.400 55.747 0.653 25768 6089 1 7 . 1 1 133 133 GLN CB C 133 29.670 29.670 29.388 0.282 25768 6090 1 7 . 1 1 133 133 GLN H H 133 8.070 8.070 8.573 -0.503 25768 6091 1 7 . 1 1 134 134 GLY N N 134 109.400 109.400 108.147 1.253 25768 6092 1 7 . 1 1 134 134 GLY C C 134 174.060 174.060 174.941 -0.881 25768 6093 1 7 . 1 1 134 134 GLY CA C 134 45.690 45.690 45.006 0.684 25768 6094 1 7 . 1 1 134 134 GLY H H 134 8.150 8.150 8.084 0.066 25768 6095 1 7 . 1 1 135 135 PHE N N 135 120.480 120.480 121.235 -0.755 25768 6096 1 7 . 1 1 135 135 PHE C C 135 176.000 176.000 176.285 -0.285 25768 6097 1 7 . 1 1 135 135 PHE CA C 135 58.370 58.370 59.134 -0.764 25768 6098 1 7 . 1 1 135 135 PHE CB C 135 39.710 39.710 39.014 0.696 25768 6099 1 7 . 1 1 135 135 PHE H H 135 8.060 8.060 8.057 0.003 25768 6100 1 7 . 1 1 136 136 SER N N 136 116.740 116.740 114.465 2.275 25768 6101 1 7 . 1 1 136 136 SER C C 136 174.620 174.620 173.116 1.504 25768 6102 1 7 . 1 1 136 136 SER CA C 136 58.870 58.870 58.128 0.742 25768 6103 1 7 . 1 1 136 136 SER CB C 136 64.200 64.200 62.642 1.558 25768 6104 1 7 . 1 1 136 136 SER H H 136 8.160 8.160 8.258 -0.098 25768 6105 1 7 . 1 1 137 137 SER N N 137 117.650 117.650 117.187 0.463 25768 6106 1 7 . 1 1 137 137 SER C C 137 174.410 174.410 172.819 1.591 25768 6107 1 7 . 1 1 137 137 SER CA C 137 58.880 58.880 58.776 0.104 25768 6108 1 7 . 1 1 137 137 SER CB C 137 64.140 64.140 64.907 -0.767 25768 6109 1 7 . 1 1 137 137 SER H H 137 8.140 8.140 7.478 0.662 25768 6110 1 7 . 1 1 138 138 MET N N 138 121.980 121.980 122.607 -0.627 25768 6111 1 7 . 1 1 138 138 MET C C 138 175.680 175.680 175.348 0.332 25768 6112 1 7 . 1 1 138 138 MET CA C 138 56.180 56.180 55.322 0.858 25768 6113 1 7 . 1 1 138 138 MET CB C 138 33.240 33.240 34.567 -1.327 25768 6114 1 7 . 1 1 138 138 MET H H 138 8.110 8.110 8.215 -0.105 25768 6115 1 7 . 1 1 139 139 LYS N N 139 122.110 122.110 120.630 1.480 25768 6116 1 7 . 1 1 139 139 LYS C C 139 176.220 176.220 174.958 1.262 25768 6117 1 7 . 1 1 139 139 LYS CA C 139 56.370 56.370 55.384 0.986 25768 6118 1 7 . 1 1 139 139 LYS CB C 139 33.220 33.220 34.808 -1.588 25768 6119 1 7 . 1 1 139 139 LYS H H 139 8.140 8.140 8.561 -0.421 25768 6120 1 7 . 1 1 140 140 LEU N N 140 123.860 123.860 122.566 1.294 25768 6121 1 7 . 1 1 140 140 LEU C C 140 177.100 177.100 176.141 0.959 25768 6122 1 7 . 1 1 140 140 LEU CA C 140 55.710 55.710 55.432 0.278 25768 6123 1 7 . 1 1 140 140 LEU CB C 140 42.460 42.460 43.204 -0.744 25768 6124 1 7 . 1 1 140 140 LEU H H 140 8.140 8.140 8.517 -0.377 25768 6125 1 7 . 1 1 141 141 GLN N N 141 120.350 120.350 120.381 -0.031 25768 6126 1 7 . 1 1 141 141 GLN C C 141 175.170 175.170 174.759 0.411 25768 6127 1 7 . 1 1 141 141 GLN CA C 141 56.200 56.200 55.488 0.712 25768 6128 1 7 . 1 1 141 141 GLN CB C 141 29.950 29.950 30.528 -0.578 25768 6129 1 7 . 1 1 141 141 GLN H H 141 8.210 8.210 8.459 -0.249 25768 6130 1 7 . 1 1 142 142 ASP N N 142 120.950 120.950 119.154 1.796 25768 6131 1 7 . 1 1 142 142 ASP C C 142 175.840 175.840 175.342 0.498 25768 6132 1 7 . 1 1 142 142 ASP CA C 142 54.700 54.700 53.934 0.766 25768 6133 1 7 . 1 1 142 142 ASP CB C 142 41.760 41.760 41.587 0.173 25768 6134 1 7 . 1 1 142 142 ASP H H 142 8.120 8.120 8.764 -0.644 25768 6135 1 7 . 1 1 143 143 SER N N 143 114.880 114.880 115.353 -0.473 25768 6136 1 7 . 1 1 143 143 SER C C 143 173.290 173.290 173.421 -0.131 25768 6137 1 7 . 1 1 143 143 SER CA C 143 58.450 58.450 59.116 -0.666 25768 6138 1 7 . 1 1 143 143 SER CB C 143 64.760 64.760 62.160 2.600 25768 6139 1 7 . 1 1 143 143 SER H H 143 7.960 7.960 8.373 -0.413 25768 6140 1 7 . 1 1 144 144 TRP N N 144 123.110 123.110 127.334 -4.224 25768 6141 1 7 . 1 1 144 144 TRP C C 144 175.880 175.880 174.980 0.900 25768 6142 1 7 . 1 1 144 144 TRP CA C 144 56.420 56.420 57.314 -0.894 25768 6143 1 7 . 1 1 144 144 TRP CB C 144 31.160 31.160 30.281 0.879 25768 6144 1 7 . 1 1 144 144 TRP H H 144 8.080 8.080 8.444 -0.364 25768 6145 1 7 . 1 1 145 145 GLY N N 145 110.410 110.410 109.894 0.516 25768 6146 1 7 . 1 1 145 145 GLY C C 145 172.870 172.870 173.641 -0.771 25768 6147 1 7 . 1 1 145 145 GLY CA C 145 45.130 45.130 44.995 0.135 25768 6148 1 7 . 1 1 145 145 GLY H H 145 8.660 8.660 8.045 0.615 25768 6149 1 7 . 1 1 148 148 GLY C C 148 171.800 171.800 173.580 -1.780 25768 6150 1 7 . 1 1 148 148 GLY CA C 148 44.140 44.140 45.287 -1.147 25768 6151 1 7 . 1 1 149 149 GLU N N 149 123.070 123.070 120.577 2.493 25768 6152 1 7 . 1 1 149 149 GLU C C 149 174.210 174.210 174.300 -0.090 25768 6153 1 7 . 1 1 149 149 GLU CA C 149 55.120 55.120 56.460 -1.340 25768 6154 1 7 . 1 1 149 149 GLU CB C 149 37.410 37.410 33.288 4.122 25768 6155 1 7 . 1 1 149 149 GLU H H 149 8.550 8.550 8.153 0.397 25768 6156 1 7 . 1 1 150 150 LEU N N 150 126.130 126.130 124.302 1.828 25768 6157 1 7 . 1 1 150 150 LEU C C 150 174.410 174.410 175.368 -0.958 25768 6158 1 7 . 1 1 150 150 LEU CA C 150 54.260 54.260 53.713 0.547 25768 6159 1 7 . 1 1 150 150 LEU CB C 150 47.510 47.510 44.412 3.098 25768 6160 1 7 . 1 1 150 150 LEU H H 150 8.550 8.550 8.679 -0.129 25768 6161 1 7 . 1 1 151 151 GLY N N 151 109.500 109.500 108.436 1.064 25768 6162 1 7 . 1 1 151 151 GLY C C 151 170.610 170.610 171.519 -0.909 25768 6163 1 7 . 1 1 151 151 GLY CA C 151 45.980 45.980 42.759 3.221 25768 6164 1 7 . 1 1 151 151 GLY H H 151 8.090 8.090 8.097 -0.007 25768 6165 1 7 . 1 1 152 152 PHE N N 152 110.960 110.960 119.754 -8.794 25768 6166 1 7 . 1 1 152 152 PHE C C 152 171.510 171.510 174.672 -3.162 25768 6167 1 7 . 1 1 152 152 PHE CA C 152 58.170 58.170 55.778 2.392 25768 6168 1 7 . 1 1 152 152 PHE CB C 152 41.690 41.690 40.344 1.346 25768 6169 1 7 . 1 1 152 152 PHE H H 152 8.380 8.380 7.567 0.813 25768 6170 1 7 . 1 1 153 153 ASP N N 153 118.880 118.880 125.819 -6.939 25768 6171 1 7 . 1 1 153 153 ASP C C 153 176.520 176.520 174.897 1.623 25768 6172 1 7 . 1 1 153 153 ASP CA C 153 52.940 52.940 53.371 -0.431 25768 6173 1 7 . 1 1 153 153 ASP CB C 153 44.540 44.540 42.346 2.194 25768 6174 1 7 . 1 1 153 153 ASP H H 153 7.970 7.970 8.590 -0.620 25768 6175 1 7 . 1 1 154 154 TYR N N 154 123.630 123.630 128.590 -4.960 25768 6176 1 7 . 1 1 154 154 TYR C C 154 175.610 175.610 173.670 1.940 25768 6177 1 7 . 1 1 154 154 TYR CA C 154 57.310 57.310 57.152 0.158 25768 6178 1 7 . 1 1 154 154 TYR CB C 154 42.040 42.040 41.142 0.898 25768 6179 1 7 . 1 1 154 154 TYR H H 154 9.730 9.730 9.230 0.500 25768 6180 1 7 . 1 1 155 155 MET N N 155 126.190 126.190 126.303 -0.113 25768 6181 1 7 . 1 1 155 155 MET C C 155 174.970 174.970 175.029 -0.059 25768 6182 1 7 . 1 1 155 155 MET CA C 155 54.720 54.720 55.739 -1.019 25768 6183 1 7 . 1 1 155 155 MET CB C 155 28.300 28.300 33.747 -5.447 25768 6184 1 7 . 1 1 155 155 MET H H 155 8.600 8.600 8.761 -0.161 25768 6185 1 7 . 1 1 156 156 LEU N N 156 125.290 125.290 124.536 0.754 25768 6186 1 7 . 1 1 156 156 LEU C C 156 177.680 177.680 177.514 0.166 25768 6187 1 7 . 1 1 156 156 LEU CA C 156 56.040 56.040 55.223 0.817 25768 6188 1 7 . 1 1 156 156 LEU CB C 156 43.040 43.040 42.997 0.043 25768 6189 1 7 . 1 1 156 156 LEU H H 156 9.190 9.190 8.555 0.635 25768 6190 1 7 . 1 1 157 157 ASN N N 157 114.690 114.690 116.253 -1.563 25768 6191 1 7 . 1 1 157 157 ASN C C 157 173.640 173.640 176.073 -2.433 25768 6192 1 7 . 1 1 157 157 ASN CA C 157 52.650 52.650 54.740 -2.090 25768 6193 1 7 . 1 1 157 157 ASN CB C 157 37.270 37.270 37.645 -0.375 25768 6194 1 7 . 1 1 157 157 ASN H H 157 8.060 8.060 7.967 0.093 25768 6195 1 7 . 1 1 158 158 GLU N N 158 114.530 114.530 118.852 -4.322 25768 6196 1 7 . 1 1 158 158 GLU C C 158 176.090 176.090 177.607 -1.517 25768 6197 1 7 . 1 1 158 158 GLU CA C 158 60.010 60.010 58.276 1.734 25768 6198 1 7 . 1 1 158 158 GLU CB C 158 29.730 29.730 30.172 -0.442 25768 6199 1 7 . 1 1 158 158 GLU H H 158 8.560 8.560 8.724 -0.164 25768 6200 1 7 . 1 1 159 159 HIS N N 159 110.480 110.480 115.632 -5.152 25768 6201 1 7 . 1 1 159 159 HIS C C 159 173.130 173.130 173.770 -0.640 25768 6202 1 7 . 1 1 159 159 HIS CA C 159 56.770 56.770 57.411 -0.641 25768 6203 1 7 . 1 1 159 159 HIS CB C 159 32.630 32.630 31.755 0.875 25768 6204 1 7 . 1 1 159 159 HIS H H 159 8.190 8.190 8.311 -0.121 25768 6205 1 7 . 1 1 160 160 ALA N N 160 122.890 122.890 120.841 2.049 25768 6206 1 7 . 1 1 160 160 ALA C C 160 176.200 176.200 175.160 1.040 25768 6207 1 7 . 1 1 160 160 ALA CA C 160 51.730 51.730 52.081 -0.351 25768 6208 1 7 . 1 1 160 160 ALA CB C 160 21.560 21.560 20.746 0.814 25768 6209 1 7 . 1 1 160 160 ALA H H 160 8.400 8.400 7.658 0.742 25768 6210 1 7 . 1 1 161 161 LEU N N 161 116.540 116.540 118.128 -1.588 25768 6211 1 7 . 1 1 161 161 LEU C C 161 174.930 174.930 175.513 -0.583 25768 6212 1 7 . 1 1 161 161 LEU CA C 161 54.280 54.280 53.988 0.292 25768 6213 1 7 . 1 1 161 161 LEU CB C 161 45.640 45.640 44.488 1.152 25768 6214 1 7 . 1 1 161 161 LEU H H 161 8.590 8.590 8.166 0.424 25768 6215 1 7 . 1 1 162 162 PHE N N 162 121.780 121.780 122.787 -1.007 25768 6216 1 7 . 1 1 162 162 PHE C C 162 171.960 171.960 174.617 -2.657 25768 6217 1 7 . 1 1 162 162 PHE CA C 162 56.420 56.420 57.662 -1.242 25768 6218 1 7 . 1 1 162 162 PHE CB C 162 43.340 43.340 42.362 0.978 25768 6219 1 7 . 1 1 162 162 PHE H H 162 9.180 9.180 9.513 -0.333 25768 6220 1 7 . 1 1 163 163 ASN N N 163 127.850 127.850 122.346 5.504 25768 6221 1 7 . 1 1 163 163 ASN C C 163 171.320 171.320 173.729 -2.409 25768 6222 1 7 . 1 1 163 163 ASN CA C 163 52.340 52.340 52.749 -0.409 25768 6223 1 7 . 1 1 163 163 ASN CB C 163 46.410 46.410 43.029 3.381 25768 6224 1 7 . 1 1 163 163 ASN H H 163 7.700 7.700 9.076 -1.376 25768 6225 1 7 . 1 1 164 164 MET N N 164 119.950 119.950 120.463 -0.513 25768 6226 1 7 . 1 1 164 164 MET C C 164 172.830 172.830 174.730 -1.900 25768 6227 1 7 . 1 1 164 164 MET CA C 164 55.180 55.180 54.271 0.909 25768 6228 1 7 . 1 1 164 164 MET CB C 164 37.770 37.770 38.268 -0.498 25768 6229 1 7 . 1 1 164 164 MET H H 164 7.070 7.070 8.547 -1.477 25768 6230 1 7 . 1 1 165 165 ALA N N 165 120.600 120.600 122.157 -1.557 25768 6231 1 7 . 1 1 165 165 ALA C C 165 174.240 174.240 174.541 -0.301 25768 6232 1 7 . 1 1 165 165 ALA CA C 165 51.630 51.630 51.242 0.388 25768 6233 1 7 . 1 1 165 165 ALA CB C 165 22.330 22.330 22.526 -0.195 25768 6234 1 7 . 1 1 165 165 ALA H H 165 8.290 8.290 8.739 -0.449 25768 6235 1 7 . 1 1 166 166 VAL N N 166 117.900 117.900 121.947 -4.047 25768 6236 1 7 . 1 1 166 166 VAL C C 166 172.950 172.950 173.785 -0.835 25768 6237 1 7 . 1 1 166 166 VAL CA C 166 59.710 59.710 61.945 -2.235 25768 6238 1 7 . 1 1 166 166 VAL CB C 166 35.290 35.290 36.300 -1.010 25768 6239 1 7 . 1 1 166 166 VAL H H 166 8.720 8.720 8.747 -0.027 25768 6240 1 7 . 1 1 171 171 ILE C C 171 175.750 175.750 175.016 0.734 25768 6241 1 7 . 1 1 171 171 ILE CA C 171 61.720 61.720 60.847 0.873 25768 6242 1 7 . 1 1 171 171 ILE CB C 171 39.300 39.300 40.285 -0.985 25768 6243 1 7 . 1 1 172 172 ASP N N 172 124.070 124.070 124.865 -0.795 25768 6244 1 7 . 1 1 172 172 ASP C C 172 176.590 176.590 176.342 0.248 25768 6245 1 7 . 1 1 172 172 ASP CA C 172 54.460 54.460 53.961 0.499 25768 6246 1 7 . 1 1 172 172 ASP CB C 172 41.410 41.410 42.017 -0.608 25768 6247 1 7 . 1 1 172 172 ASP H H 172 8.460 8.460 8.529 -0.069 25768 6248 1 7 . 1 1 173 173 THR N N 173 115.570 115.570 113.120 2.450 25768 6249 1 7 . 1 1 173 173 THR C C 173 175.030 175.030 176.157 -1.127 25768 6250 1 7 . 1 1 173 173 THR CA C 173 62.680 62.680 63.198 -0.518 25768 6251 1 7 . 1 1 173 173 THR CB C 173 69.840 69.840 69.021 0.819 25768 6252 1 7 . 1 1 173 173 THR H H 173 8.080 8.080 7.759 0.321 25768 6253 1 7 . 1 1 174 174 LYS N N 174 122.680 122.680 121.395 1.285 25768 6254 1 7 . 1 1 174 174 LYS C C 174 176.340 176.340 177.594 -1.254 25768 6255 1 7 . 1 1 174 174 LYS CA C 174 56.820 56.820 56.689 0.131 25768 6256 1 7 . 1 1 174 174 LYS CB C 174 32.790 32.790 32.559 0.230 25768 6257 1 7 . 1 1 174 174 LYS H H 174 8.180 8.180 8.339 -0.159 25768 6258 1 7 . 1 1 175 175 ALA N N 175 124.050 124.050 120.432 3.618 25768 6259 1 7 . 1 1 175 175 ALA C C 175 177.550 177.550 177.208 0.342 25768 6260 1 7 . 1 1 175 175 ALA CA C 175 52.840 52.840 53.757 -0.917 25768 6261 1 7 . 1 1 175 175 ALA CB C 175 19.580 19.580 17.578 2.002 25768 6262 1 7 . 1 1 175 175 ALA H H 175 8.050 8.050 8.013 0.037 25768 6263 1 7 . 1 1 176 176 SER N N 176 114.920 114.920 115.634 -0.714 25768 6264 1 7 . 1 1 176 176 SER C C 176 174.240 174.240 173.097 1.143 25768 6265 1 7 . 1 1 176 176 SER CA C 176 58.390 58.390 58.500 -0.110 25768 6266 1 7 . 1 1 176 176 SER CB C 176 64.370 64.370 63.189 1.181 25768 6267 1 7 . 1 1 176 176 SER H H 176 8.070 8.070 8.389 -0.319 25768 6268 1 7 . 1 1 177 177 ILE N N 177 121.650 121.650 123.741 -2.091 25768 6269 1 7 . 1 1 177 177 ILE C C 177 174.990 174.990 175.579 -0.589 25768 6270 1 7 . 1 1 177 177 ILE CA C 177 61.570 61.570 60.582 0.988 25768 6271 1 7 . 1 1 177 177 ILE CB C 177 39.100 39.100 38.877 0.223 25768 6272 1 7 . 1 1 177 177 ILE H H 177 7.960 7.960 8.140 -0.180 25768 6273 1 7 . 1 1 178 178 ASN N N 178 127.040 127.040 126.001 1.039 25768 6274 1 7 . 1 1 178 178 ASN C C 178 179.160 179.160 174.659 4.501 25768 6275 1 7 . 1 1 178 178 ASN CA C 178 55.100 55.100 52.956 2.144 25768 6276 1 7 . 1 1 178 178 ASN CB C 178 41.300 41.300 39.157 2.143 25768 6277 1 7 . 1 1 178 178 ASN H H 178 7.850 7.850 8.519 -0.669 25768 6278 1 7 . 1 1 180 180 PRO C C 180 177.520 177.520 176.082 1.438 25768 6279 1 7 . 1 1 180 180 PRO CA C 180 63.980 63.980 63.355 0.625 25768 6280 1 7 . 1 1 180 180 PRO CB C 180 32.190 32.190 32.000 0.190 25768 6281 1 7 . 1 1 181 181 SER N N 181 115.600 115.600 113.908 1.692 25768 6282 1 7 . 1 1 181 181 SER C C 181 174.710 174.710 173.209 1.501 25768 6283 1 7 . 1 1 181 181 SER CA C 181 58.900 58.900 58.383 0.518 25768 6284 1 7 . 1 1 181 181 SER CB C 181 64.070 64.070 62.932 1.138 25768 6285 1 7 . 1 1 181 181 SER H H 181 8.260 8.260 8.375 -0.115 25768 6286 1 7 . 1 1 182 182 ALA N N 182 125.880 125.880 125.812 0.068 25768 6287 1 7 . 1 1 182 182 ALA C C 182 177.560 177.560 177.374 0.186 25768 6288 1 7 . 1 1 182 182 ALA CA C 182 53.090 53.090 51.388 1.702 25768 6289 1 7 . 1 1 182 182 ALA CB C 182 19.310 19.310 19.418 -0.107 25768 6290 1 7 . 1 1 182 182 ALA H H 182 8.130 8.130 8.136 -0.006 25768 6291 1 7 . 1 1 183 183 LEU N N 183 119.980 119.980 122.965 -2.985 25768 6292 1 7 . 1 1 183 183 LEU C C 183 177.850 177.850 176.832 1.018 25768 6293 1 7 . 1 1 183 183 LEU CA C 183 55.650 55.650 55.331 0.319 25768 6294 1 7 . 1 1 183 183 LEU CB C 183 42.530 42.530 42.420 0.110 25768 6295 1 7 . 1 1 183 183 LEU H H 183 7.940 7.940 8.485 -0.545 25768 6296 1 7 . 1 1 184 184 GLY N N 184 109.250 109.250 109.198 0.052 25768 6297 1 7 . 1 1 184 184 GLY C C 184 174.250 174.250 173.357 0.893 25768 6298 1 7 . 1 1 184 184 GLY CA C 184 45.830 45.830 44.956 0.874 25768 6299 1 7 . 1 1 184 184 GLY H H 184 8.150 8.150 8.485 -0.335 25768 6300 1 7 . 1 1 185 185 VAL N N 185 118.830 118.830 123.248 -4.418 25768 6301 1 7 . 1 1 185 185 VAL C C 185 175.890 175.890 175.604 0.286 25768 6302 1 7 . 1 1 185 185 VAL CA C 185 62.740 62.740 61.299 1.441 25768 6303 1 7 . 1 1 185 185 VAL CB C 185 32.770 32.770 33.293 -0.523 25768 6304 1 7 . 1 1 185 185 VAL H H 185 7.760 7.760 8.173 -0.413 25768 6305 1 7 . 1 1 186 186 ASN N N 186 121.850 121.850 120.361 1.489 25768 6306 1 7 . 1 1 186 186 ASN C C 186 174.970 174.970 174.324 0.646 25768 6307 1 7 . 1 1 186 186 ASN CA C 186 53.590 53.590 53.944 -0.354 25768 6308 1 7 . 1 1 186 186 ASN CB C 186 39.160 39.160 38.821 0.339 25768 6309 1 7 . 1 1 186 186 ASN H H 186 8.380 8.380 8.576 -0.196 25768 6310 1 7 . 1 1 187 187 LYS N N 187 122.120 122.120 122.536 -0.416 25768 6311 1 7 . 1 1 187 187 LYS C C 187 176.490 176.490 177.180 -0.690 25768 6312 1 7 . 1 1 187 187 LYS CA C 187 56.750 56.750 55.511 1.239 25768 6313 1 7 . 1 1 187 187 LYS CB C 187 33.250 33.250 33.455 -0.205 25768 6314 1 7 . 1 1 187 187 LYS H H 187 8.140 8.140 8.151 -0.011 25768 6315 1 7 . 1 1 188 188 THR N N 188 115.250 115.250 115.407 -0.157 25768 6316 1 7 . 1 1 188 188 THR C C 188 174.250 174.250 174.177 0.073 25768 6317 1 7 . 1 1 188 188 THR CA C 188 62.360 62.360 64.382 -2.022 25768 6318 1 7 . 1 1 188 188 THR CB C 188 70.280 70.280 69.113 1.167 25768 6319 1 7 . 1 1 188 188 THR H H 188 8.100 8.100 8.275 -0.175 25768 6320 1 7 . 1 1 189 189 LYS N N 189 123.780 123.780 119.723 4.057 25768 6321 1 7 . 1 1 189 189 LYS C C 189 176.090 176.090 174.950 1.140 25768 6322 1 7 . 1 1 189 189 LYS CA C 189 56.590 56.590 57.451 -0.861 25768 6323 1 7 . 1 1 189 189 LYS CB C 189 33.350 33.350 31.553 1.797 25768 6324 1 7 . 1 1 189 189 LYS H H 189 8.110 8.110 8.466 -0.356 25768 6325 1 7 . 1 1 190 190 VAL N N 190 120.920 120.920 111.996 8.924 25768 6326 1 7 . 1 1 190 190 VAL C C 190 175.590 175.590 174.187 1.403 25768 6327 1 7 . 1 1 190 190 VAL CA C 190 62.400 62.400 60.338 2.062 25768 6328 1 7 . 1 1 190 190 VAL CB C 190 32.990 32.990 34.866 -1.876 25768 6329 1 7 . 1 1 190 190 VAL H H 190 8.040 8.040 7.414 0.626 25768 6330 1 7 . 1 1 191 191 ASP N N 191 123.790 123.790 120.729 3.061 25768 6331 1 7 . 1 1 191 191 ASP C C 191 175.750 175.750 175.291 0.459 25768 6332 1 7 . 1 1 191 191 ASP CA C 191 54.650 54.650 55.410 -0.759 25768 6333 1 7 . 1 1 191 191 ASP CB C 191 41.450 41.450 40.036 1.414 25768 6334 1 7 . 1 1 191 191 ASP H H 191 8.240 8.240 8.560 -0.320 25768 6335 1 7 . 1 1 192 192 VAL N N 192 118.850 118.850 116.746 2.104 25768 6336 1 7 . 1 1 192 192 VAL C C 192 175.380 175.380 175.026 0.354 25768 6337 1 7 . 1 1 192 192 VAL CA C 192 62.110 62.110 63.293 -1.183 25768 6338 1 7 . 1 1 192 192 VAL CB C 192 33.290 33.290 30.702 2.588 25768 6339 1 7 . 1 1 192 192 VAL H H 192 7.860 7.860 8.497 -0.637 25768 6340 1 7 . 1 1 193 193 ASP N N 193 124.190 124.190 125.517 -1.327 25768 6341 1 7 . 1 1 193 193 ASP C C 193 175.630 175.630 175.860 -0.230 25768 6342 1 7 . 1 1 193 193 ASP CA C 193 54.540 54.540 54.729 -0.189 25768 6343 1 7 . 1 1 193 193 ASP CB C 193 41.410 41.410 43.754 -2.344 25768 6344 1 7 . 1 1 193 193 ASP H H 193 8.310 8.310 8.615 -0.305 25768 6345 1 7 . 1 1 194 194 VAL N N 194 119.580 119.580 118.610 0.970 25768 6346 1 7 . 1 1 194 194 VAL C C 194 174.950 174.950 174.632 0.318 25768 6347 1 7 . 1 1 194 194 VAL CA C 194 61.770 61.770 62.417 -0.647 25768 6348 1 7 . 1 1 194 194 VAL CB C 194 33.680 33.680 32.988 0.692 25768 6349 1 7 . 1 1 194 194 VAL H H 194 7.890 7.890 7.727 0.163 25768 6350 1 7 . 1 1 195 195 ASP N N 195 125.660 125.660 126.119 -0.459 25768 6351 1 7 . 1 1 195 195 ASP C C 195 174.290 174.290 174.457 -0.167 25768 6352 1 7 . 1 1 195 195 ASP CA C 195 51.940 51.940 52.392 -0.452 25768 6353 1 7 . 1 1 195 195 ASP CB C 195 40.950 40.950 41.495 -0.545 25768 6354 1 7 . 1 1 195 195 ASP H H 195 8.410 8.410 8.386 0.024 25768 6355 1 7 . 1 1 198 198 VAL C C 198 173.940 173.940 173.744 0.196 25768 6356 1 7 . 1 1 198 198 VAL CA C 198 61.270 61.270 61.844 -0.574 25768 6357 1 7 . 1 1 198 198 VAL CB C 198 35.910 35.910 34.021 1.889 25768 6358 1 7 . 1 1 199 199 TYR N N 199 123.780 123.780 120.737 3.043 25768 6359 1 7 . 1 1 199 199 TYR C C 199 174.150 174.150 173.258 0.892 25768 6360 1 7 . 1 1 199 199 TYR CA C 199 56.220 56.220 55.327 0.893 25768 6361 1 7 . 1 1 199 199 TYR CB C 199 41.660 41.660 39.865 1.795 25768 6362 1 7 . 1 1 199 199 TYR H H 199 8.540 8.540 7.398 1.142 25768 6363 1 7 . 1 1 200 200 MET N N 200 123.920 123.920 120.499 3.421 25768 6364 1 7 . 1 1 200 200 MET C C 200 173.810 173.810 174.982 -1.172 25768 6365 1 7 . 1 1 200 200 MET CA C 200 54.710 54.710 54.598 0.112 25768 6366 1 7 . 1 1 200 200 MET CB C 200 37.110 37.110 35.810 1.300 25768 6367 1 7 . 1 1 200 200 MET H H 200 9.130 9.130 8.210 0.920 25768 6368 1 7 . 1 1 201 201 ILE N N 201 123.670 123.670 118.117 5.553 25768 6369 1 7 . 1 1 201 201 ILE C C 201 174.030 174.030 174.549 -0.519 25768 6370 1 7 . 1 1 201 201 ILE CA C 201 59.820 59.820 59.064 0.756 25768 6371 1 7 . 1 1 201 201 ILE CB C 201 41.720 41.720 41.707 0.013 25768 6372 1 7 . 1 1 201 201 ILE H H 201 8.030 8.030 8.328 -0.298 25768 6373 1 7 . 1 1 202 202 GLY N N 202 112.910 112.910 111.137 1.773 25768 6374 1 7 . 1 1 202 202 GLY C C 202 170.280 170.280 171.851 -1.571 25768 6375 1 7 . 1 1 202 202 GLY CA C 202 46.800 46.800 45.807 0.993 25768 6376 1 7 . 1 1 202 202 GLY H H 202 8.580 8.580 8.555 0.025 25768 6377 1 7 . 1 1 203 203 PHE N N 203 116.240 116.240 116.029 0.211 25768 6378 1 7 . 1 1 203 203 PHE C C 203 173.940 173.940 173.778 0.162 25768 6379 1 7 . 1 1 203 203 PHE CA C 203 55.890 55.890 54.449 1.441 25768 6380 1 7 . 1 1 203 203 PHE CB C 203 45.060 45.060 41.603 3.457 25768 6381 1 7 . 1 1 203 203 PHE H H 203 8.620 8.620 8.017 0.603 25768 6382 1 7 . 1 1 204 204 GLY N N 204 105.610 105.610 105.677 -0.067 25768 6383 1 7 . 1 1 204 204 GLY C C 204 171.190 171.190 171.666 -0.476 25768 6384 1 7 . 1 1 204 204 GLY CA C 204 46.720 46.720 45.436 1.284 25768 6385 1 7 . 1 1 204 204 GLY H H 204 8.960 8.960 8.805 0.155 25768 6386 1 7 . 1 1 205 205 TYR N N 205 121.160 121.160 118.363 2.797 25768 6387 1 7 . 1 1 205 205 TYR C C 205 173.030 173.030 173.248 -0.218 25768 6388 1 7 . 1 1 205 205 TYR CA C 205 57.190 57.190 57.282 -0.093 25768 6389 1 7 . 1 1 205 205 TYR CB C 205 44.400 44.400 43.472 0.928 25768 6390 1 7 . 1 1 205 205 TYR H H 205 9.380 9.380 9.028 0.352 25768 6391 1 7 . 1 1 206 206 LYS N N 206 126.970 126.970 123.488 3.482 25768 6392 1 7 . 1 1 206 206 LYS C C 206 174.210 174.210 175.059 -0.849 25768 6393 1 7 . 1 1 206 206 LYS CA C 206 54.770 54.770 54.497 0.273 25768 6394 1 7 . 1 1 206 206 LYS CB C 206 34.440 34.440 35.175 -0.735 25768 6395 1 7 . 1 1 206 206 LYS H H 206 8.380 8.380 7.654 0.726 25768 6396 1 7 . 1 1 207 207 PHE N N 207 126.330 126.330 126.814 -0.484 25768 6397 1 7 . 1 1 207 207 PHE C C 207 175.020 175.020 175.236 -0.216 25768 6398 1 7 . 1 1 207 207 PHE CA C 207 58.170 58.170 59.170 -1.000 25768 6399 1 7 . 1 1 207 207 PHE CB C 207 40.920 40.920 40.059 0.861 25768 6400 1 7 . 1 1 207 207 PHE H H 207 9.290 9.290 8.236 1.054 25768 6401 1 7 . 1 1 208 208 LEU N N 208 122.740 122.740 127.152 -4.412 25768 6402 1 7 . 1 1 208 208 LEU C C 208 176.510 176.510 176.382 0.128 25768 6403 1 7 . 1 1 208 208 LEU CA C 208 54.910 54.910 55.260 -0.349 25768 6404 1 7 . 1 1 208 208 LEU CB C 208 43.830 43.830 42.532 1.298 25768 6405 1 7 . 1 1 208 208 LEU H H 208 8.310 8.310 7.864 0.446 25768 6406 1 8 . 1 1 2 2 HIS C C 2 175.310 175.310 173.896 1.414 25768 6407 1 8 . 1 1 3 3 LYS N N 3 122.080 122.080 122.602 -0.522 25768 6408 1 8 . 1 1 3 3 LYS C C 3 173.490 173.490 174.368 -0.878 25768 6409 1 8 . 1 1 3 3 LYS CA C 3 55.050 55.050 55.736 -0.686 25768 6410 1 8 . 1 1 3 3 LYS CB C 3 35.380 35.380 35.961 -0.581 25768 6411 1 8 . 1 1 3 3 LYS H H 3 8.620 8.620 8.390 0.230 25768 6412 1 8 . 1 1 4 4 ALA N N 4 120.860 120.860 123.008 -2.148 25768 6413 1 8 . 1 1 4 4 ALA C C 4 178.190 178.190 178.182 0.008 25768 6414 1 8 . 1 1 4 4 ALA CA C 4 53.480 53.480 53.002 0.478 25768 6415 1 8 . 1 1 4 4 ALA CB C 4 18.140 18.140 18.256 -0.116 25768 6416 1 8 . 1 1 4 4 ALA H H 4 8.580 8.580 8.295 0.285 25768 6417 1 8 . 1 1 5 5 GLY N N 5 112.890 112.890 111.882 1.008 25768 6418 1 8 . 1 1 5 5 GLY C C 5 173.830 173.830 173.618 0.212 25768 6419 1 8 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.366 0.514 25768 6420 1 8 . 1 1 5 5 GLY H H 5 9.210 9.210 8.307 0.903 25768 6421 1 8 . 1 1 6 6 ASP N N 6 121.590 121.590 120.311 1.279 25768 6422 1 8 . 1 1 6 6 ASP C C 6 174.380 174.380 174.394 -0.014 25768 6423 1 8 . 1 1 6 6 ASP CA C 6 55.790 55.790 54.901 0.889 25768 6424 1 8 . 1 1 6 6 ASP CB C 6 41.760 41.760 41.642 0.118 25768 6425 1 8 . 1 1 6 6 ASP H H 6 7.620 7.620 7.414 0.206 25768 6426 1 8 . 1 1 7 7 PHE N N 7 120.860 120.860 119.626 1.234 25768 6427 1 8 . 1 1 7 7 PHE C C 7 174.050 174.050 175.048 -0.998 25768 6428 1 8 . 1 1 7 7 PHE CA C 7 56.110 56.110 57.220 -1.110 25768 6429 1 8 . 1 1 7 7 PHE CB C 7 42.550 42.550 40.589 1.961 25768 6430 1 8 . 1 1 7 7 PHE H H 7 8.250 8.250 8.497 -0.247 25768 6431 1 8 . 1 1 8 8 ILE N N 8 127.950 127.950 122.795 5.155 25768 6432 1 8 . 1 1 8 8 ILE C C 8 174.000 174.000 174.719 -0.719 25768 6433 1 8 . 1 1 8 8 ILE CA C 8 61.160 61.160 60.541 0.619 25768 6434 1 8 . 1 1 8 8 ILE CB C 8 42.660 42.660 41.918 0.742 25768 6435 1 8 . 1 1 8 8 ILE H H 8 9.230 9.230 8.997 0.233 25768 6436 1 8 . 1 1 9 9 ILE N N 9 125.380 125.380 124.776 0.604 25768 6437 1 8 . 1 1 9 9 ILE C C 9 173.630 173.630 175.001 -1.371 25768 6438 1 8 . 1 1 9 9 ILE CA C 9 59.600 59.600 60.873 -1.273 25768 6439 1 8 . 1 1 9 9 ILE CB C 9 41.180 41.180 40.072 1.108 25768 6440 1 8 . 1 1 9 9 ILE H H 9 8.580 8.580 9.031 -0.451 25768 6441 1 8 . 1 1 10 10 ARG N N 10 124.950 124.950 123.992 0.958 25768 6442 1 8 . 1 1 10 10 ARG C C 10 175.030 175.030 174.596 0.434 25768 6443 1 8 . 1 1 10 10 ARG CA C 10 53.920 53.920 54.879 -0.959 25768 6444 1 8 . 1 1 10 10 ARG CB C 10 31.880 31.880 35.038 -3.158 25768 6445 1 8 . 1 1 10 10 ARG H H 10 9.230 9.230 8.210 1.020 25768 6446 1 8 . 1 1 11 11 GLY N N 11 105.650 105.650 111.537 -5.887 25768 6447 1 8 . 1 1 11 11 GLY C C 11 172.090 172.090 172.661 -0.571 25768 6448 1 8 . 1 1 11 11 GLY CA C 11 44.460 44.460 43.895 0.565 25768 6449 1 8 . 1 1 11 11 GLY H H 11 8.780 8.780 9.181 -0.401 25768 6450 1 8 . 1 1 12 12 GLY N N 12 107.800 107.800 108.913 -1.113 25768 6451 1 8 . 1 1 12 12 GLY C C 12 171.460 171.460 172.000 -0.540 25768 6452 1 8 . 1 1 12 12 GLY CA C 12 46.630 46.630 43.572 3.058 25768 6453 1 8 . 1 1 12 12 GLY H H 12 8.510 8.510 8.906 -0.396 25768 6454 1 8 . 1 1 13 13 PHE N N 13 119.900 119.900 121.067 -1.167 25768 6455 1 8 . 1 1 13 13 PHE C C 13 174.190 174.190 173.545 0.645 25768 6456 1 8 . 1 1 13 13 PHE CA C 13 56.340 56.340 57.550 -1.210 25768 6457 1 8 . 1 1 13 13 PHE CB C 13 41.090 41.090 43.381 -2.291 25768 6458 1 8 . 1 1 13 13 PHE H H 13 8.610 8.610 8.072 0.538 25768 6459 1 8 . 1 1 14 14 ALA N N 14 128.030 128.030 128.680 -0.650 25768 6460 1 8 . 1 1 14 14 ALA C C 14 176.560 176.560 176.905 -0.345 25768 6461 1 8 . 1 1 14 14 ALA CA C 14 49.940 49.940 50.485 -0.545 25768 6462 1 8 . 1 1 14 14 ALA CB C 14 20.360 20.360 21.799 -1.439 25768 6463 1 8 . 1 1 14 14 ALA H H 14 9.220 9.220 8.118 1.102 25768 6464 1 8 . 1 1 15 15 THR N N 15 118.620 118.620 115.080 3.540 25768 6465 1 8 . 1 1 15 15 THR CA C 15 61.440 61.440 61.331 0.108 25768 6466 1 8 . 1 1 15 15 THR CB C 15 71.370 71.370 70.206 1.164 25768 6467 1 8 . 1 1 15 15 THR H H 15 9.220 9.220 8.374 0.846 25768 6468 1 8 . 1 1 18 18 PRO C C 18 176.690 176.690 176.688 0.002 25768 6469 1 8 . 1 1 18 18 PRO CA C 18 63.610 63.610 64.203 -0.593 25768 6470 1 8 . 1 1 18 18 PRO CB C 18 32.440 32.440 32.480 -0.040 25768 6471 1 8 . 1 1 19 19 ASP N N 19 120.320 120.320 114.852 5.468 25768 6472 1 8 . 1 1 19 19 ASP C C 19 175.950 175.950 175.104 0.846 25768 6473 1 8 . 1 1 19 19 ASP CA C 19 54.710 54.710 54.719 -0.009 25768 6474 1 8 . 1 1 19 19 ASP CB C 19 41.450 41.450 39.928 1.522 25768 6475 1 8 . 1 1 19 19 ASP H H 19 8.330 8.330 8.582 -0.252 25768 6476 1 8 . 1 1 20 20 ASP N N 20 121.990 121.990 117.297 4.693 25768 6477 1 8 . 1 1 20 20 ASP C C 20 176.760 176.760 177.104 -0.344 25768 6478 1 8 . 1 1 20 20 ASP CA C 20 54.470 54.470 55.293 -0.823 25768 6479 1 8 . 1 1 20 20 ASP CB C 20 41.310 41.310 41.285 0.025 25768 6480 1 8 . 1 1 20 20 ASP H H 20 8.240 8.240 8.378 -0.138 25768 6481 1 8 . 1 1 21 21 SER N N 21 117.050 117.050 115.083 1.967 25768 6482 1 8 . 1 1 21 21 SER C C 21 175.170 175.170 174.108 1.062 25768 6483 1 8 . 1 1 21 21 SER CA C 21 59.490 59.490 59.328 0.162 25768 6484 1 8 . 1 1 21 21 SER CB C 21 64.080 64.080 61.803 2.277 25768 6485 1 8 . 1 1 21 21 SER H H 21 8.360 8.360 8.242 0.118 25768 6486 1 8 . 1 1 22 22 SER N N 22 117.820 117.820 117.291 0.529 25768 6487 1 8 . 1 1 22 22 SER C C 22 174.940 174.940 173.920 1.020 25768 6488 1 8 . 1 1 22 22 SER CA C 22 59.160 59.160 58.773 0.387 25768 6489 1 8 . 1 1 22 22 SER CB C 22 64.110 64.110 63.838 0.272 25768 6490 1 8 . 1 1 22 22 SER H H 22 8.310 8.310 8.446 -0.136 25768 6491 1 8 . 1 1 23 23 SER N N 23 117.660 117.660 119.735 -2.075 25768 6492 1 8 . 1 1 23 23 SER C C 23 174.340 174.340 173.794 0.546 25768 6493 1 8 . 1 1 23 23 SER CA C 23 59.050 59.050 58.175 0.875 25768 6494 1 8 . 1 1 23 23 SER CB C 23 64.210 64.210 63.781 0.429 25768 6495 1 8 . 1 1 23 23 SER H H 23 8.120 8.120 8.228 -0.108 25768 6496 1 8 . 1 1 24 24 ASP N N 24 122.590 122.590 119.787 2.803 25768 6497 1 8 . 1 1 24 24 ASP C C 24 176.250 176.250 175.192 1.058 25768 6498 1 8 . 1 1 24 24 ASP CA C 24 54.910 54.910 53.635 1.275 25768 6499 1 8 . 1 1 24 24 ASP CB C 24 41.270 41.270 42.340 -1.069 25768 6500 1 8 . 1 1 24 24 ASP H H 24 8.230 8.230 7.721 0.509 25768 6501 1 8 . 1 1 25 25 ILE N N 25 120.650 120.650 120.062 0.588 25768 6502 1 8 . 1 1 25 25 ILE C C 25 176.190 176.190 175.054 1.136 25768 6503 1 8 . 1 1 25 25 ILE CA C 25 61.880 61.880 61.852 0.028 25768 6504 1 8 . 1 1 25 25 ILE CB C 25 38.730 38.730 39.097 -0.367 25768 6505 1 8 . 1 1 25 25 ILE H H 25 7.860 7.860 8.073 -0.213 25768 6506 1 8 . 1 1 26 26 LYS N N 26 124.420 124.420 118.991 5.429 25768 6507 1 8 . 1 1 26 26 LYS C C 26 176.640 176.640 175.541 1.099 25768 6508 1 8 . 1 1 26 26 LYS CA C 26 56.520 56.520 55.577 0.943 25768 6509 1 8 . 1 1 26 26 LYS CB C 26 32.890 32.890 34.330 -1.440 25768 6510 1 8 . 1 1 26 26 LYS H H 26 8.140 8.140 7.479 0.661 25768 6511 1 8 . 1 1 27 27 LEU N N 27 123.120 123.120 122.320 0.800 25768 6512 1 8 . 1 1 27 27 LEU C C 27 177.110 177.110 176.255 0.855 25768 6513 1 8 . 1 1 27 27 LEU CA C 27 55.590 55.590 55.416 0.174 25768 6514 1 8 . 1 1 27 27 LEU CB C 27 42.500 42.500 42.642 -0.142 25768 6515 1 8 . 1 1 27 27 LEU H H 27 8.080 8.080 8.586 -0.506 25768 6516 1 8 . 1 1 28 28 ASP N N 28 120.850 120.850 117.463 3.387 25768 6517 1 8 . 1 1 28 28 ASP C C 28 176.960 176.960 174.915 2.045 25768 6518 1 8 . 1 1 28 28 ASP CA C 28 54.800 54.800 54.746 0.054 25768 6519 1 8 . 1 1 28 28 ASP CB C 28 41.380 41.380 40.867 0.513 25768 6520 1 8 . 1 1 28 28 ASP H H 28 8.180 8.180 7.970 0.210 25768 6521 1 8 . 1 1 29 29 GLY N N 29 109.800 109.800 107.087 2.713 25768 6522 1 8 . 1 1 29 29 GLY C C 29 174.370 174.370 174.901 -0.531 25768 6523 1 8 . 1 1 29 29 GLY CA C 29 46.150 46.150 45.287 0.863 25768 6524 1 8 . 1 1 29 29 GLY H H 29 8.230 8.230 8.423 -0.193 25768 6525 1 8 . 1 1 30 30 ALA N N 30 123.880 123.880 123.515 0.365 25768 6526 1 8 . 1 1 30 30 ALA C C 30 178.040 178.040 178.111 -0.071 25768 6527 1 8 . 1 1 30 30 ALA CA C 30 53.140 53.140 52.761 0.379 25768 6528 1 8 . 1 1 30 30 ALA CB C 30 19.350 19.350 18.955 0.395 25768 6529 1 8 . 1 1 30 30 ALA H H 30 8.040 8.040 7.990 0.050 25768 6530 1 8 . 1 1 31 31 LYS N N 31 119.800 119.800 121.026 -1.226 25768 6531 1 8 . 1 1 31 31 LYS C C 31 176.770 176.770 175.473 1.297 25768 6532 1 8 . 1 1 31 31 LYS CA C 31 56.870 56.870 56.212 0.657 25768 6533 1 8 . 1 1 31 31 LYS CB C 31 32.980 32.980 33.088 -0.108 25768 6534 1 8 . 1 1 31 31 LYS H H 31 8.060 8.060 8.025 0.035 25768 6535 1 8 . 1 1 32 32 GLN N N 32 120.930 120.930 120.040 0.890 25768 6536 1 8 . 1 1 32 32 GLN C C 32 176.000 176.000 174.576 1.424 25768 6537 1 8 . 1 1 32 32 GLN CA C 32 56.280 56.280 55.161 1.119 25768 6538 1 8 . 1 1 32 32 GLN CB C 32 29.580 29.580 28.690 0.890 25768 6539 1 8 . 1 1 32 32 GLN H H 32 8.170 8.170 8.384 -0.214 25768 6540 1 8 . 1 1 33 33 ARG N N 33 122.370 122.370 122.977 -0.607 25768 6541 1 8 . 1 1 33 33 ARG C C 33 176.820 176.820 175.786 1.034 25768 6542 1 8 . 1 1 33 33 ARG CA C 33 56.680 56.680 56.044 0.636 25768 6543 1 8 . 1 1 33 33 ARG CB C 33 31.040 31.040 31.907 -0.867 25768 6544 1 8 . 1 1 33 33 ARG H H 33 8.270 8.270 8.111 0.159 25768 6545 1 8 . 1 1 34 34 GLY N N 34 110.210 110.210 110.051 0.159 25768 6546 1 8 . 1 1 34 34 GLY C C 34 174.280 174.280 174.520 -0.240 25768 6547 1 8 . 1 1 34 34 GLY CA C 34 45.770 45.770 44.347 1.423 25768 6548 1 8 . 1 1 34 34 GLY H H 34 8.360 8.360 8.312 0.048 25768 6549 1 8 . 1 1 35 35 THR N N 35 114.100 114.100 117.051 -2.951 25768 6550 1 8 . 1 1 35 35 THR C C 35 174.550 174.550 174.083 0.467 25768 6551 1 8 . 1 1 35 35 THR CA C 35 62.140 62.140 62.965 -0.825 25768 6552 1 8 . 1 1 35 35 THR CB C 35 70.330 70.330 68.433 1.897 25768 6553 1 8 . 1 1 35 35 THR H H 35 7.970 7.970 8.220 -0.250 25768 6554 1 8 . 1 1 36 36 LYS N N 36 123.850 123.850 125.826 -1.976 25768 6555 1 8 . 1 1 36 36 LYS C C 36 176.040 176.040 174.923 1.117 25768 6556 1 8 . 1 1 36 36 LYS CA C 36 56.600 56.600 56.290 0.310 25768 6557 1 8 . 1 1 36 36 LYS CB C 36 33.280 33.280 35.048 -1.768 25768 6558 1 8 . 1 1 36 36 LYS H H 36 8.230 8.230 8.186 0.044 25768 6559 1 8 . 1 1 37 37 ALA N N 37 125.650 125.650 125.288 0.362 25768 6560 1 8 . 1 1 37 37 ALA C C 37 177.570 177.570 176.946 0.624 25768 6561 1 8 . 1 1 37 37 ALA CA C 37 52.860 52.860 52.272 0.588 25768 6562 1 8 . 1 1 37 37 ALA CB C 37 19.610 19.610 20.203 -0.593 25768 6563 1 8 . 1 1 37 37 ALA H H 37 8.290 8.290 8.350 -0.060 25768 6564 1 8 . 1 1 38 38 THR N N 38 113.350 113.350 116.504 -3.154 25768 6565 1 8 . 1 1 38 38 THR C C 38 174.540 174.540 174.593 -0.053 25768 6566 1 8 . 1 1 38 38 THR CA C 38 62.010 62.010 61.646 0.364 25768 6567 1 8 . 1 1 38 38 THR CB C 38 70.350 70.350 69.893 0.457 25768 6568 1 8 . 1 1 38 38 THR H H 38 7.970 7.970 7.935 0.035 25768 6569 1 8 . 1 1 39 39 VAL N N 39 120.790 120.790 123.612 -2.822 25768 6570 1 8 . 1 1 39 39 VAL C C 39 175.620 175.620 176.135 -0.515 25768 6571 1 8 . 1 1 39 39 VAL CA C 39 62.470 62.470 63.595 -1.125 25768 6572 1 8 . 1 1 39 39 VAL CB C 39 32.940 32.940 32.290 0.650 25768 6573 1 8 . 1 1 39 39 VAL H H 39 8.020 8.020 8.499 -0.479 25768 6574 1 8 . 1 1 40 40 ASP N N 40 123.690 123.690 118.450 5.240 25768 6575 1 8 . 1 1 40 40 ASP C C 40 176.190 176.190 175.684 0.506 25768 6576 1 8 . 1 1 40 40 ASP CA C 40 54.780 54.780 53.727 1.053 25768 6577 1 8 . 1 1 40 40 ASP CB C 40 41.590 41.590 42.434 -0.844 25768 6578 1 8 . 1 1 40 40 ASP H H 40 8.310 8.310 8.164 0.146 25768 6579 1 8 . 1 1 41 41 SER N N 41 115.470 115.470 118.139 -2.669 25768 6580 1 8 . 1 1 41 41 SER C C 41 174.170 174.170 174.618 -0.448 25768 6581 1 8 . 1 1 41 41 SER CA C 41 59.000 59.000 58.926 0.074 25768 6582 1 8 . 1 1 41 41 SER CB C 41 64.420 64.420 64.091 0.329 25768 6583 1 8 . 1 1 41 41 SER H H 41 8.130 8.130 8.703 -0.573 25768 6584 1 8 . 1 1 42 42 ASP N N 42 122.430 122.430 121.867 0.563 25768 6585 1 8 . 1 1 42 42 ASP C C 42 175.740 175.740 174.471 1.269 25768 6586 1 8 . 1 1 42 42 ASP CA C 42 54.780 54.780 53.916 0.864 25768 6587 1 8 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.511 -0.891 25768 6588 1 8 . 1 1 42 42 ASP H H 42 8.410 8.410 8.249 0.161 25768 6589 1 8 . 1 1 43 43 THR N N 43 117.580 117.580 118.347 -0.767 25768 6590 1 8 . 1 1 43 43 THR C C 43 173.630 173.630 173.184 0.446 25768 6591 1 8 . 1 1 43 43 THR CA C 43 63.120 63.120 62.138 0.982 25768 6592 1 8 . 1 1 43 43 THR CB C 43 70.650 70.650 70.441 0.209 25768 6593 1 8 . 1 1 43 43 THR H H 43 8.010 8.010 8.417 -0.407 25768 6594 1 8 . 1 1 44 44 GLN N N 44 125.420 125.420 123.544 1.876 25768 6595 1 8 . 1 1 44 44 GLN C C 44 174.080 174.080 174.783 -0.703 25768 6596 1 8 . 1 1 44 44 GLN CA C 44 55.110 55.110 54.174 0.936 25768 6597 1 8 . 1 1 44 44 GLN CB C 44 31.570 31.570 30.402 1.168 25768 6598 1 8 . 1 1 44 44 GLN H H 44 9.260 9.260 8.111 1.149 25768 6599 1 8 . 1 1 45 45 LEU N N 45 124.190 124.190 126.862 -2.672 25768 6600 1 8 . 1 1 45 45 LEU C C 45 175.970 175.970 176.587 -0.617 25768 6601 1 8 . 1 1 45 45 LEU CA C 45 54.690 54.690 54.580 0.110 25768 6602 1 8 . 1 1 45 45 LEU CB C 45 42.270 42.270 42.726 -0.456 25768 6603 1 8 . 1 1 45 45 LEU H H 45 8.550 8.550 8.169 0.381 25768 6604 1 8 . 1 1 46 46 GLY N N 46 113.310 113.310 113.900 -0.590 25768 6605 1 8 . 1 1 46 46 GLY C C 46 171.180 171.180 173.304 -2.124 25768 6606 1 8 . 1 1 46 46 GLY CA C 46 44.400 44.400 44.628 -0.228 25768 6607 1 8 . 1 1 46 46 GLY H H 46 8.810 8.810 8.411 0.399 25768 6608 1 8 . 1 1 47 47 LEU N N 47 123.890 123.890 129.221 -5.331 25768 6609 1 8 . 1 1 47 47 LEU C C 47 175.400 175.400 175.484 -0.084 25768 6610 1 8 . 1 1 47 47 LEU CA C 47 53.750 53.750 54.446 -0.696 25768 6611 1 8 . 1 1 47 47 LEU CB C 47 46.800 46.800 43.827 2.973 25768 6612 1 8 . 1 1 47 47 LEU H H 47 8.590 8.590 8.967 -0.377 25768 6613 1 8 . 1 1 48 48 THR N N 48 111.210 111.210 114.024 -2.814 25768 6614 1 8 . 1 1 48 48 THR C C 48 172.520 172.520 172.771 -0.251 25768 6615 1 8 . 1 1 48 48 THR CA C 48 58.950 58.950 59.666 -0.716 25768 6616 1 8 . 1 1 48 48 THR CB C 48 72.360 72.360 71.818 0.542 25768 6617 1 8 . 1 1 48 48 THR H H 48 8.620 8.620 8.409 0.211 25768 6618 1 8 . 1 1 49 49 PHE N N 49 118.810 118.810 121.198 -2.388 25768 6619 1 8 . 1 1 49 49 PHE C C 49 174.700 174.700 175.170 -0.470 25768 6620 1 8 . 1 1 49 49 PHE CA C 49 55.080 55.080 56.403 -1.323 25768 6621 1 8 . 1 1 49 49 PHE CB C 49 42.360 42.360 42.909 -0.549 25768 6622 1 8 . 1 1 49 49 PHE H H 49 8.410 8.410 8.077 0.333 25768 6623 1 8 . 1 1 50 50 THR N N 50 121.230 121.230 119.296 1.934 25768 6624 1 8 . 1 1 50 50 THR C C 50 173.250 173.250 173.896 -0.646 25768 6625 1 8 . 1 1 50 50 THR CA C 50 62.740 62.740 60.209 2.531 25768 6626 1 8 . 1 1 50 50 THR CB C 50 73.740 73.740 69.453 4.287 25768 6627 1 8 . 1 1 50 50 THR H H 50 9.330 9.330 9.234 0.096 25768 6628 1 8 . 1 1 51 51 TYR N N 51 126.010 126.010 127.149 -1.139 25768 6629 1 8 . 1 1 51 51 TYR C C 51 174.850 174.850 175.584 -0.734 25768 6630 1 8 . 1 1 51 51 TYR CA C 51 56.240 56.240 55.079 1.161 25768 6631 1 8 . 1 1 51 51 TYR CB C 51 41.630 41.630 38.137 3.493 25768 6632 1 8 . 1 1 51 51 TYR H H 51 9.150 9.150 8.705 0.445 25768 6633 1 8 . 1 1 52 52 MET N N 52 127.390 127.390 123.723 3.667 25768 6634 1 8 . 1 1 52 52 MET C C 52 174.490 174.490 174.420 0.070 25768 6635 1 8 . 1 1 52 52 MET CA C 52 52.450 52.450 56.589 -4.139 25768 6636 1 8 . 1 1 52 52 MET CB C 52 28.590 28.590 33.270 -4.680 25768 6637 1 8 . 1 1 52 52 MET H H 52 7.950 7.950 8.784 -0.834 25768 6638 1 8 . 1 1 53 53 PHE N N 53 123.830 123.830 126.918 -3.088 25768 6639 1 8 . 1 1 53 53 PHE C C 53 173.720 173.720 173.518 0.202 25768 6640 1 8 . 1 1 53 53 PHE CA C 53 57.110 57.110 56.372 0.738 25768 6641 1 8 . 1 1 53 53 PHE CB C 53 39.420 39.420 40.866 -1.446 25768 6642 1 8 . 1 1 53 53 PHE H H 53 7.720 7.720 8.461 -0.741 25768 6643 1 8 . 1 1 54 54 ALA N N 54 125.650 125.650 128.471 -2.821 25768 6644 1 8 . 1 1 54 54 ALA C C 54 175.020 175.020 175.305 -0.285 25768 6645 1 8 . 1 1 54 54 ALA CA C 54 50.740 50.740 52.919 -2.179 25768 6646 1 8 . 1 1 54 54 ALA CB C 54 22.700 22.700 18.386 4.314 25768 6647 1 8 . 1 1 54 54 ALA H H 54 8.360 8.360 8.040 0.320 25768 6648 1 8 . 1 1 55 55 ASP N N 55 118.790 118.790 120.821 -2.031 25768 6649 1 8 . 1 1 55 55 ASP C C 55 174.780 174.780 175.814 -1.034 25768 6650 1 8 . 1 1 55 55 ASP CA C 55 58.590 58.590 54.752 3.837 25768 6651 1 8 . 1 1 55 55 ASP CB C 55 40.430 40.430 40.295 0.135 25768 6652 1 8 . 1 1 55 55 ASP H H 55 8.590 8.590 8.471 0.119 25768 6653 1 8 . 1 1 56 56 LYS N N 56 106.200 106.200 117.601 -11.401 25768 6654 1 8 . 1 1 56 56 LYS C C 56 174.940 174.940 174.673 0.267 25768 6655 1 8 . 1 1 56 56 LYS CA C 56 55.260 55.260 56.664 -1.404 25768 6656 1 8 . 1 1 56 56 LYS CB C 56 34.510 34.510 35.237 -0.727 25768 6657 1 8 . 1 1 56 56 LYS H H 56 7.260 7.260 7.348 -0.088 25768 6658 1 8 . 1 1 57 57 TRP N N 57 115.680 115.680 120.365 -4.685 25768 6659 1 8 . 1 1 57 57 TRP C C 57 173.940 173.940 175.197 -1.257 25768 6660 1 8 . 1 1 57 57 TRP CA C 57 55.410 55.410 56.989 -1.579 25768 6661 1 8 . 1 1 57 57 TRP CB C 57 34.470 34.470 31.816 2.654 25768 6662 1 8 . 1 1 57 57 TRP H H 57 6.570 6.570 8.157 -1.587 25768 6663 1 8 . 1 1 58 58 GLY N N 58 107.610 107.610 108.572 -0.962 25768 6664 1 8 . 1 1 58 58 GLY C C 58 172.730 172.730 172.526 0.204 25768 6665 1 8 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.039 0.011 25768 6666 1 8 . 1 1 58 58 GLY H H 58 9.260 9.260 8.656 0.604 25768 6667 1 8 . 1 1 59 59 VAL N N 59 118.130 118.130 124.192 -6.062 25768 6668 1 8 . 1 1 59 59 VAL C C 59 173.000 173.000 174.238 -1.238 25768 6669 1 8 . 1 1 59 59 VAL CA C 59 59.950 59.950 61.155 -1.205 25768 6670 1 8 . 1 1 59 59 VAL CB C 59 35.170 35.170 33.996 1.174 25768 6671 1 8 . 1 1 59 59 VAL H H 59 9.030 9.030 8.808 0.222 25768 6672 1 8 . 1 1 60 60 GLU N N 60 127.900 127.900 126.164 1.736 25768 6673 1 8 . 1 1 60 60 GLU C C 60 174.470 174.470 174.452 0.018 25768 6674 1 8 . 1 1 60 60 GLU CA C 60 52.940 52.940 54.930 -1.990 25768 6675 1 8 . 1 1 60 60 GLU CB C 60 35.100 35.100 33.642 1.458 25768 6676 1 8 . 1 1 60 60 GLU H H 60 9.440 9.440 8.666 0.774 25768 6677 1 8 . 1 1 61 61 LEU N N 61 127.410 127.410 125.806 1.604 25768 6678 1 8 . 1 1 61 61 LEU C C 61 174.950 174.950 175.741 -0.791 25768 6679 1 8 . 1 1 61 61 LEU CA C 61 53.390 53.390 53.973 -0.583 25768 6680 1 8 . 1 1 61 61 LEU CB C 61 45.980 45.980 44.215 1.765 25768 6681 1 8 . 1 1 61 61 LEU H H 61 8.740 8.740 8.478 0.262 25768 6682 1 8 . 1 1 62 62 VAL N N 62 125.750 125.750 115.596 10.154 25768 6683 1 8 . 1 1 62 62 VAL C C 62 173.960 173.960 174.285 -0.325 25768 6684 1 8 . 1 1 62 62 VAL CA C 62 61.350 61.350 59.858 1.492 25768 6685 1 8 . 1 1 62 62 VAL CB C 62 34.740 34.740 35.026 -0.286 25768 6686 1 8 . 1 1 62 62 VAL H H 62 8.790 8.790 7.910 0.880 25768 6687 1 8 . 1 1 63 63 ALA N N 63 127.230 127.230 125.044 2.186 25768 6688 1 8 . 1 1 63 63 ALA C C 63 173.930 173.930 175.302 -1.372 25768 6689 1 8 . 1 1 63 63 ALA CA C 63 51.140 51.140 52.412 -1.272 25768 6690 1 8 . 1 1 63 63 ALA CB C 63 22.500 22.500 21.183 1.317 25768 6691 1 8 . 1 1 63 63 ALA H H 63 8.740 8.740 7.890 0.850 25768 6692 1 8 . 1 1 64 64 ALA N N 64 120.410 120.410 124.722 -4.312 25768 6693 1 8 . 1 1 64 64 ALA C C 64 176.770 176.770 177.132 -0.362 25768 6694 1 8 . 1 1 64 64 ALA CA C 64 51.420 51.420 50.605 0.815 25768 6695 1 8 . 1 1 64 64 ALA CB C 64 22.590 22.590 21.253 1.337 25768 6696 1 8 . 1 1 64 64 ALA H H 64 8.290 8.290 8.283 0.007 25768 6697 1 8 . 1 1 65 65 THR N N 65 116.130 116.130 113.576 2.554 25768 6698 1 8 . 1 1 65 65 THR C C 65 171.220 171.220 173.048 -1.828 25768 6699 1 8 . 1 1 65 65 THR CA C 65 58.860 58.860 59.838 -0.978 25768 6700 1 8 . 1 1 65 65 THR CB C 65 72.020 72.020 68.922 3.098 25768 6701 1 8 . 1 1 65 65 THR H H 65 8.760 8.760 8.153 0.607 25768 6702 1 8 . 1 1 66 66 PRO C C 66 176.720 176.720 175.511 1.209 25768 6703 1 8 . 1 1 66 66 PRO CA C 66 63.610 63.610 62.732 0.878 25768 6704 1 8 . 1 1 66 66 PRO CB C 66 32.550 32.550 32.323 0.227 25768 6705 1 8 . 1 1 67 67 PHE N N 67 120.360 120.360 117.770 2.590 25768 6706 1 8 . 1 1 67 67 PHE C C 67 175.480 175.480 174.987 0.493 25768 6707 1 8 . 1 1 67 67 PHE CA C 67 58.840 58.840 58.789 0.051 25768 6708 1 8 . 1 1 67 67 PHE CB C 67 40.170 40.170 40.227 -0.057 25768 6709 1 8 . 1 1 67 67 PHE H H 67 8.590 8.590 8.305 0.285 25768 6710 1 8 . 1 1 68 68 ASN N N 68 119.030 119.030 116.354 2.676 25768 6711 1 8 . 1 1 68 68 ASN C C 68 174.740 174.740 173.068 1.672 25768 6712 1 8 . 1 1 68 68 ASN CA C 68 53.430 53.430 52.922 0.508 25768 6713 1 8 . 1 1 68 68 ASN CB C 68 39.420 39.420 41.000 -1.580 25768 6714 1 8 . 1 1 68 68 ASN H H 68 8.340 8.340 8.249 0.091 25768 6715 1 8 . 1 1 69 69 HIS N N 69 119.590 119.590 117.493 2.097 25768 6716 1 8 . 1 1 69 69 HIS C C 69 174.370 174.370 173.705 0.665 25768 6717 1 8 . 1 1 69 69 HIS CA C 69 55.950 55.950 56.760 -0.810 25768 6718 1 8 . 1 1 69 69 HIS CB C 69 29.960 29.960 31.809 -1.849 25768 6719 1 8 . 1 1 69 69 HIS H H 69 8.350 8.350 8.455 -0.105 25768 6720 1 8 . 1 1 70 70 GLN N N 70 121.980 121.980 127.380 -5.400 25768 6721 1 8 . 1 1 70 70 GLN C C 70 175.740 175.740 175.654 0.086 25768 6722 1 8 . 1 1 70 70 GLN CA C 70 56.340 56.340 55.093 1.247 25768 6723 1 8 . 1 1 70 70 GLN CB C 70 29.660 29.660 29.293 0.367 25768 6724 1 8 . 1 1 70 70 GLN H H 70 8.350 8.350 8.618 -0.268 25768 6725 1 8 . 1 1 71 71 VAL N N 71 120.530 120.530 119.220 1.310 25768 6726 1 8 . 1 1 71 71 VAL C C 71 175.500 175.500 175.514 -0.014 25768 6727 1 8 . 1 1 71 71 VAL CA C 71 62.540 62.540 65.415 -2.875 25768 6728 1 8 . 1 1 71 71 VAL CB C 71 33.090 33.090 30.708 2.382 25768 6729 1 8 . 1 1 71 71 VAL H H 71 8.020 8.020 8.241 -0.221 25768 6730 1 8 . 1 1 72 72 ASP N N 72 123.910 123.910 121.016 2.894 25768 6731 1 8 . 1 1 72 72 ASP C C 72 176.300 176.300 176.077 0.223 25768 6732 1 8 . 1 1 72 72 ASP CA C 72 54.340 54.340 53.911 0.429 25768 6733 1 8 . 1 1 72 72 ASP CB C 72 41.480 41.480 39.740 1.740 25768 6734 1 8 . 1 1 72 72 ASP H H 72 8.280 8.280 8.112 0.168 25768 6735 1 8 . 1 1 73 73 VAL N N 73 120.580 120.580 119.327 1.253 25768 6736 1 8 . 1 1 73 73 VAL C C 73 176.350 176.350 175.755 0.595 25768 6737 1 8 . 1 1 73 73 VAL CA C 73 62.970 62.970 62.614 0.356 25768 6738 1 8 . 1 1 73 73 VAL CB C 73 32.550 32.550 32.703 -0.153 25768 6739 1 8 . 1 1 73 73 VAL H H 73 7.960 7.960 7.560 0.400 25768 6740 1 8 . 1 1 74 74 LYS N N 74 123.620 123.620 123.111 0.509 25768 6741 1 8 . 1 1 74 74 LYS C C 74 177.130 177.130 175.746 1.384 25768 6742 1 8 . 1 1 74 74 LYS CA C 74 57.060 57.060 56.579 0.481 25768 6743 1 8 . 1 1 74 74 LYS CB C 74 32.860 32.860 32.501 0.360 25768 6744 1 8 . 1 1 74 74 LYS H H 74 8.230 8.230 8.222 0.008 25768 6745 1 8 . 1 1 75 75 GLY N N 75 109.370 109.370 109.504 -0.134 25768 6746 1 8 . 1 1 75 75 GLY C C 75 174.030 174.030 173.387 0.643 25768 6747 1 8 . 1 1 75 75 GLY CA C 75 45.800 45.800 45.405 0.395 25768 6748 1 8 . 1 1 75 75 GLY H H 75 8.160 8.160 8.192 -0.032 25768 6749 1 8 . 1 1 76 76 LEU N N 76 121.660 121.660 123.480 -1.820 25768 6750 1 8 . 1 1 76 76 LEU C C 76 177.410 177.410 177.774 -0.364 25768 6751 1 8 . 1 1 76 76 LEU CA C 76 55.410 55.410 54.844 0.566 25768 6752 1 8 . 1 1 76 76 LEU CB C 76 42.790 42.790 43.290 -0.500 25768 6753 1 8 . 1 1 76 76 LEU H H 76 8.030 8.030 8.127 -0.097 25768 6754 1 8 . 1 1 77 77 GLY N N 77 109.330 109.330 111.126 -1.796 25768 6755 1 8 . 1 1 77 77 GLY C C 77 171.800 171.800 172.868 -1.068 25768 6756 1 8 . 1 1 77 77 GLY CA C 77 44.990 44.990 44.249 0.741 25768 6757 1 8 . 1 1 77 77 GLY H H 77 8.100 8.100 8.446 -0.346 25768 6758 1 8 . 1 1 78 78 PRO C C 78 177.740 177.740 177.294 0.446 25768 6759 1 8 . 1 1 78 78 PRO CA C 78 63.890 63.890 62.701 1.189 25768 6760 1 8 . 1 1 78 78 PRO CB C 78 32.170 32.170 31.890 0.280 25768 6761 1 8 . 1 1 79 79 GLY N N 79 109.530 109.530 111.959 -2.429 25768 6762 1 8 . 1 1 79 79 GLY C C 79 174.460 174.460 174.090 0.370 25768 6763 1 8 . 1 1 79 79 GLY CA C 79 45.780 45.780 44.867 0.913 25768 6764 1 8 . 1 1 79 79 GLY H H 79 8.410 8.410 8.733 -0.323 25768 6765 1 8 . 1 1 80 80 LEU N N 80 121.880 121.880 121.600 0.280 25768 6766 1 8 . 1 1 80 80 LEU C C 80 177.100 177.100 176.647 0.453 25768 6767 1 8 . 1 1 80 80 LEU CA C 80 55.720 55.720 55.360 0.360 25768 6768 1 8 . 1 1 80 80 LEU CB C 80 42.580 42.580 42.797 -0.217 25768 6769 1 8 . 1 1 80 80 LEU H H 80 8.010 8.010 8.092 -0.082 25768 6770 1 8 . 1 1 81 81 ASP N N 81 119.990 119.990 119.042 0.948 25768 6771 1 8 . 1 1 81 81 ASP C C 81 176.880 176.880 175.941 0.939 25768 6772 1 8 . 1 1 81 81 ASP CA C 81 54.770 54.770 53.938 0.832 25768 6773 1 8 . 1 1 81 81 ASP CB C 81 41.390 41.390 42.231 -0.841 25768 6774 1 8 . 1 1 81 81 ASP H H 81 8.220 8.220 8.227 -0.007 25768 6775 1 8 . 1 1 82 82 GLY N N 82 109.270 109.270 113.194 -3.924 25768 6776 1 8 . 1 1 82 82 GLY C C 82 174.190 174.190 173.862 0.328 25768 6777 1 8 . 1 1 82 82 GLY CA C 82 45.990 45.990 45.200 0.790 25768 6778 1 8 . 1 1 82 82 GLY H H 82 8.170 8.170 8.267 -0.097 25768 6779 1 8 . 1 1 83 83 LYS N N 83 121.000 121.000 121.738 -0.738 25768 6780 1 8 . 1 1 83 83 LYS C C 83 176.610 176.610 176.628 -0.018 25768 6781 1 8 . 1 1 83 83 LYS CA C 83 56.620 56.620 56.419 0.201 25768 6782 1 8 . 1 1 83 83 LYS CB C 83 33.020 33.020 32.873 0.147 25768 6783 1 8 . 1 1 83 83 LYS H H 83 7.970 7.970 8.182 -0.212 25768 6784 1 8 . 1 1 84 84 LEU N N 84 123.120 123.120 116.191 6.929 25768 6785 1 8 . 1 1 84 84 LEU C C 84 176.920 176.920 176.240 0.680 25768 6786 1 8 . 1 1 84 84 LEU CA C 84 55.550 55.550 55.020 0.530 25768 6787 1 8 . 1 1 84 84 LEU CB C 84 42.430 42.430 40.107 2.323 25768 6788 1 8 . 1 1 84 84 LEU H H 84 8.130 8.130 8.351 -0.221 25768 6789 1 8 . 1 1 85 85 ALA N N 85 123.930 123.930 121.981 1.949 25768 6790 1 8 . 1 1 85 85 ALA C C 85 177.060 177.060 176.929 0.131 25768 6791 1 8 . 1 1 85 85 ALA CA C 85 52.790 52.790 51.462 1.328 25768 6792 1 8 . 1 1 85 85 ALA CB C 85 19.670 19.670 18.764 0.906 25768 6793 1 8 . 1 1 85 85 ALA H H 85 8.040 8.040 7.796 0.244 25768 6794 1 8 . 1 1 86 86 ASP N N 86 119.760 119.760 125.865 -6.105 25768 6795 1 8 . 1 1 86 86 ASP C C 86 175.820 175.820 176.496 -0.676 25768 6796 1 8 . 1 1 86 86 ASP CA C 86 54.520 54.520 53.647 0.873 25768 6797 1 8 . 1 1 86 86 ASP CB C 86 41.390 41.390 40.642 0.748 25768 6798 1 8 . 1 1 86 86 ASP H H 86 8.110 8.110 8.746 -0.636 25768 6799 1 8 . 1 1 87 87 ILE N N 87 120.620 120.620 118.354 2.266 25768 6800 1 8 . 1 1 87 87 ILE C C 87 175.740 175.740 175.803 -0.063 25768 6801 1 8 . 1 1 87 87 ILE CA C 87 61.160 61.160 63.533 -2.373 25768 6802 1 8 . 1 1 87 87 ILE CB C 87 39.260 39.260 37.449 1.811 25768 6803 1 8 . 1 1 87 87 ILE H H 87 7.800 7.800 7.397 0.403 25768 6804 1 8 . 1 1 88 88 LYS N N 88 125.820 125.820 120.733 5.087 25768 6805 1 8 . 1 1 88 88 LYS C C 88 175.340 175.340 175.034 0.306 25768 6806 1 8 . 1 1 88 88 LYS CA C 88 56.300 56.300 55.854 0.446 25768 6807 1 8 . 1 1 88 88 LYS CB C 88 32.900 32.900 33.682 -0.782 25768 6808 1 8 . 1 1 88 88 LYS H H 88 8.250 8.250 8.141 0.109 25768 6809 1 8 . 1 1 89 89 GLN N N 89 121.750 121.750 123.011 -1.261 25768 6810 1 8 . 1 1 89 89 GLN C C 89 175.000 175.000 174.699 0.301 25768 6811 1 8 . 1 1 89 89 GLN CA C 89 55.210 55.210 55.471 -0.261 25768 6812 1 8 . 1 1 89 89 GLN CB C 89 30.570 30.570 28.928 1.642 25768 6813 1 8 . 1 1 89 89 GLN H H 89 8.000 8.000 8.465 -0.465 25768 6814 1 8 . 1 1 90 90 LEU N N 90 126.660 126.660 126.032 0.628 25768 6815 1 8 . 1 1 90 90 LEU C C 90 174.240 174.240 175.371 -1.131 25768 6816 1 8 . 1 1 90 90 LEU CA C 90 52.720 52.720 53.134 -0.414 25768 6817 1 8 . 1 1 90 90 LEU CB C 90 42.350 42.350 42.661 -0.311 25768 6818 1 8 . 1 1 90 90 LEU H H 90 8.630 8.630 8.210 0.420 25768 6819 1 8 . 1 1 92 92 PRO C C 92 173.900 173.900 176.803 -2.903 25768 6820 1 8 . 1 1 92 92 PRO CA C 92 63.320 63.320 62.404 0.916 25768 6821 1 8 . 1 1 92 92 PRO CB C 92 31.920 31.920 33.002 -1.083 25768 6822 1 8 . 1 1 93 93 THR N N 93 119.770 119.770 118.216 1.554 25768 6823 1 8 . 1 1 93 93 THR C C 93 171.360 171.360 173.447 -2.087 25768 6824 1 8 . 1 1 93 93 THR CA C 93 62.610 62.610 62.331 0.279 25768 6825 1 8 . 1 1 93 93 THR CB C 93 72.680 72.680 70.694 1.986 25768 6826 1 8 . 1 1 93 93 THR H H 93 8.290 8.290 8.372 -0.082 25768 6827 1 8 . 1 1 94 94 LEU N N 94 128.880 128.880 128.325 0.555 25768 6828 1 8 . 1 1 94 94 LEU C C 94 175.130 175.130 174.404 0.726 25768 6829 1 8 . 1 1 94 94 LEU CA C 94 53.520 53.520 54.462 -0.942 25768 6830 1 8 . 1 1 94 94 LEU CB C 94 46.140 46.140 44.487 1.653 25768 6831 1 8 . 1 1 94 94 LEU H H 94 8.680 8.680 8.412 0.268 25768 6832 1 8 . 1 1 95 95 LEU N N 95 123.630 123.630 125.275 -1.645 25768 6833 1 8 . 1 1 95 95 LEU C C 95 175.540 175.540 174.242 1.298 25768 6834 1 8 . 1 1 95 95 LEU CA C 95 55.190 55.190 54.148 1.042 25768 6835 1 8 . 1 1 95 95 LEU CB C 95 45.300 45.300 46.513 -1.213 25768 6836 1 8 . 1 1 95 95 LEU H H 95 9.580 9.580 8.082 1.498 25768 6837 1 8 . 1 1 96 96 LEU N N 96 123.150 123.150 122.986 0.164 25768 6838 1 8 . 1 1 96 96 LEU C C 96 174.960 174.960 174.408 0.552 25768 6839 1 8 . 1 1 96 96 LEU CA C 96 54.420 54.420 54.014 0.406 25768 6840 1 8 . 1 1 96 96 LEU CB C 96 44.560 44.560 46.898 -2.338 25768 6841 1 8 . 1 1 96 96 LEU H H 96 8.770 8.770 9.164 -0.394 25768 6842 1 8 . 1 1 97 97 GLN N N 97 121.290 121.290 119.765 1.525 25768 6843 1 8 . 1 1 97 97 GLN C C 97 174.380 174.380 173.766 0.614 25768 6844 1 8 . 1 1 97 97 GLN CA C 97 54.740 54.740 53.760 0.980 25768 6845 1 8 . 1 1 97 97 GLN CB C 97 36.600 36.600 32.261 4.339 25768 6846 1 8 . 1 1 97 97 GLN H H 97 9.480 9.480 9.111 0.369 25768 6847 1 8 . 1 1 98 98 TYR N N 98 122.250 122.250 120.766 1.484 25768 6848 1 8 . 1 1 98 98 TYR C C 98 173.460 173.460 174.760 -1.300 25768 6849 1 8 . 1 1 98 98 TYR CA C 98 55.160 55.160 56.786 -1.626 25768 6850 1 8 . 1 1 98 98 TYR CB C 98 42.420 42.420 42.424 -0.004 25768 6851 1 8 . 1 1 98 98 TYR H H 98 9.010 9.010 7.740 1.270 25768 6852 1 8 . 1 1 99 99 TYR N N 99 126.860 126.860 124.612 2.248 25768 6853 1 8 . 1 1 99 99 TYR C C 99 175.380 175.380 174.531 0.849 25768 6854 1 8 . 1 1 99 99 TYR CA C 99 54.220 54.220 54.301 -0.081 25768 6855 1 8 . 1 1 99 99 TYR CB C 99 38.890 38.890 38.089 0.801 25768 6856 1 8 . 1 1 99 99 TYR H H 99 8.300 8.300 7.731 0.569 25768 6857 1 8 . 1 1 100 100 PRO C C 100 178.330 178.330 176.995 1.335 25768 6858 1 8 . 1 1 100 100 PRO CA C 100 64.750 64.750 65.172 -0.422 25768 6859 1 8 . 1 1 100 100 PRO CB C 100 32.130 32.130 32.108 0.022 25768 6860 1 8 . 1 1 101 101 MET N N 101 114.520 114.520 117.942 -3.422 25768 6861 1 8 . 1 1 101 101 MET C C 101 178.240 178.240 175.212 3.028 25768 6862 1 8 . 1 1 101 101 MET CA C 101 53.500 53.500 54.195 -0.695 25768 6863 1 8 . 1 1 101 101 MET CB C 101 30.160 30.160 33.343 -3.183 25768 6864 1 8 . 1 1 101 101 MET H H 101 9.390 9.390 7.740 1.650 25768 6865 1 8 . 1 1 102 102 GLY N N 102 117.500 117.500 108.032 9.468 25768 6866 1 8 . 1 1 102 102 GLY C C 102 175.690 175.690 174.394 1.296 25768 6867 1 8 . 1 1 102 102 GLY CA C 102 46.760 46.760 44.319 2.441 25768 6868 1 8 . 1 1 102 102 GLY H H 102 8.640 8.640 7.803 0.837 25768 6869 1 8 . 1 1 103 103 GLY N N 103 111.030 111.030 111.772 -0.742 25768 6870 1 8 . 1 1 103 103 GLY C C 103 174.070 174.070 173.508 0.562 25768 6871 1 8 . 1 1 103 103 GLY CA C 103 46.140 46.140 44.884 1.256 25768 6872 1 8 . 1 1 103 103 GLY H H 103 9.390 9.390 8.380 1.010 25768 6873 1 8 . 1 1 104 104 THR N N 104 109.290 109.290 112.519 -3.229 25768 6874 1 8 . 1 1 104 104 THR C C 104 174.290 174.290 173.807 0.483 25768 6875 1 8 . 1 1 104 104 THR CA C 104 60.900 60.900 60.567 0.333 25768 6876 1 8 . 1 1 104 104 THR CB C 104 72.070 72.070 70.815 1.255 25768 6877 1 8 . 1 1 104 104 THR H H 104 7.290 7.290 7.741 -0.451 25768 6878 1 8 . 1 1 105 105 ASN C C 105 175.050 175.050 174.496 0.554 25768 6879 1 8 . 1 1 105 105 ASN CA C 105 52.880 52.880 52.898 -0.018 25768 6880 1 8 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.871 -0.611 25768 6881 1 8 . 1 1 106 106 SER N N 106 113.000 113.000 114.910 -1.910 25768 6882 1 8 . 1 1 106 106 SER C C 106 176.000 176.000 174.788 1.212 25768 6883 1 8 . 1 1 106 106 SER CA C 106 58.700 58.700 57.863 0.837 25768 6884 1 8 . 1 1 106 106 SER CB C 106 64.540 64.540 64.377 0.163 25768 6885 1 8 . 1 1 106 106 SER H H 106 7.450 7.450 7.500 -0.050 25768 6886 1 8 . 1 1 107 107 ALA N N 107 132.220 132.220 126.470 5.750 25768 6887 1 8 . 1 1 107 107 ALA C C 107 176.610 176.610 178.248 -1.638 25768 6888 1 8 . 1 1 107 107 ALA CA C 107 54.380 54.380 53.927 0.453 25768 6889 1 8 . 1 1 107 107 ALA CB C 107 18.690 18.690 19.174 -0.484 25768 6890 1 8 . 1 1 107 107 ALA H H 107 8.870 8.870 8.754 0.116 25768 6891 1 8 . 1 1 108 108 PHE N N 108 116.050 116.050 121.682 -5.632 25768 6892 1 8 . 1 1 108 108 PHE C C 108 174.270 174.270 174.746 -0.476 25768 6893 1 8 . 1 1 108 108 PHE CA C 108 56.140 56.140 56.486 -0.346 25768 6894 1 8 . 1 1 108 108 PHE CB C 108 40.520 40.520 39.691 0.830 25768 6895 1 8 . 1 1 108 108 PHE H H 108 7.550 7.550 8.197 -0.647 25768 6896 1 8 . 1 1 109 109 GLN N N 109 128.260 128.260 126.453 1.807 25768 6897 1 8 . 1 1 109 109 GLN C C 109 172.300 172.300 173.643 -1.343 25768 6898 1 8 . 1 1 109 109 GLN CA C 109 52.310 52.310 52.668 -0.358 25768 6899 1 8 . 1 1 109 109 GLN CB C 109 29.050 29.050 29.815 -0.765 25768 6900 1 8 . 1 1 109 109 GLN H H 109 9.060 9.060 8.928 0.132 25768 6901 1 8 . 1 1 110 110 PRO C C 110 175.020 175.020 175.719 -0.699 25768 6902 1 8 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.262 -0.712 25768 6903 1 8 . 1 1 110 110 PRO CB C 110 33.280 33.280 32.408 0.872 25768 6904 1 8 . 1 1 111 111 TYR N N 111 115.730 115.730 111.853 3.877 25768 6905 1 8 . 1 1 111 111 TYR C C 111 173.850 173.850 173.671 0.179 25768 6906 1 8 . 1 1 111 111 TYR CA C 111 56.470 56.470 56.948 -0.478 25768 6907 1 8 . 1 1 111 111 TYR CB C 111 38.650 38.650 38.518 0.132 25768 6908 1 8 . 1 1 111 111 TYR H H 111 8.500 8.500 7.950 0.550 25768 6909 1 8 . 1 1 112 112 GLY N N 112 103.570 103.570 106.982 -3.412 25768 6910 1 8 . 1 1 112 112 GLY C C 112 172.020 172.020 173.452 -1.432 25768 6911 1 8 . 1 1 112 112 GLY CA C 112 43.950 43.950 43.528 0.422 25768 6912 1 8 . 1 1 112 112 GLY H H 112 8.110 8.110 8.599 -0.489 25768 6913 1 8 . 1 1 113 113 GLY N N 113 108.510 108.510 107.635 0.875 25768 6914 1 8 . 1 1 113 113 GLY C C 113 171.540 171.540 172.788 -1.248 25768 6915 1 8 . 1 1 113 113 GLY CA C 113 46.120 46.120 45.631 0.489 25768 6916 1 8 . 1 1 113 113 GLY H H 113 9.080 9.080 7.899 1.181 25768 6917 1 8 . 1 1 114 114 LEU N N 114 120.270 120.270 124.928 -4.658 25768 6918 1 8 . 1 1 114 114 LEU C C 114 175.810 175.810 176.277 -0.467 25768 6919 1 8 . 1 1 114 114 LEU CA C 114 53.920 53.920 53.548 0.372 25768 6920 1 8 . 1 1 114 114 LEU CB C 114 47.940 47.940 44.551 3.389 25768 6921 1 8 . 1 1 114 114 LEU H H 114 8.620 8.620 9.009 -0.389 25768 6922 1 8 . 1 1 115 115 GLY N N 115 110.620 110.620 111.059 -0.439 25768 6923 1 8 . 1 1 115 115 GLY C C 115 171.560 171.560 172.892 -1.332 25768 6924 1 8 . 1 1 115 115 GLY CA C 115 46.940 46.940 44.315 2.625 25768 6925 1 8 . 1 1 115 115 GLY H H 115 9.000 9.000 8.441 0.559 25768 6926 1 8 . 1 1 116 116 VAL N N 116 113.600 113.600 119.241 -5.641 25768 6927 1 8 . 1 1 116 116 VAL C C 116 174.120 174.120 173.810 0.310 25768 6928 1 8 . 1 1 116 116 VAL CA C 116 58.970 58.970 59.715 -0.745 25768 6929 1 8 . 1 1 116 116 VAL CB C 116 36.600 36.600 34.760 1.840 25768 6930 1 8 . 1 1 116 116 VAL H H 116 8.680 8.680 7.752 0.928 25768 6931 1 8 . 1 1 117 117 ASN N N 117 120.020 120.020 122.998 -2.978 25768 6932 1 8 . 1 1 117 117 ASN CA C 117 52.190 52.190 54.358 -2.168 25768 6933 1 8 . 1 1 117 117 ASN CB C 117 42.450 42.450 40.373 2.078 25768 6934 1 8 . 1 1 117 117 ASN H H 117 8.840 8.840 8.750 0.090 25768 6935 1 8 . 1 1 119 119 THR C C 119 174.350 174.350 175.073 -0.723 25768 6936 1 8 . 1 1 119 119 THR CA C 119 63.140 63.140 62.694 0.446 25768 6937 1 8 . 1 1 119 119 THR CB C 119 70.170 70.170 69.325 0.845 25768 6938 1 8 . 1 1 120 120 THR N N 120 114.120 114.120 118.152 -4.032 25768 6939 1 8 . 1 1 120 120 THR C C 120 174.220 174.220 173.826 0.394 25768 6940 1 8 . 1 1 120 120 THR CA C 120 61.900 61.900 62.840 -0.940 25768 6941 1 8 . 1 1 120 120 THR CB C 120 70.140 70.140 69.120 1.020 25768 6942 1 8 . 1 1 120 120 THR H H 120 7.570 7.570 8.337 -0.767 25768 6943 1 8 . 1 1 121 121 PHE N N 121 121.230 121.230 119.811 1.419 25768 6944 1 8 . 1 1 121 121 PHE C C 121 174.910 174.910 172.806 2.104 25768 6945 1 8 . 1 1 121 121 PHE CA C 121 58.720 58.720 57.030 1.690 25768 6946 1 8 . 1 1 121 121 PHE CB C 121 40.470 40.470 40.919 -0.449 25768 6947 1 8 . 1 1 121 121 PHE H H 121 7.830 7.830 7.395 0.435 25768 6948 1 8 . 1 1 122 122 PHE C C 122 175.070 175.070 174.872 0.198 25768 6949 1 8 . 1 1 122 122 PHE CA C 122 57.890 57.890 56.909 0.981 25768 6950 1 8 . 1 1 122 122 PHE CB C 122 39.870 39.870 40.639 -0.769 25768 6951 1 8 . 1 1 123 123 ASP N N 123 122.170 122.170 122.652 -0.482 25768 6952 1 8 . 1 1 123 123 ASP C C 123 176.150 176.150 176.081 0.069 25768 6953 1 8 . 1 1 123 123 ASP CA C 123 54.530 54.530 54.098 0.432 25768 6954 1 8 . 1 1 123 123 ASP CB C 123 41.830 41.830 41.428 0.402 25768 6955 1 8 . 1 1 123 123 ASP H H 123 7.950 7.950 8.597 -0.647 25768 6956 1 8 . 1 1 124 124 GLU N N 124 122.690 122.690 124.491 -1.801 25768 6957 1 8 . 1 1 124 124 GLU C C 124 176.630 176.630 177.303 -0.673 25768 6958 1 8 . 1 1 124 124 GLU CA C 124 57.620 57.620 57.667 -0.047 25768 6959 1 8 . 1 1 124 124 GLU CB C 124 30.450 30.450 31.015 -0.565 25768 6960 1 8 . 1 1 124 124 GLU H H 124 8.340 8.340 8.889 -0.549 25768 6961 1 8 . 1 1 125 125 ASP N N 125 121.280 121.280 120.903 0.377 25768 6962 1 8 . 1 1 125 125 ASP C C 125 176.940 176.940 178.124 -1.184 25768 6963 1 8 . 1 1 125 125 ASP CA C 125 55.180 55.180 57.017 -1.837 25768 6964 1 8 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.628 0.592 25768 6965 1 8 . 1 1 125 125 ASP H H 125 8.310 8.310 8.684 -0.374 25768 6966 1 8 . 1 1 126 126 LEU N N 126 122.830 122.830 119.312 3.518 25768 6967 1 8 . 1 1 126 126 LEU C C 126 178.020 178.020 178.682 -0.662 25768 6968 1 8 . 1 1 126 126 LEU CA C 126 56.450 56.450 57.046 -0.596 25768 6969 1 8 . 1 1 126 126 LEU CB C 126 42.150 42.150 42.219 -0.069 25768 6970 1 8 . 1 1 126 126 LEU H H 126 8.010 8.010 8.000 0.010 25768 6971 1 8 . 1 1 127 127 ALA N N 127 122.660 122.660 121.348 1.312 25768 6972 1 8 . 1 1 127 127 ALA C C 127 178.600 178.600 178.286 0.314 25768 6973 1 8 . 1 1 127 127 ALA CA C 127 53.780 53.780 54.320 -0.540 25768 6974 1 8 . 1 1 127 127 ALA CB C 127 19.000 19.000 18.907 0.093 25768 6975 1 8 . 1 1 127 127 ALA H H 127 8.100 8.100 7.911 0.189 25768 6976 1 8 . 1 1 128 128 SER N N 128 113.740 113.740 113.283 0.457 25768 6977 1 8 . 1 1 128 128 SER C C 128 175.010 175.010 173.143 1.867 25768 6978 1 8 . 1 1 128 128 SER CA C 128 59.580 59.580 58.037 1.543 25768 6979 1 8 . 1 1 128 128 SER CB C 128 63.800 63.800 63.290 0.510 25768 6980 1 8 . 1 1 128 128 SER H H 128 7.920 7.920 8.061 -0.141 25768 6981 1 8 . 1 1 129 129 ASN N N 129 120.300 120.300 119.000 1.300 25768 6982 1 8 . 1 1 129 129 ASN C C 129 175.590 175.590 173.280 2.310 25768 6983 1 8 . 1 1 129 129 ASN CA C 129 54.180 54.180 53.643 0.537 25768 6984 1 8 . 1 1 129 129 ASN CB C 129 38.900 38.900 40.706 -1.806 25768 6985 1 8 . 1 1 129 129 ASN H H 129 8.120 8.120 7.481 0.639 25768 6986 1 8 . 1 1 130 130 ARG N N 130 120.630 120.630 120.770 -0.140 25768 6987 1 8 . 1 1 130 130 ARG C C 130 176.720 176.720 174.647 2.073 25768 6988 1 8 . 1 1 130 130 ARG CA C 130 57.240 57.240 57.072 0.168 25768 6989 1 8 . 1 1 130 130 ARG CB C 130 30.500 30.500 29.965 0.535 25768 6990 1 8 . 1 1 130 130 ARG H H 130 8.050 8.050 8.716 -0.666 25768 6991 1 8 . 1 1 131 131 LYS N N 131 121.150 121.150 124.817 -3.667 25768 6992 1 8 . 1 1 131 131 LYS C C 131 176.750 176.750 175.423 1.327 25768 6993 1 8 . 1 1 131 131 LYS CA C 131 57.050 57.050 56.477 0.573 25768 6994 1 8 . 1 1 131 131 LYS CB C 131 32.870 32.870 32.053 0.817 25768 6995 1 8 . 1 1 131 131 LYS H H 131 8.020 8.020 8.491 -0.471 25768 6996 1 8 . 1 1 132 132 ALA N N 132 124.110 124.110 125.297 -1.187 25768 6997 1 8 . 1 1 132 132 ALA C C 132 177.680 177.680 175.807 1.873 25768 6998 1 8 . 1 1 132 132 ALA CA C 132 53.070 53.070 52.046 1.024 25768 6999 1 8 . 1 1 132 132 ALA CB C 132 19.250 19.250 20.484 -1.234 25768 7000 1 8 . 1 1 132 132 ALA H H 132 8.010 8.010 8.262 -0.252 25768 7001 1 8 . 1 1 133 133 GLN N N 133 118.830 118.830 120.831 -2.001 25768 7002 1 8 . 1 1 133 133 GLN C C 133 176.380 176.380 175.148 1.232 25768 7003 1 8 . 1 1 133 133 GLN CA C 133 56.400 56.400 55.737 0.663 25768 7004 1 8 . 1 1 133 133 GLN CB C 133 29.670 29.670 30.437 -0.767 25768 7005 1 8 . 1 1 133 133 GLN H H 133 8.070 8.070 8.495 -0.425 25768 7006 1 8 . 1 1 134 134 GLY N N 134 109.400 109.400 111.147 -1.747 25768 7007 1 8 . 1 1 134 134 GLY C C 134 174.060 174.060 173.941 0.119 25768 7008 1 8 . 1 1 134 134 GLY CA C 134 45.690 45.690 45.410 0.280 25768 7009 1 8 . 1 1 134 134 GLY H H 134 8.150 8.150 8.679 -0.529 25768 7010 1 8 . 1 1 135 135 PHE N N 135 120.480 120.480 122.414 -1.934 25768 7011 1 8 . 1 1 135 135 PHE C C 135 176.000 176.000 174.829 1.171 25768 7012 1 8 . 1 1 135 135 PHE CA C 135 58.370 58.370 57.569 0.801 25768 7013 1 8 . 1 1 135 135 PHE CB C 135 39.710 39.710 40.958 -1.248 25768 7014 1 8 . 1 1 135 135 PHE H H 135 8.060 8.060 8.205 -0.145 25768 7015 1 8 . 1 1 136 136 SER N N 136 116.740 116.740 122.042 -5.302 25768 7016 1 8 . 1 1 136 136 SER C C 136 174.620 174.620 173.377 1.243 25768 7017 1 8 . 1 1 136 136 SER CA C 136 58.870 58.870 57.850 1.020 25768 7018 1 8 . 1 1 136 136 SER CB C 136 64.200 64.200 63.855 0.345 25768 7019 1 8 . 1 1 136 136 SER H H 136 8.160 8.160 8.522 -0.362 25768 7020 1 8 . 1 1 137 137 SER N N 137 117.650 117.650 121.720 -4.070 25768 7021 1 8 . 1 1 137 137 SER C C 137 174.410 174.410 173.739 0.671 25768 7022 1 8 . 1 1 137 137 SER CA C 137 58.880 58.880 58.128 0.752 25768 7023 1 8 . 1 1 137 137 SER CB C 137 64.140 64.140 64.725 -0.585 25768 7024 1 8 . 1 1 137 137 SER H H 137 8.140 8.140 8.577 -0.437 25768 7025 1 8 . 1 1 138 138 MET N N 138 121.980 121.980 122.687 -0.707 25768 7026 1 8 . 1 1 138 138 MET C C 138 175.680 175.680 175.496 0.184 25768 7027 1 8 . 1 1 138 138 MET CA C 138 56.180 56.180 55.745 0.436 25768 7028 1 8 . 1 1 138 138 MET CB C 138 33.240 33.240 34.158 -0.918 25768 7029 1 8 . 1 1 138 138 MET H H 138 8.110 8.110 8.357 -0.247 25768 7030 1 8 . 1 1 139 139 LYS N N 139 122.110 122.110 125.727 -3.617 25768 7031 1 8 . 1 1 139 139 LYS C C 139 176.220 176.220 176.393 -0.173 25768 7032 1 8 . 1 1 139 139 LYS CA C 139 56.370 56.370 56.153 0.217 25768 7033 1 8 . 1 1 139 139 LYS CB C 139 33.220 33.220 33.192 0.028 25768 7034 1 8 . 1 1 139 139 LYS H H 139 8.140 8.140 8.495 -0.355 25768 7035 1 8 . 1 1 140 140 LEU N N 140 123.860 123.860 122.842 1.018 25768 7036 1 8 . 1 1 140 140 LEU C C 140 177.100 177.100 176.801 0.299 25768 7037 1 8 . 1 1 140 140 LEU CA C 140 55.710 55.710 54.836 0.874 25768 7038 1 8 . 1 1 140 140 LEU CB C 140 42.460 42.460 41.804 0.655 25768 7039 1 8 . 1 1 140 140 LEU H H 140 8.140 8.140 8.483 -0.343 25768 7040 1 8 . 1 1 141 141 GLN N N 141 120.350 120.350 117.003 3.347 25768 7041 1 8 . 1 1 141 141 GLN C C 141 175.170 175.170 174.960 0.210 25768 7042 1 8 . 1 1 141 141 GLN CA C 141 56.200 56.200 55.368 0.832 25768 7043 1 8 . 1 1 141 141 GLN CB C 141 29.950 29.950 29.229 0.721 25768 7044 1 8 . 1 1 141 141 GLN H H 141 8.210 8.210 7.725 0.485 25768 7045 1 8 . 1 1 142 142 ASP N N 142 120.950 120.950 119.839 1.111 25768 7046 1 8 . 1 1 142 142 ASP C C 142 175.840 175.840 175.460 0.380 25768 7047 1 8 . 1 1 142 142 ASP CA C 142 54.700 54.700 54.840 -0.140 25768 7048 1 8 . 1 1 142 142 ASP CB C 142 41.760 41.760 41.741 0.019 25768 7049 1 8 . 1 1 142 142 ASP H H 142 8.120 8.120 8.459 -0.339 25768 7050 1 8 . 1 1 143 143 SER N N 143 114.880 114.880 114.817 0.063 25768 7051 1 8 . 1 1 143 143 SER C C 143 173.290 173.290 174.769 -1.479 25768 7052 1 8 . 1 1 143 143 SER CA C 143 58.450 58.450 57.365 1.085 25768 7053 1 8 . 1 1 143 143 SER CB C 143 64.760 64.760 63.053 1.707 25768 7054 1 8 . 1 1 143 143 SER H H 143 7.960 7.960 7.717 0.243 25768 7055 1 8 . 1 1 144 144 TRP N N 144 123.110 123.110 121.990 1.120 25768 7056 1 8 . 1 1 144 144 TRP C C 144 175.880 175.880 177.453 -1.573 25768 7057 1 8 . 1 1 144 144 TRP CA C 144 56.420 56.420 58.633 -2.213 25768 7058 1 8 . 1 1 144 144 TRP CB C 144 31.160 31.160 30.053 1.107 25768 7059 1 8 . 1 1 144 144 TRP H H 144 8.080 8.080 7.997 0.083 25768 7060 1 8 . 1 1 145 145 GLY N N 145 110.410 110.410 108.633 1.777 25768 7061 1 8 . 1 1 145 145 GLY C C 145 172.870 172.870 173.504 -0.634 25768 7062 1 8 . 1 1 145 145 GLY CA C 145 45.130 45.130 44.954 0.176 25768 7063 1 8 . 1 1 145 145 GLY H H 145 8.660 8.660 8.940 -0.280 25768 7064 1 8 . 1 1 148 148 GLY C C 148 171.800 171.800 173.574 -1.774 25768 7065 1 8 . 1 1 148 148 GLY CA C 148 44.140 44.140 44.823 -0.683 25768 7066 1 8 . 1 1 149 149 GLU N N 149 123.070 123.070 120.586 2.484 25768 7067 1 8 . 1 1 149 149 GLU C C 149 174.210 174.210 174.499 -0.289 25768 7068 1 8 . 1 1 149 149 GLU CA C 149 55.120 55.120 55.010 0.110 25768 7069 1 8 . 1 1 149 149 GLU CB C 149 37.410 37.410 34.282 3.128 25768 7070 1 8 . 1 1 149 149 GLU H H 149 8.550 8.550 7.978 0.572 25768 7071 1 8 . 1 1 150 150 LEU N N 150 126.130 126.130 120.680 5.450 25768 7072 1 8 . 1 1 150 150 LEU C C 150 174.410 174.410 176.001 -1.591 25768 7073 1 8 . 1 1 150 150 LEU CA C 150 54.260 54.260 53.917 0.342 25768 7074 1 8 . 1 1 150 150 LEU CB C 150 47.510 47.510 43.432 4.078 25768 7075 1 8 . 1 1 150 150 LEU H H 150 8.550 8.550 8.250 0.300 25768 7076 1 8 . 1 1 151 151 GLY N N 151 109.500 109.500 108.601 0.899 25768 7077 1 8 . 1 1 151 151 GLY C C 151 170.610 170.610 171.749 -1.139 25768 7078 1 8 . 1 1 151 151 GLY CA C 151 45.980 45.980 43.189 2.791 25768 7079 1 8 . 1 1 151 151 GLY H H 151 8.090 8.090 8.286 -0.196 25768 7080 1 8 . 1 1 152 152 PHE N N 152 110.960 110.960 121.497 -10.537 25768 7081 1 8 . 1 1 152 152 PHE C C 152 171.510 171.510 174.281 -2.771 25768 7082 1 8 . 1 1 152 152 PHE CA C 152 58.170 58.170 56.577 1.593 25768 7083 1 8 . 1 1 152 152 PHE CB C 152 41.690 41.690 41.450 0.240 25768 7084 1 8 . 1 1 152 152 PHE H H 152 8.380 8.380 9.280 -0.900 25768 7085 1 8 . 1 1 153 153 ASP N N 153 118.880 118.880 125.287 -6.407 25768 7086 1 8 . 1 1 153 153 ASP C C 153 176.520 176.520 175.050 1.470 25768 7087 1 8 . 1 1 153 153 ASP CA C 153 52.940 52.940 53.553 -0.613 25768 7088 1 8 . 1 1 153 153 ASP CB C 153 44.540 44.540 43.268 1.272 25768 7089 1 8 . 1 1 153 153 ASP H H 153 7.970 7.970 8.321 -0.351 25768 7090 1 8 . 1 1 154 154 TYR N N 154 123.630 123.630 124.788 -1.158 25768 7091 1 8 . 1 1 154 154 TYR C C 154 175.610 175.610 174.119 1.491 25768 7092 1 8 . 1 1 154 154 TYR CA C 154 57.310 57.310 56.517 0.794 25768 7093 1 8 . 1 1 154 154 TYR CB C 154 42.040 42.040 42.026 0.014 25768 7094 1 8 . 1 1 154 154 TYR H H 154 9.730 9.730 9.058 0.672 25768 7095 1 8 . 1 1 155 155 MET N N 155 126.190 126.190 127.084 -0.894 25768 7096 1 8 . 1 1 155 155 MET C C 155 174.970 174.970 175.122 -0.152 25768 7097 1 8 . 1 1 155 155 MET CA C 155 54.720 54.720 56.337 -1.617 25768 7098 1 8 . 1 1 155 155 MET CB C 155 28.300 28.300 32.285 -3.985 25768 7099 1 8 . 1 1 155 155 MET H H 155 8.600 8.600 8.281 0.319 25768 7100 1 8 . 1 1 156 156 LEU N N 156 125.290 125.290 125.142 0.148 25768 7101 1 8 . 1 1 156 156 LEU C C 156 177.680 177.680 177.304 0.376 25768 7102 1 8 . 1 1 156 156 LEU CA C 156 56.040 56.040 54.817 1.223 25768 7103 1 8 . 1 1 156 156 LEU CB C 156 43.040 43.040 43.197 -0.157 25768 7104 1 8 . 1 1 156 156 LEU H H 156 9.190 9.190 8.978 0.212 25768 7105 1 8 . 1 1 157 157 ASN N N 157 114.690 114.690 116.552 -1.862 25768 7106 1 8 . 1 1 157 157 ASN C C 157 173.640 173.640 177.280 -3.640 25768 7107 1 8 . 1 1 157 157 ASN CA C 157 52.650 52.650 56.259 -3.609 25768 7108 1 8 . 1 1 157 157 ASN CB C 157 37.270 37.270 36.658 0.612 25768 7109 1 8 . 1 1 157 157 ASN H H 157 8.060 8.060 8.125 -0.065 25768 7110 1 8 . 1 1 158 158 GLU N N 158 114.530 114.530 121.813 -7.283 25768 7111 1 8 . 1 1 158 158 GLU C C 158 176.090 176.090 176.589 -0.499 25768 7112 1 8 . 1 1 158 158 GLU CA C 158 60.010 60.010 58.570 1.440 25768 7113 1 8 . 1 1 158 158 GLU CB C 158 29.730 29.730 29.971 -0.241 25768 7114 1 8 . 1 1 158 158 GLU H H 158 8.560 8.560 8.259 0.301 25768 7115 1 8 . 1 1 159 159 HIS N N 159 110.480 110.480 117.154 -6.674 25768 7116 1 8 . 1 1 159 159 HIS C C 159 173.130 173.130 174.129 -0.999 25768 7117 1 8 . 1 1 159 159 HIS CA C 159 56.770 56.770 55.079 1.691 25768 7118 1 8 . 1 1 159 159 HIS CB C 159 32.630 32.630 29.573 3.057 25768 7119 1 8 . 1 1 159 159 HIS H H 159 8.190 8.190 7.468 0.722 25768 7120 1 8 . 1 1 160 160 ALA N N 160 122.890 122.890 120.318 2.572 25768 7121 1 8 . 1 1 160 160 ALA C C 160 176.200 176.200 174.943 1.257 25768 7122 1 8 . 1 1 160 160 ALA CA C 160 51.730 51.730 53.741 -2.011 25768 7123 1 8 . 1 1 160 160 ALA CB C 160 21.560 21.560 18.463 3.097 25768 7124 1 8 . 1 1 160 160 ALA H H 160 8.400 8.400 7.882 0.518 25768 7125 1 8 . 1 1 161 161 LEU N N 161 116.540 116.540 118.554 -2.014 25768 7126 1 8 . 1 1 161 161 LEU C C 161 174.930 174.930 175.965 -1.035 25768 7127 1 8 . 1 1 161 161 LEU CA C 161 54.280 54.280 53.950 0.330 25768 7128 1 8 . 1 1 161 161 LEU CB C 161 45.640 45.640 45.785 -0.145 25768 7129 1 8 . 1 1 161 161 LEU H H 161 8.590 8.590 8.292 0.298 25768 7130 1 8 . 1 1 162 162 PHE N N 162 121.780 121.780 124.951 -3.171 25768 7131 1 8 . 1 1 162 162 PHE C C 162 171.960 171.960 174.349 -2.389 25768 7132 1 8 . 1 1 162 162 PHE CA C 162 56.420 56.420 57.067 -0.647 25768 7133 1 8 . 1 1 162 162 PHE CB C 162 43.340 43.340 40.907 2.433 25768 7134 1 8 . 1 1 162 162 PHE H H 162 9.180 9.180 9.478 -0.298 25768 7135 1 8 . 1 1 163 163 ASN N N 163 127.850 127.850 128.567 -0.717 25768 7136 1 8 . 1 1 163 163 ASN C C 163 171.320 171.320 173.597 -2.277 25768 7137 1 8 . 1 1 163 163 ASN CA C 163 52.340 52.340 52.993 -0.653 25768 7138 1 8 . 1 1 163 163 ASN CB C 163 46.410 46.410 39.907 6.503 25768 7139 1 8 . 1 1 163 163 ASN H H 163 7.700 7.700 7.994 -0.294 25768 7140 1 8 . 1 1 164 164 MET N N 164 119.950 119.950 125.385 -5.435 25768 7141 1 8 . 1 1 164 164 MET C C 164 172.830 172.830 173.550 -0.720 25768 7142 1 8 . 1 1 164 164 MET CA C 164 55.180 55.180 54.310 0.870 25768 7143 1 8 . 1 1 164 164 MET CB C 164 37.770 37.770 36.402 1.368 25768 7144 1 8 . 1 1 164 164 MET H H 164 7.070 7.070 8.614 -1.544 25768 7145 1 8 . 1 1 165 165 ALA N N 165 120.600 120.600 128.837 -8.237 25768 7146 1 8 . 1 1 165 165 ALA C C 165 174.240 174.240 175.236 -0.996 25768 7147 1 8 . 1 1 165 165 ALA CA C 165 51.630 51.630 49.922 1.708 25768 7148 1 8 . 1 1 165 165 ALA CB C 165 22.330 22.330 21.793 0.537 25768 7149 1 8 . 1 1 165 165 ALA H H 165 8.290 8.290 8.736 -0.446 25768 7150 1 8 . 1 1 166 166 VAL N N 166 117.900 117.900 116.636 1.264 25768 7151 1 8 . 1 1 166 166 VAL C C 166 172.950 172.950 175.699 -2.749 25768 7152 1 8 . 1 1 166 166 VAL CA C 166 59.710 59.710 60.457 -0.747 25768 7153 1 8 . 1 1 166 166 VAL CB C 166 35.290 35.290 35.618 -0.328 25768 7154 1 8 . 1 1 166 166 VAL H H 166 8.720 8.720 8.270 0.450 25768 7155 1 8 . 1 1 171 171 ILE C C 171 175.750 175.750 174.327 1.423 25768 7156 1 8 . 1 1 171 171 ILE CA C 171 61.720 61.720 62.294 -0.574 25768 7157 1 8 . 1 1 171 171 ILE CB C 171 39.300 39.300 39.643 -0.343 25768 7158 1 8 . 1 1 172 172 ASP N N 172 124.070 124.070 123.514 0.556 25768 7159 1 8 . 1 1 172 172 ASP C C 172 176.590 176.590 175.709 0.881 25768 7160 1 8 . 1 1 172 172 ASP CA C 172 54.460 54.460 54.038 0.422 25768 7161 1 8 . 1 1 172 172 ASP CB C 172 41.410 41.410 41.869 -0.459 25768 7162 1 8 . 1 1 172 172 ASP H H 172 8.460 8.460 8.531 -0.071 25768 7163 1 8 . 1 1 173 173 THR N N 173 115.570 115.570 112.940 2.630 25768 7164 1 8 . 1 1 173 173 THR C C 173 175.030 175.030 174.527 0.503 25768 7165 1 8 . 1 1 173 173 THR CA C 173 62.680 62.680 61.649 1.031 25768 7166 1 8 . 1 1 173 173 THR CB C 173 69.840 69.840 70.624 -0.784 25768 7167 1 8 . 1 1 173 173 THR H H 173 8.080 8.080 8.340 -0.260 25768 7168 1 8 . 1 1 174 174 LYS N N 174 122.680 122.680 123.819 -1.139 25768 7169 1 8 . 1 1 174 174 LYS C C 174 176.340 176.340 176.205 0.135 25768 7170 1 8 . 1 1 174 174 LYS CA C 174 56.820 56.820 56.209 0.611 25768 7171 1 8 . 1 1 174 174 LYS CB C 174 32.790 32.790 32.928 -0.138 25768 7172 1 8 . 1 1 174 174 LYS H H 174 8.180 8.180 8.666 -0.486 25768 7173 1 8 . 1 1 175 175 ALA N N 175 124.050 124.050 123.064 0.986 25768 7174 1 8 . 1 1 175 175 ALA C C 175 177.550 177.550 177.003 0.547 25768 7175 1 8 . 1 1 175 175 ALA CA C 175 52.840 52.840 52.299 0.541 25768 7176 1 8 . 1 1 175 175 ALA CB C 175 19.580 19.580 18.860 0.720 25768 7177 1 8 . 1 1 175 175 ALA H H 175 8.050 8.050 7.927 0.123 25768 7178 1 8 . 1 1 176 176 SER N N 176 114.920 114.920 117.210 -2.290 25768 7179 1 8 . 1 1 176 176 SER C C 176 174.240 174.240 175.326 -1.086 25768 7180 1 8 . 1 1 176 176 SER CA C 176 58.390 58.390 59.172 -0.782 25768 7181 1 8 . 1 1 176 176 SER CB C 176 64.370 64.370 63.859 0.511 25768 7182 1 8 . 1 1 176 176 SER H H 176 8.070 8.070 8.600 -0.530 25768 7183 1 8 . 1 1 177 177 ILE N N 177 121.650 121.650 119.530 2.120 25768 7184 1 8 . 1 1 177 177 ILE C C 177 174.990 174.990 174.381 0.609 25768 7185 1 8 . 1 1 177 177 ILE CA C 177 61.570 61.570 60.496 1.074 25768 7186 1 8 . 1 1 177 177 ILE CB C 177 39.100 39.100 37.300 1.800 25768 7187 1 8 . 1 1 177 177 ILE H H 177 7.960 7.960 7.797 0.163 25768 7188 1 8 . 1 1 178 178 ASN N N 178 127.040 127.040 124.124 2.916 25768 7189 1 8 . 1 1 178 178 ASN C C 178 179.160 179.160 175.643 3.517 25768 7190 1 8 . 1 1 178 178 ASN CA C 178 55.100 55.100 54.297 0.802 25768 7191 1 8 . 1 1 178 178 ASN CB C 178 41.300 41.300 39.061 2.239 25768 7192 1 8 . 1 1 178 178 ASN H H 178 7.850 7.850 8.388 -0.538 25768 7193 1 8 . 1 1 180 180 PRO C C 180 177.520 177.520 177.196 0.324 25768 7194 1 8 . 1 1 180 180 PRO CA C 180 63.980 63.980 64.884 -0.904 25768 7195 1 8 . 1 1 180 180 PRO CB C 180 32.190 32.190 31.886 0.304 25768 7196 1 8 . 1 1 181 181 SER N N 181 115.600 115.600 109.519 6.081 25768 7197 1 8 . 1 1 181 181 SER C C 181 174.710 174.710 174.490 0.220 25768 7198 1 8 . 1 1 181 181 SER CA C 181 58.900 58.900 56.817 2.083 25768 7199 1 8 . 1 1 181 181 SER CB C 181 64.070 64.070 62.766 1.304 25768 7200 1 8 . 1 1 181 181 SER H H 181 8.260 8.260 8.117 0.143 25768 7201 1 8 . 1 1 182 182 ALA N N 182 125.880 125.880 123.982 1.898 25768 7202 1 8 . 1 1 182 182 ALA C C 182 177.560 177.560 178.726 -1.166 25768 7203 1 8 . 1 1 182 182 ALA CA C 182 53.090 53.090 54.280 -1.190 25768 7204 1 8 . 1 1 182 182 ALA CB C 182 19.310 19.310 19.130 0.180 25768 7205 1 8 . 1 1 182 182 ALA H H 182 8.130 8.130 8.057 0.073 25768 7206 1 8 . 1 1 183 183 LEU N N 183 119.980 119.980 117.204 2.776 25768 7207 1 8 . 1 1 183 183 LEU C C 183 177.850 177.850 177.425 0.425 25768 7208 1 8 . 1 1 183 183 LEU CA C 183 55.650 55.650 54.511 1.139 25768 7209 1 8 . 1 1 183 183 LEU CB C 183 42.530 42.530 42.700 -0.170 25768 7210 1 8 . 1 1 183 183 LEU H H 183 7.940 7.940 8.265 -0.325 25768 7211 1 8 . 1 1 184 184 GLY N N 184 109.250 109.250 108.016 1.234 25768 7212 1 8 . 1 1 184 184 GLY C C 184 174.250 174.250 174.758 -0.508 25768 7213 1 8 . 1 1 184 184 GLY CA C 184 45.830 45.830 44.988 0.842 25768 7214 1 8 . 1 1 184 184 GLY H H 184 8.150 8.150 7.850 0.300 25768 7215 1 8 . 1 1 185 185 VAL N N 185 118.830 118.830 119.503 -0.673 25768 7216 1 8 . 1 1 185 185 VAL C C 185 175.890 175.890 176.045 -0.155 25768 7217 1 8 . 1 1 185 185 VAL CA C 185 62.740 62.740 63.054 -0.314 25768 7218 1 8 . 1 1 185 185 VAL CB C 185 32.770 32.770 32.287 0.483 25768 7219 1 8 . 1 1 185 185 VAL H H 185 7.760 7.760 8.284 -0.524 25768 7220 1 8 . 1 1 186 186 ASN N N 186 121.850 121.850 116.263 5.587 25768 7221 1 8 . 1 1 186 186 ASN C C 186 174.970 174.970 174.237 0.733 25768 7222 1 8 . 1 1 186 186 ASN CA C 186 53.590 53.590 53.053 0.537 25768 7223 1 8 . 1 1 186 186 ASN CB C 186 39.160 39.160 38.660 0.500 25768 7224 1 8 . 1 1 186 186 ASN H H 186 8.380 8.380 8.148 0.232 25768 7225 1 8 . 1 1 187 187 LYS N N 187 122.120 122.120 120.643 1.477 25768 7226 1 8 . 1 1 187 187 LYS C C 187 176.490 176.490 174.206 2.284 25768 7227 1 8 . 1 1 187 187 LYS CA C 187 56.750 56.750 56.365 0.385 25768 7228 1 8 . 1 1 187 187 LYS CB C 187 33.250 33.250 34.163 -0.913 25768 7229 1 8 . 1 1 187 187 LYS H H 187 8.140 8.140 7.895 0.245 25768 7230 1 8 . 1 1 188 188 THR N N 188 115.250 115.250 117.629 -2.379 25768 7231 1 8 . 1 1 188 188 THR C C 188 174.250 174.250 174.269 -0.019 25768 7232 1 8 . 1 1 188 188 THR CA C 188 62.360 62.360 61.321 1.039 25768 7233 1 8 . 1 1 188 188 THR CB C 188 70.280 70.280 70.901 -0.621 25768 7234 1 8 . 1 1 188 188 THR H H 188 8.100 8.100 8.275 -0.175 25768 7235 1 8 . 1 1 189 189 LYS N N 189 123.780 123.780 121.192 2.588 25768 7236 1 8 . 1 1 189 189 LYS C C 189 176.090 176.090 176.313 -0.223 25768 7237 1 8 . 1 1 189 189 LYS CA C 189 56.590 56.590 56.907 -0.317 25768 7238 1 8 . 1 1 189 189 LYS CB C 189 33.350 33.350 33.342 0.008 25768 7239 1 8 . 1 1 189 189 LYS H H 189 8.110 8.110 8.525 -0.415 25768 7240 1 8 . 1 1 190 190 VAL N N 190 120.920 120.920 116.943 3.977 25768 7241 1 8 . 1 1 190 190 VAL C C 190 175.590 175.590 174.075 1.515 25768 7242 1 8 . 1 1 190 190 VAL CA C 190 62.400 62.400 62.096 0.304 25768 7243 1 8 . 1 1 190 190 VAL CB C 190 32.990 32.990 34.433 -1.443 25768 7244 1 8 . 1 1 190 190 VAL H H 190 8.040 8.040 7.354 0.686 25768 7245 1 8 . 1 1 191 191 ASP N N 191 123.790 123.790 126.389 -2.599 25768 7246 1 8 . 1 1 191 191 ASP C C 191 175.750 175.750 175.893 -0.143 25768 7247 1 8 . 1 1 191 191 ASP CA C 191 54.650 54.650 55.616 -0.966 25768 7248 1 8 . 1 1 191 191 ASP CB C 191 41.450 41.450 42.157 -0.707 25768 7249 1 8 . 1 1 191 191 ASP H H 191 8.240 8.240 8.511 -0.271 25768 7250 1 8 . 1 1 192 192 VAL N N 192 118.850 118.850 118.804 0.046 25768 7251 1 8 . 1 1 192 192 VAL C C 192 175.380 175.380 174.991 0.389 25768 7252 1 8 . 1 1 192 192 VAL CA C 192 62.110 62.110 62.453 -0.343 25768 7253 1 8 . 1 1 192 192 VAL CB C 192 33.290 33.290 33.515 -0.225 25768 7254 1 8 . 1 1 192 192 VAL H H 192 7.860 7.860 7.645 0.215 25768 7255 1 8 . 1 1 193 193 ASP N N 193 124.190 124.190 120.013 4.177 25768 7256 1 8 . 1 1 193 193 ASP C C 193 175.630 175.630 176.657 -1.027 25768 7257 1 8 . 1 1 193 193 ASP CA C 193 54.540 54.540 54.044 0.496 25768 7258 1 8 . 1 1 193 193 ASP CB C 193 41.410 41.410 40.880 0.530 25768 7259 1 8 . 1 1 193 193 ASP H H 193 8.310 8.310 7.987 0.323 25768 7260 1 8 . 1 1 194 194 VAL N N 194 119.580 119.580 117.523 2.057 25768 7261 1 8 . 1 1 194 194 VAL C C 194 174.950 174.950 175.825 -0.875 25768 7262 1 8 . 1 1 194 194 VAL CA C 194 61.770 61.770 63.546 -1.776 25768 7263 1 8 . 1 1 194 194 VAL CB C 194 33.680 33.680 32.000 1.680 25768 7264 1 8 . 1 1 194 194 VAL H H 194 7.890 7.890 7.727 0.163 25768 7265 1 8 . 1 1 195 195 ASP N N 195 125.660 125.660 121.506 4.154 25768 7266 1 8 . 1 1 195 195 ASP C C 195 174.290 174.290 173.916 0.374 25768 7267 1 8 . 1 1 195 195 ASP CA C 195 51.940 51.940 51.372 0.568 25768 7268 1 8 . 1 1 195 195 ASP CB C 195 40.950 40.950 42.081 -1.131 25768 7269 1 8 . 1 1 195 195 ASP H H 195 8.410 8.410 7.968 0.442 25768 7270 1 8 . 1 1 198 198 VAL C C 198 173.940 173.940 173.794 0.146 25768 7271 1 8 . 1 1 198 198 VAL CA C 198 61.270 61.270 60.070 1.200 25768 7272 1 8 . 1 1 198 198 VAL CB C 198 35.910 35.910 33.398 2.512 25768 7273 1 8 . 1 1 199 199 TYR N N 199 123.780 123.780 123.052 0.728 25768 7274 1 8 . 1 1 199 199 TYR C C 199 174.150 174.150 174.457 -0.307 25768 7275 1 8 . 1 1 199 199 TYR CA C 199 56.220 56.220 56.987 -0.767 25768 7276 1 8 . 1 1 199 199 TYR CB C 199 41.660 41.660 42.705 -1.044 25768 7277 1 8 . 1 1 199 199 TYR H H 199 8.540 8.540 7.919 0.621 25768 7278 1 8 . 1 1 200 200 MET N N 200 123.920 123.920 120.009 3.911 25768 7279 1 8 . 1 1 200 200 MET C C 200 173.810 173.810 174.863 -1.053 25768 7280 1 8 . 1 1 200 200 MET CA C 200 54.710 54.710 55.211 -0.501 25768 7281 1 8 . 1 1 200 200 MET CB C 200 37.110 37.110 33.277 3.833 25768 7282 1 8 . 1 1 200 200 MET H H 200 9.130 9.130 8.439 0.691 25768 7283 1 8 . 1 1 201 201 ILE N N 201 123.670 123.670 123.021 0.649 25768 7284 1 8 . 1 1 201 201 ILE C C 201 174.030 174.030 174.887 -0.857 25768 7285 1 8 . 1 1 201 201 ILE CA C 201 59.820 59.820 59.406 0.414 25768 7286 1 8 . 1 1 201 201 ILE CB C 201 41.720 41.720 41.603 0.117 25768 7287 1 8 . 1 1 201 201 ILE H H 201 8.030 8.030 8.432 -0.402 25768 7288 1 8 . 1 1 202 202 GLY N N 202 112.910 112.910 109.949 2.961 25768 7289 1 8 . 1 1 202 202 GLY C C 202 170.280 170.280 171.993 -1.713 25768 7290 1 8 . 1 1 202 202 GLY CA C 202 46.800 46.800 45.153 1.647 25768 7291 1 8 . 1 1 202 202 GLY H H 202 8.580 8.580 7.292 1.288 25768 7292 1 8 . 1 1 203 203 PHE N N 203 116.240 116.240 117.596 -1.356 25768 7293 1 8 . 1 1 203 203 PHE C C 203 173.940 173.940 174.987 -1.047 25768 7294 1 8 . 1 1 203 203 PHE CA C 203 55.890 55.890 55.975 -0.085 25768 7295 1 8 . 1 1 203 203 PHE CB C 203 45.060 45.060 43.751 1.309 25768 7296 1 8 . 1 1 203 203 PHE H H 203 8.620 8.620 7.770 0.850 25768 7297 1 8 . 1 1 204 204 GLY N N 204 105.610 105.610 106.895 -1.285 25768 7298 1 8 . 1 1 204 204 GLY C C 204 171.190 171.190 171.775 -0.585 25768 7299 1 8 . 1 1 204 204 GLY CA C 204 46.720 46.720 44.374 2.346 25768 7300 1 8 . 1 1 204 204 GLY H H 204 8.960 8.960 9.074 -0.114 25768 7301 1 8 . 1 1 205 205 TYR N N 205 121.160 121.160 120.521 0.639 25768 7302 1 8 . 1 1 205 205 TYR C C 205 173.030 173.030 173.445 -0.415 25768 7303 1 8 . 1 1 205 205 TYR CA C 205 57.190 57.190 57.503 -0.313 25768 7304 1 8 . 1 1 205 205 TYR CB C 205 44.400 44.400 42.970 1.430 25768 7305 1 8 . 1 1 205 205 TYR H H 205 9.380 9.380 9.102 0.278 25768 7306 1 8 . 1 1 206 206 LYS N N 206 126.970 126.970 126.104 0.866 25768 7307 1 8 . 1 1 206 206 LYS C C 206 174.210 174.210 174.974 -0.764 25768 7308 1 8 . 1 1 206 206 LYS CA C 206 54.770 54.770 55.478 -0.708 25768 7309 1 8 . 1 1 206 206 LYS CB C 206 34.440 34.440 33.003 1.437 25768 7310 1 8 . 1 1 206 206 LYS H H 206 8.380 8.380 8.012 0.368 25768 7311 1 8 . 1 1 207 207 PHE N N 207 126.330 126.330 122.762 3.568 25768 7312 1 8 . 1 1 207 207 PHE C C 207 175.020 175.020 175.624 -0.604 25768 7313 1 8 . 1 1 207 207 PHE CA C 207 58.170 58.170 58.415 -0.245 25768 7314 1 8 . 1 1 207 207 PHE CB C 207 40.920 40.920 40.779 0.140 25768 7315 1 8 . 1 1 207 207 PHE H H 207 9.290 9.290 8.101 1.189 25768 7316 1 8 . 1 1 208 208 LEU N N 208 122.740 122.740 123.994 -1.254 25768 7317 1 8 . 1 1 208 208 LEU C C 208 176.510 176.510 176.437 0.073 25768 7318 1 8 . 1 1 208 208 LEU CA C 208 54.910 54.910 54.787 0.123 25768 7319 1 8 . 1 1 208 208 LEU CB C 208 43.830 43.830 43.060 0.770 25768 7320 1 8 . 1 1 208 208 LEU H H 208 8.310 8.310 7.993 0.317 25768 7321 1 9 . 1 1 2 2 HIS C C 2 175.310 175.310 174.548 0.762 25768 7322 1 9 . 1 1 3 3 LYS N N 3 122.080 122.080 123.993 -1.913 25768 7323 1 9 . 1 1 3 3 LYS C C 3 173.490 173.490 174.495 -1.005 25768 7324 1 9 . 1 1 3 3 LYS CA C 3 55.050 55.050 55.673 -0.623 25768 7325 1 9 . 1 1 3 3 LYS CB C 3 35.380 35.380 36.230 -0.850 25768 7326 1 9 . 1 1 3 3 LYS H H 3 8.620 8.620 8.275 0.345 25768 7327 1 9 . 1 1 4 4 ALA N N 4 120.860 120.860 124.121 -3.261 25768 7328 1 9 . 1 1 4 4 ALA C C 4 178.190 178.190 178.501 -0.311 25768 7329 1 9 . 1 1 4 4 ALA CA C 4 53.480 53.480 52.881 0.599 25768 7330 1 9 . 1 1 4 4 ALA CB C 4 18.140 18.140 18.323 -0.183 25768 7331 1 9 . 1 1 4 4 ALA H H 4 8.580 8.580 8.374 0.206 25768 7332 1 9 . 1 1 5 5 GLY N N 5 112.890 112.890 112.501 0.389 25768 7333 1 9 . 1 1 5 5 GLY C C 5 173.830 173.830 173.520 0.310 25768 7334 1 9 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.594 0.286 25768 7335 1 9 . 1 1 5 5 GLY H H 5 9.210 9.210 8.536 0.674 25768 7336 1 9 . 1 1 6 6 ASP N N 6 121.590 121.590 121.003 0.587 25768 7337 1 9 . 1 1 6 6 ASP C C 6 174.380 174.380 174.468 -0.088 25768 7338 1 9 . 1 1 6 6 ASP CA C 6 55.790 55.790 55.142 0.648 25768 7339 1 9 . 1 1 6 6 ASP CB C 6 41.760 41.760 42.419 -0.659 25768 7340 1 9 . 1 1 6 6 ASP H H 6 7.620 7.620 7.400 0.220 25768 7341 1 9 . 1 1 7 7 PHE N N 7 120.860 120.860 124.608 -3.748 25768 7342 1 9 . 1 1 7 7 PHE C C 7 174.050 174.050 173.922 0.128 25768 7343 1 9 . 1 1 7 7 PHE CA C 7 56.110 56.110 57.684 -1.574 25768 7344 1 9 . 1 1 7 7 PHE CB C 7 42.550 42.550 42.154 0.396 25768 7345 1 9 . 1 1 7 7 PHE H H 7 8.250 8.250 7.862 0.388 25768 7346 1 9 . 1 1 8 8 ILE N N 8 127.950 127.950 126.062 1.888 25768 7347 1 9 . 1 1 8 8 ILE C C 8 174.000 174.000 174.286 -0.286 25768 7348 1 9 . 1 1 8 8 ILE CA C 8 61.160 61.160 60.420 0.740 25768 7349 1 9 . 1 1 8 8 ILE CB C 8 42.660 42.660 41.409 1.251 25768 7350 1 9 . 1 1 8 8 ILE H H 8 9.230 9.230 7.948 1.282 25768 7351 1 9 . 1 1 9 9 ILE N N 9 125.380 125.380 126.654 -1.274 25768 7352 1 9 . 1 1 9 9 ILE C C 9 173.630 173.630 175.021 -1.391 25768 7353 1 9 . 1 1 9 9 ILE CA C 9 59.600 59.600 60.589 -0.989 25768 7354 1 9 . 1 1 9 9 ILE CB C 9 41.180 41.180 39.788 1.393 25768 7355 1 9 . 1 1 9 9 ILE H H 9 8.580 8.580 8.940 -0.360 25768 7356 1 9 . 1 1 10 10 ARG N N 10 124.950 124.950 122.962 1.988 25768 7357 1 9 . 1 1 10 10 ARG C C 10 175.030 175.030 175.774 -0.744 25768 7358 1 9 . 1 1 10 10 ARG CA C 10 53.920 53.920 54.610 -0.690 25768 7359 1 9 . 1 1 10 10 ARG CB C 10 31.880 31.880 34.871 -2.991 25768 7360 1 9 . 1 1 10 10 ARG H H 10 9.230 9.230 8.292 0.938 25768 7361 1 9 . 1 1 11 11 GLY N N 11 105.650 105.650 109.453 -3.803 25768 7362 1 9 . 1 1 11 11 GLY C C 11 172.090 172.090 172.937 -0.847 25768 7363 1 9 . 1 1 11 11 GLY CA C 11 44.460 44.460 43.644 0.816 25768 7364 1 9 . 1 1 11 11 GLY H H 11 8.780 8.780 7.860 0.920 25768 7365 1 9 . 1 1 12 12 GLY N N 12 107.800 107.800 105.177 2.623 25768 7366 1 9 . 1 1 12 12 GLY C C 12 171.460 171.460 171.889 -0.429 25768 7367 1 9 . 1 1 12 12 GLY CA C 12 46.630 46.630 44.951 1.679 25768 7368 1 9 . 1 1 12 12 GLY H H 12 8.510 8.510 7.305 1.205 25768 7369 1 9 . 1 1 13 13 PHE N N 13 119.900 119.900 119.354 0.546 25768 7370 1 9 . 1 1 13 13 PHE C C 13 174.190 174.190 173.559 0.631 25768 7371 1 9 . 1 1 13 13 PHE CA C 13 56.340 56.340 57.437 -1.097 25768 7372 1 9 . 1 1 13 13 PHE CB C 13 41.090 41.090 44.291 -3.201 25768 7373 1 9 . 1 1 13 13 PHE H H 13 8.610 8.610 9.145 -0.535 25768 7374 1 9 . 1 1 14 14 ALA N N 14 128.030 128.030 124.334 3.696 25768 7375 1 9 . 1 1 14 14 ALA C C 14 176.560 176.560 176.855 -0.295 25768 7376 1 9 . 1 1 14 14 ALA CA C 14 49.940 49.940 50.928 -0.988 25768 7377 1 9 . 1 1 14 14 ALA CB C 14 20.360 20.360 21.652 -1.292 25768 7378 1 9 . 1 1 14 14 ALA H H 14 9.220 9.220 8.881 0.339 25768 7379 1 9 . 1 1 15 15 THR N N 15 118.620 118.620 119.740 -1.120 25768 7380 1 9 . 1 1 15 15 THR CA C 15 61.440 61.440 61.590 -0.150 25768 7381 1 9 . 1 1 15 15 THR CB C 15 71.370 71.370 70.234 1.136 25768 7382 1 9 . 1 1 15 15 THR H H 15 9.220 9.220 8.427 0.793 25768 7383 1 9 . 1 1 18 18 PRO C C 18 176.690 176.690 176.572 0.118 25768 7384 1 9 . 1 1 18 18 PRO CA C 18 63.610 63.610 63.455 0.155 25768 7385 1 9 . 1 1 18 18 PRO CB C 18 32.440 32.440 31.977 0.463 25768 7386 1 9 . 1 1 19 19 ASP N N 19 120.320 120.320 120.262 0.058 25768 7387 1 9 . 1 1 19 19 ASP C C 19 175.950 175.950 175.488 0.462 25768 7388 1 9 . 1 1 19 19 ASP CA C 19 54.710 54.710 54.551 0.159 25768 7389 1 9 . 1 1 19 19 ASP CB C 19 41.450 41.450 40.370 1.080 25768 7390 1 9 . 1 1 19 19 ASP H H 19 8.330 8.330 8.438 -0.108 25768 7391 1 9 . 1 1 20 20 ASP N N 20 121.990 121.990 121.599 0.391 25768 7392 1 9 . 1 1 20 20 ASP C C 20 176.760 176.760 176.152 0.608 25768 7393 1 9 . 1 1 20 20 ASP CA C 20 54.470 54.470 54.766 -0.296 25768 7394 1 9 . 1 1 20 20 ASP CB C 20 41.310 41.310 41.449 -0.139 25768 7395 1 9 . 1 1 20 20 ASP H H 20 8.240 8.240 8.550 -0.310 25768 7396 1 9 . 1 1 21 21 SER N N 21 117.050 117.050 115.154 1.896 25768 7397 1 9 . 1 1 21 21 SER C C 21 175.170 175.170 173.579 1.591 25768 7398 1 9 . 1 1 21 21 SER CA C 21 59.490 59.490 58.311 1.179 25768 7399 1 9 . 1 1 21 21 SER CB C 21 64.080 64.080 63.157 0.923 25768 7400 1 9 . 1 1 21 21 SER H H 21 8.360 8.360 7.878 0.482 25768 7401 1 9 . 1 1 22 22 SER N N 22 117.820 117.820 120.571 -2.751 25768 7402 1 9 . 1 1 22 22 SER C C 22 174.940 174.940 174.646 0.294 25768 7403 1 9 . 1 1 22 22 SER CA C 22 59.160 59.160 58.938 0.222 25768 7404 1 9 . 1 1 22 22 SER CB C 22 64.110 64.110 63.063 1.047 25768 7405 1 9 . 1 1 22 22 SER H H 22 8.310 8.310 8.638 -0.328 25768 7406 1 9 . 1 1 23 23 SER N N 23 117.660 117.660 115.769 1.891 25768 7407 1 9 . 1 1 23 23 SER C C 23 174.340 174.340 174.871 -0.531 25768 7408 1 9 . 1 1 23 23 SER CA C 23 59.050 59.050 58.047 1.003 25768 7409 1 9 . 1 1 23 23 SER CB C 23 64.210 64.210 63.641 0.569 25768 7410 1 9 . 1 1 23 23 SER H H 23 8.120 8.120 8.709 -0.589 25768 7411 1 9 . 1 1 24 24 ASP N N 24 122.590 122.590 119.184 3.406 25768 7412 1 9 . 1 1 24 24 ASP C C 24 176.250 176.250 174.688 1.562 25768 7413 1 9 . 1 1 24 24 ASP CA C 24 54.910 54.910 55.719 -0.810 25768 7414 1 9 . 1 1 24 24 ASP CB C 24 41.270 41.270 40.259 1.011 25768 7415 1 9 . 1 1 24 24 ASP H H 24 8.230 8.230 8.665 -0.435 25768 7416 1 9 . 1 1 25 25 ILE N N 25 120.650 120.650 116.924 3.726 25768 7417 1 9 . 1 1 25 25 ILE C C 25 176.190 176.190 173.570 2.620 25768 7418 1 9 . 1 1 25 25 ILE CA C 25 61.880 61.880 60.845 1.035 25768 7419 1 9 . 1 1 25 25 ILE CB C 25 38.730 38.730 40.046 -1.316 25768 7420 1 9 . 1 1 25 25 ILE H H 25 7.860 7.860 7.433 0.427 25768 7421 1 9 . 1 1 26 26 LYS N N 26 124.420 124.420 127.739 -3.319 25768 7422 1 9 . 1 1 26 26 LYS C C 26 176.640 176.640 176.581 0.059 25768 7423 1 9 . 1 1 26 26 LYS CA C 26 56.520 56.520 54.897 1.623 25768 7424 1 9 . 1 1 26 26 LYS CB C 26 32.890 32.890 33.815 -0.925 25768 7425 1 9 . 1 1 26 26 LYS H H 26 8.140 8.140 8.246 -0.106 25768 7426 1 9 . 1 1 27 27 LEU N N 27 123.120 123.120 122.966 0.154 25768 7427 1 9 . 1 1 27 27 LEU C C 27 177.110 177.110 176.688 0.422 25768 7428 1 9 . 1 1 27 27 LEU CA C 27 55.590 55.590 55.039 0.551 25768 7429 1 9 . 1 1 27 27 LEU CB C 27 42.500 42.500 41.165 1.335 25768 7430 1 9 . 1 1 27 27 LEU H H 27 8.080 8.080 8.694 -0.614 25768 7431 1 9 . 1 1 28 28 ASP N N 28 120.850 120.850 122.058 -1.208 25768 7432 1 9 . 1 1 28 28 ASP C C 28 176.960 176.960 177.612 -0.652 25768 7433 1 9 . 1 1 28 28 ASP CA C 28 54.800 54.800 54.285 0.515 25768 7434 1 9 . 1 1 28 28 ASP CB C 28 41.380 41.380 41.098 0.282 25768 7435 1 9 . 1 1 28 28 ASP H H 28 8.180 8.180 8.290 -0.110 25768 7436 1 9 . 1 1 29 29 GLY N N 29 109.800 109.800 106.390 3.410 25768 7437 1 9 . 1 1 29 29 GLY C C 29 174.370 174.370 173.739 0.631 25768 7438 1 9 . 1 1 29 29 GLY CA C 29 46.150 46.150 45.191 0.959 25768 7439 1 9 . 1 1 29 29 GLY H H 29 8.230 8.230 8.529 -0.299 25768 7440 1 9 . 1 1 30 30 ALA N N 30 123.880 123.880 122.634 1.246 25768 7441 1 9 . 1 1 30 30 ALA C C 30 178.040 178.040 175.476 2.564 25768 7442 1 9 . 1 1 30 30 ALA CA C 30 53.140 53.140 51.792 1.348 25768 7443 1 9 . 1 1 30 30 ALA CB C 30 19.350 19.350 20.294 -0.944 25768 7444 1 9 . 1 1 30 30 ALA H H 30 8.040 8.040 7.674 0.366 25768 7445 1 9 . 1 1 31 31 LYS N N 31 119.800 119.800 123.524 -3.724 25768 7446 1 9 . 1 1 31 31 LYS C C 31 176.770 176.770 176.430 0.340 25768 7447 1 9 . 1 1 31 31 LYS CA C 31 56.870 56.870 55.461 1.409 25768 7448 1 9 . 1 1 31 31 LYS CB C 31 32.980 32.980 32.737 0.243 25768 7449 1 9 . 1 1 31 31 LYS H H 31 8.060 8.060 8.385 -0.325 25768 7450 1 9 . 1 1 32 32 GLN N N 32 120.930 120.930 120.649 0.281 25768 7451 1 9 . 1 1 32 32 GLN C C 32 176.000 176.000 174.676 1.324 25768 7452 1 9 . 1 1 32 32 GLN CA C 32 56.280 56.280 56.429 -0.149 25768 7453 1 9 . 1 1 32 32 GLN CB C 32 29.580 29.580 28.917 0.663 25768 7454 1 9 . 1 1 32 32 GLN H H 32 8.170 8.170 8.494 -0.324 25768 7455 1 9 . 1 1 33 33 ARG N N 33 122.370 122.370 122.962 -0.592 25768 7456 1 9 . 1 1 33 33 ARG C C 33 176.820 176.820 176.389 0.431 25768 7457 1 9 . 1 1 33 33 ARG CA C 33 56.680 56.680 55.231 1.449 25768 7458 1 9 . 1 1 33 33 ARG CB C 33 31.040 31.040 31.857 -0.817 25768 7459 1 9 . 1 1 33 33 ARG H H 33 8.270 8.270 8.382 -0.112 25768 7460 1 9 . 1 1 34 34 GLY N N 34 110.210 110.210 109.658 0.552 25768 7461 1 9 . 1 1 34 34 GLY C C 34 174.280 174.280 173.763 0.517 25768 7462 1 9 . 1 1 34 34 GLY CA C 34 45.770 45.770 44.743 1.027 25768 7463 1 9 . 1 1 34 34 GLY H H 34 8.360 8.360 8.526 -0.166 25768 7464 1 9 . 1 1 35 35 THR N N 35 114.100 114.100 114.468 -0.368 25768 7465 1 9 . 1 1 35 35 THR C C 35 174.550 174.550 174.281 0.269 25768 7466 1 9 . 1 1 35 35 THR CA C 35 62.140 62.140 61.188 0.952 25768 7467 1 9 . 1 1 35 35 THR CB C 35 70.330 70.330 71.273 -0.943 25768 7468 1 9 . 1 1 35 35 THR H H 35 7.970 7.970 7.907 0.063 25768 7469 1 9 . 1 1 36 36 LYS N N 36 123.850 123.850 120.818 3.032 25768 7470 1 9 . 1 1 36 36 LYS C C 36 176.040 176.040 175.296 0.744 25768 7471 1 9 . 1 1 36 36 LYS CA C 36 56.600 56.600 55.780 0.820 25768 7472 1 9 . 1 1 36 36 LYS CB C 36 33.280 33.280 32.860 0.420 25768 7473 1 9 . 1 1 36 36 LYS H H 36 8.230 8.230 8.331 -0.101 25768 7474 1 9 . 1 1 37 37 ALA N N 37 125.650 125.650 122.686 2.964 25768 7475 1 9 . 1 1 37 37 ALA C C 37 177.570 177.570 176.274 1.296 25768 7476 1 9 . 1 1 37 37 ALA CA C 37 52.860 52.860 52.199 0.661 25768 7477 1 9 . 1 1 37 37 ALA CB C 37 19.610 19.610 19.762 -0.152 25768 7478 1 9 . 1 1 37 37 ALA H H 37 8.290 8.290 7.606 0.684 25768 7479 1 9 . 1 1 38 38 THR N N 38 113.350 113.350 115.517 -2.167 25768 7480 1 9 . 1 1 38 38 THR C C 38 174.540 174.540 174.581 -0.041 25768 7481 1 9 . 1 1 38 38 THR CA C 38 62.010 62.010 62.011 -0.001 25768 7482 1 9 . 1 1 38 38 THR CB C 38 70.350 70.350 68.519 1.831 25768 7483 1 9 . 1 1 38 38 THR H H 38 7.970 7.970 8.144 -0.174 25768 7484 1 9 . 1 1 39 39 VAL N N 39 120.790 120.790 125.165 -4.375 25768 7485 1 9 . 1 1 39 39 VAL C C 39 175.620 175.620 174.894 0.726 25768 7486 1 9 . 1 1 39 39 VAL CA C 39 62.470 62.470 61.988 0.482 25768 7487 1 9 . 1 1 39 39 VAL CB C 39 32.940 32.940 32.923 0.017 25768 7488 1 9 . 1 1 39 39 VAL H H 39 8.020 8.020 8.296 -0.276 25768 7489 1 9 . 1 1 40 40 ASP N N 40 123.690 123.690 127.307 -3.617 25768 7490 1 9 . 1 1 40 40 ASP C C 40 176.190 176.190 176.324 -0.134 25768 7491 1 9 . 1 1 40 40 ASP CA C 40 54.780 54.780 54.815 -0.035 25768 7492 1 9 . 1 1 40 40 ASP CB C 40 41.590 41.590 40.958 0.632 25768 7493 1 9 . 1 1 40 40 ASP H H 40 8.310 8.310 8.444 -0.134 25768 7494 1 9 . 1 1 41 41 SER N N 41 115.470 115.470 119.570 -4.100 25768 7495 1 9 . 1 1 41 41 SER C C 41 174.170 174.170 175.092 -0.922 25768 7496 1 9 . 1 1 41 41 SER CA C 41 59.000 59.000 59.794 -0.794 25768 7497 1 9 . 1 1 41 41 SER CB C 41 64.420 64.420 63.886 0.534 25768 7498 1 9 . 1 1 41 41 SER H H 41 8.130 8.130 8.353 -0.223 25768 7499 1 9 . 1 1 42 42 ASP N N 42 122.430 122.430 123.308 -0.878 25768 7500 1 9 . 1 1 42 42 ASP C C 42 175.740 175.740 175.964 -0.224 25768 7501 1 9 . 1 1 42 42 ASP CA C 42 54.780 54.780 56.376 -1.596 25768 7502 1 9 . 1 1 42 42 ASP CB C 42 41.620 41.620 40.207 1.413 25768 7503 1 9 . 1 1 42 42 ASP H H 42 8.410 8.410 8.598 -0.188 25768 7504 1 9 . 1 1 43 43 THR N N 43 117.580 117.580 117.465 0.115 25768 7505 1 9 . 1 1 43 43 THR C C 43 173.630 173.630 173.566 0.064 25768 7506 1 9 . 1 1 43 43 THR CA C 43 63.120 63.120 63.239 -0.119 25768 7507 1 9 . 1 1 43 43 THR CB C 43 70.650 70.650 68.248 2.402 25768 7508 1 9 . 1 1 43 43 THR H H 43 8.010 8.010 7.965 0.045 25768 7509 1 9 . 1 1 44 44 GLN N N 44 125.420 125.420 124.367 1.053 25768 7510 1 9 . 1 1 44 44 GLN C C 44 174.080 174.080 174.127 -0.047 25768 7511 1 9 . 1 1 44 44 GLN CA C 44 55.110 55.110 55.236 -0.126 25768 7512 1 9 . 1 1 44 44 GLN CB C 44 31.570 31.570 32.820 -1.250 25768 7513 1 9 . 1 1 44 44 GLN H H 44 9.260 9.260 8.549 0.711 25768 7514 1 9 . 1 1 45 45 LEU N N 45 124.190 124.190 126.052 -1.862 25768 7515 1 9 . 1 1 45 45 LEU C C 45 175.970 175.970 176.076 -0.106 25768 7516 1 9 . 1 1 45 45 LEU CA C 45 54.690 54.690 54.810 -0.120 25768 7517 1 9 . 1 1 45 45 LEU CB C 45 42.270 42.270 42.299 -0.029 25768 7518 1 9 . 1 1 45 45 LEU H H 45 8.550 8.550 8.123 0.427 25768 7519 1 9 . 1 1 46 46 GLY N N 46 113.310 113.310 113.231 0.079 25768 7520 1 9 . 1 1 46 46 GLY C C 46 171.180 171.180 173.064 -1.884 25768 7521 1 9 . 1 1 46 46 GLY CA C 46 44.400 44.400 44.784 -0.384 25768 7522 1 9 . 1 1 46 46 GLY H H 46 8.810 8.810 7.722 1.088 25768 7523 1 9 . 1 1 47 47 LEU N N 47 123.890 123.890 127.617 -3.727 25768 7524 1 9 . 1 1 47 47 LEU C C 47 175.400 175.400 174.721 0.679 25768 7525 1 9 . 1 1 47 47 LEU CA C 47 53.750 53.750 54.213 -0.463 25768 7526 1 9 . 1 1 47 47 LEU CB C 47 46.800 46.800 46.237 0.562 25768 7527 1 9 . 1 1 47 47 LEU H H 47 8.590 8.590 8.611 -0.021 25768 7528 1 9 . 1 1 48 48 THR N N 48 111.210 111.210 113.435 -2.225 25768 7529 1 9 . 1 1 48 48 THR C C 48 172.520 172.520 173.046 -0.526 25768 7530 1 9 . 1 1 48 48 THR CA C 48 58.950 58.950 59.804 -0.855 25768 7531 1 9 . 1 1 48 48 THR CB C 48 72.360 72.360 71.482 0.878 25768 7532 1 9 . 1 1 48 48 THR H H 48 8.620 8.620 8.153 0.467 25768 7533 1 9 . 1 1 49 49 PHE N N 49 118.810 118.810 122.468 -3.658 25768 7534 1 9 . 1 1 49 49 PHE C C 49 174.700 174.700 175.888 -1.188 25768 7535 1 9 . 1 1 49 49 PHE CA C 49 55.080 55.080 56.699 -1.619 25768 7536 1 9 . 1 1 49 49 PHE CB C 49 42.360 42.360 40.824 1.536 25768 7537 1 9 . 1 1 49 49 PHE H H 49 8.410 8.410 8.259 0.151 25768 7538 1 9 . 1 1 50 50 THR N N 50 121.230 121.230 120.666 0.564 25768 7539 1 9 . 1 1 50 50 THR C C 50 173.250 173.250 173.203 0.047 25768 7540 1 9 . 1 1 50 50 THR CA C 50 62.740 62.740 61.968 0.772 25768 7541 1 9 . 1 1 50 50 THR CB C 50 73.740 73.740 70.406 3.334 25768 7542 1 9 . 1 1 50 50 THR H H 50 9.330 9.330 9.032 0.298 25768 7543 1 9 . 1 1 51 51 TYR N N 51 126.010 126.010 127.319 -1.309 25768 7544 1 9 . 1 1 51 51 TYR C C 51 174.850 174.850 175.165 -0.315 25768 7545 1 9 . 1 1 51 51 TYR CA C 51 56.240 56.240 56.788 -0.548 25768 7546 1 9 . 1 1 51 51 TYR CB C 51 41.630 41.630 40.295 1.335 25768 7547 1 9 . 1 1 51 51 TYR H H 51 9.150 9.150 9.281 -0.131 25768 7548 1 9 . 1 1 52 52 MET N N 52 127.390 127.390 127.343 0.047 25768 7549 1 9 . 1 1 52 52 MET C C 52 174.490 174.490 174.262 0.228 25768 7550 1 9 . 1 1 52 52 MET CA C 52 52.450 52.450 56.817 -4.367 25768 7551 1 9 . 1 1 52 52 MET CB C 52 28.590 28.590 32.881 -4.291 25768 7552 1 9 . 1 1 52 52 MET H H 52 7.950 7.950 8.497 -0.547 25768 7553 1 9 . 1 1 53 53 PHE N N 53 123.830 123.830 127.596 -3.766 25768 7554 1 9 . 1 1 53 53 PHE C C 53 173.720 173.720 173.827 -0.107 25768 7555 1 9 . 1 1 53 53 PHE CA C 53 57.110 57.110 56.976 0.134 25768 7556 1 9 . 1 1 53 53 PHE CB C 53 39.420 39.420 41.326 -1.906 25768 7557 1 9 . 1 1 53 53 PHE H H 53 7.720 7.720 8.277 -0.557 25768 7558 1 9 . 1 1 54 54 ALA N N 54 125.650 125.650 128.073 -2.423 25768 7559 1 9 . 1 1 54 54 ALA C C 54 175.020 175.020 175.411 -0.391 25768 7560 1 9 . 1 1 54 54 ALA CA C 54 50.740 50.740 53.258 -2.518 25768 7561 1 9 . 1 1 54 54 ALA CB C 54 22.700 22.700 18.800 3.900 25768 7562 1 9 . 1 1 54 54 ALA H H 54 8.360 8.360 8.297 0.063 25768 7563 1 9 . 1 1 55 55 ASP N N 55 118.790 118.790 121.401 -2.611 25768 7564 1 9 . 1 1 55 55 ASP C C 55 174.780 174.780 175.937 -1.157 25768 7565 1 9 . 1 1 55 55 ASP CA C 55 58.590 58.590 54.906 3.684 25768 7566 1 9 . 1 1 55 55 ASP CB C 55 40.430 40.430 40.575 -0.145 25768 7567 1 9 . 1 1 55 55 ASP H H 55 8.590 8.590 8.660 -0.070 25768 7568 1 9 . 1 1 56 56 LYS N N 56 106.200 106.200 116.698 -10.498 25768 7569 1 9 . 1 1 56 56 LYS C C 56 174.940 174.940 175.218 -0.278 25768 7570 1 9 . 1 1 56 56 LYS CA C 56 55.260 55.260 56.770 -1.510 25768 7571 1 9 . 1 1 56 56 LYS CB C 56 34.510 34.510 35.164 -0.654 25768 7572 1 9 . 1 1 56 56 LYS H H 56 7.260 7.260 7.458 -0.198 25768 7573 1 9 . 1 1 57 57 TRP N N 57 115.680 115.680 120.483 -4.803 25768 7574 1 9 . 1 1 57 57 TRP C C 57 173.940 173.940 175.516 -1.576 25768 7575 1 9 . 1 1 57 57 TRP CA C 57 55.410 55.410 56.716 -1.306 25768 7576 1 9 . 1 1 57 57 TRP CB C 57 34.470 34.470 31.938 2.532 25768 7577 1 9 . 1 1 57 57 TRP H H 57 6.570 6.570 8.011 -1.442 25768 7578 1 9 . 1 1 58 58 GLY N N 58 107.610 107.610 107.423 0.187 25768 7579 1 9 . 1 1 58 58 GLY C C 58 172.730 172.730 172.147 0.583 25768 7580 1 9 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.767 -0.717 25768 7581 1 9 . 1 1 58 58 GLY H H 58 9.260 9.260 8.587 0.673 25768 7582 1 9 . 1 1 59 59 VAL N N 59 118.130 118.130 124.813 -6.683 25768 7583 1 9 . 1 1 59 59 VAL C C 59 173.000 173.000 174.334 -1.334 25768 7584 1 9 . 1 1 59 59 VAL CA C 59 59.950 59.950 61.977 -2.027 25768 7585 1 9 . 1 1 59 59 VAL CB C 59 35.170 35.170 33.425 1.746 25768 7586 1 9 . 1 1 59 59 VAL H H 59 9.030 9.030 8.371 0.659 25768 7587 1 9 . 1 1 60 60 GLU N N 60 127.900 127.900 128.277 -0.377 25768 7588 1 9 . 1 1 60 60 GLU C C 60 174.470 174.470 174.892 -0.422 25768 7589 1 9 . 1 1 60 60 GLU CA C 60 52.940 52.940 54.490 -1.550 25768 7590 1 9 . 1 1 60 60 GLU CB C 60 35.100 35.100 33.825 1.275 25768 7591 1 9 . 1 1 60 60 GLU H H 60 9.440 9.440 9.135 0.305 25768 7592 1 9 . 1 1 61 61 LEU N N 61 127.410 127.410 124.928 2.482 25768 7593 1 9 . 1 1 61 61 LEU C C 61 174.950 174.950 175.671 -0.721 25768 7594 1 9 . 1 1 61 61 LEU CA C 61 53.390 53.390 53.829 -0.439 25768 7595 1 9 . 1 1 61 61 LEU CB C 61 45.980 45.980 45.549 0.431 25768 7596 1 9 . 1 1 61 61 LEU H H 61 8.740 8.740 8.316 0.424 25768 7597 1 9 . 1 1 62 62 VAL N N 62 125.750 125.750 120.204 5.546 25768 7598 1 9 . 1 1 62 62 VAL C C 62 173.960 173.960 174.943 -0.983 25768 7599 1 9 . 1 1 62 62 VAL CA C 62 61.350 61.350 61.295 0.055 25768 7600 1 9 . 1 1 62 62 VAL CB C 62 34.740 34.740 33.844 0.896 25768 7601 1 9 . 1 1 62 62 VAL H H 62 8.790 8.790 7.837 0.953 25768 7602 1 9 . 1 1 63 63 ALA N N 63 127.230 127.230 127.036 0.194 25768 7603 1 9 . 1 1 63 63 ALA C C 63 173.930 173.930 174.694 -0.764 25768 7604 1 9 . 1 1 63 63 ALA CA C 63 51.140 51.140 52.031 -0.891 25768 7605 1 9 . 1 1 63 63 ALA CB C 63 22.500 22.500 21.931 0.569 25768 7606 1 9 . 1 1 63 63 ALA H H 63 8.740 8.740 8.533 0.207 25768 7607 1 9 . 1 1 64 64 ALA N N 64 120.410 120.410 124.309 -3.899 25768 7608 1 9 . 1 1 64 64 ALA C C 64 176.770 176.770 176.270 0.500 25768 7609 1 9 . 1 1 64 64 ALA CA C 64 51.420 51.420 50.364 1.056 25768 7610 1 9 . 1 1 64 64 ALA CB C 64 22.590 22.590 23.029 -0.439 25768 7611 1 9 . 1 1 64 64 ALA H H 64 8.290 8.290 8.198 0.092 25768 7612 1 9 . 1 1 65 65 THR N N 65 116.130 116.130 110.814 5.316 25768 7613 1 9 . 1 1 65 65 THR C C 65 171.220 171.220 172.627 -1.407 25768 7614 1 9 . 1 1 65 65 THR CA C 65 58.860 58.860 59.106 -0.246 25768 7615 1 9 . 1 1 65 65 THR CB C 65 72.020 72.020 69.129 2.891 25768 7616 1 9 . 1 1 65 65 THR H H 65 8.760 8.760 7.902 0.858 25768 7617 1 9 . 1 1 66 66 PRO C C 66 176.720 176.720 176.608 0.112 25768 7618 1 9 . 1 1 66 66 PRO CA C 66 63.610 63.610 62.123 1.487 25768 7619 1 9 . 1 1 66 66 PRO CB C 66 32.550 32.550 29.904 2.646 25768 7620 1 9 . 1 1 67 67 PHE N N 67 120.360 120.360 118.872 1.488 25768 7621 1 9 . 1 1 67 67 PHE C C 67 175.480 175.480 174.607 0.873 25768 7622 1 9 . 1 1 67 67 PHE CA C 67 58.840 58.840 59.670 -0.830 25768 7623 1 9 . 1 1 67 67 PHE CB C 67 40.170 40.170 37.973 2.197 25768 7624 1 9 . 1 1 67 67 PHE H H 67 8.590 8.590 8.084 0.506 25768 7625 1 9 . 1 1 68 68 ASN N N 68 119.030 119.030 118.923 0.107 25768 7626 1 9 . 1 1 68 68 ASN C C 68 174.740 174.740 175.394 -0.654 25768 7627 1 9 . 1 1 68 68 ASN CA C 68 53.430 53.430 52.315 1.115 25768 7628 1 9 . 1 1 68 68 ASN CB C 68 39.420 39.420 39.874 -0.454 25768 7629 1 9 . 1 1 68 68 ASN H H 68 8.340 8.340 8.593 -0.253 25768 7630 1 9 . 1 1 69 69 HIS N N 69 119.590 119.590 119.795 -0.205 25768 7631 1 9 . 1 1 69 69 HIS C C 69 174.370 174.370 174.611 -0.241 25768 7632 1 9 . 1 1 69 69 HIS CA C 69 55.950 55.950 55.037 0.913 25768 7633 1 9 . 1 1 69 69 HIS CB C 69 29.960 29.960 28.559 1.401 25768 7634 1 9 . 1 1 69 69 HIS H H 69 8.350 8.350 8.794 -0.444 25768 7635 1 9 . 1 1 70 70 GLN N N 70 121.980 121.980 122.193 -0.213 25768 7636 1 9 . 1 1 70 70 GLN C C 70 175.740 175.740 174.742 0.998 25768 7637 1 9 . 1 1 70 70 GLN CA C 70 56.340 56.340 55.505 0.835 25768 7638 1 9 . 1 1 70 70 GLN CB C 70 29.660 29.660 31.575 -1.915 25768 7639 1 9 . 1 1 70 70 GLN H H 70 8.350 8.350 8.021 0.329 25768 7640 1 9 . 1 1 71 71 VAL N N 71 120.530 120.530 118.767 1.763 25768 7641 1 9 . 1 1 71 71 VAL C C 71 175.500 175.500 175.182 0.318 25768 7642 1 9 . 1 1 71 71 VAL CA C 71 62.540 62.540 61.775 0.765 25768 7643 1 9 . 1 1 71 71 VAL CB C 71 33.090 33.090 32.947 0.143 25768 7644 1 9 . 1 1 71 71 VAL H H 71 8.020 8.020 8.183 -0.163 25768 7645 1 9 . 1 1 72 72 ASP N N 72 123.910 123.910 123.499 0.411 25768 7646 1 9 . 1 1 72 72 ASP C C 72 176.300 176.300 175.825 0.475 25768 7647 1 9 . 1 1 72 72 ASP CA C 72 54.340 54.340 53.504 0.836 25768 7648 1 9 . 1 1 72 72 ASP CB C 72 41.480 41.480 43.331 -1.851 25768 7649 1 9 . 1 1 72 72 ASP H H 72 8.280 8.280 8.151 0.129 25768 7650 1 9 . 1 1 73 73 VAL N N 73 120.580 120.580 117.469 3.111 25768 7651 1 9 . 1 1 73 73 VAL C C 73 176.350 176.350 174.723 1.627 25768 7652 1 9 . 1 1 73 73 VAL CA C 73 62.970 62.970 61.965 1.005 25768 7653 1 9 . 1 1 73 73 VAL CB C 73 32.550 32.550 32.680 -0.130 25768 7654 1 9 . 1 1 73 73 VAL H H 73 7.960 7.960 8.322 -0.362 25768 7655 1 9 . 1 1 74 74 LYS N N 74 123.620 123.620 120.405 3.215 25768 7656 1 9 . 1 1 74 74 LYS C C 74 177.130 177.130 176.476 0.654 25768 7657 1 9 . 1 1 74 74 LYS CA C 74 57.060 57.060 56.348 0.712 25768 7658 1 9 . 1 1 74 74 LYS CB C 74 32.860 32.860 34.187 -1.327 25768 7659 1 9 . 1 1 74 74 LYS H H 74 8.230 8.230 7.584 0.646 25768 7660 1 9 . 1 1 75 75 GLY N N 75 109.370 109.370 110.686 -1.316 25768 7661 1 9 . 1 1 75 75 GLY C C 75 174.030 174.030 174.687 -0.657 25768 7662 1 9 . 1 1 75 75 GLY CA C 75 45.800 45.800 45.760 0.040 25768 7663 1 9 . 1 1 75 75 GLY H H 75 8.160 8.160 8.311 -0.151 25768 7664 1 9 . 1 1 76 76 LEU N N 76 121.660 121.660 122.207 -0.547 25768 7665 1 9 . 1 1 76 76 LEU C C 76 177.410 177.410 175.908 1.502 25768 7666 1 9 . 1 1 76 76 LEU CA C 76 55.410 55.410 55.037 0.373 25768 7667 1 9 . 1 1 76 76 LEU CB C 76 42.790 42.790 43.162 -0.372 25768 7668 1 9 . 1 1 76 76 LEU H H 76 8.030 8.030 7.610 0.420 25768 7669 1 9 . 1 1 77 77 GLY N N 77 109.330 109.330 112.515 -3.185 25768 7670 1 9 . 1 1 77 77 GLY C C 77 171.800 171.800 172.222 -0.422 25768 7671 1 9 . 1 1 77 77 GLY CA C 77 44.990 44.990 45.388 -0.398 25768 7672 1 9 . 1 1 77 77 GLY H H 77 8.100 8.100 8.110 -0.010 25768 7673 1 9 . 1 1 78 78 PRO C C 78 177.740 177.740 176.351 1.389 25768 7674 1 9 . 1 1 78 78 PRO CA C 78 63.890 63.890 62.985 0.905 25768 7675 1 9 . 1 1 78 78 PRO CB C 78 32.170 32.170 31.726 0.444 25768 7676 1 9 . 1 1 79 79 GLY N N 79 109.530 109.530 111.397 -1.867 25768 7677 1 9 . 1 1 79 79 GLY C C 79 174.460 174.460 174.088 0.372 25768 7678 1 9 . 1 1 79 79 GLY CA C 79 45.780 45.780 45.042 0.738 25768 7679 1 9 . 1 1 79 79 GLY H H 79 8.410 8.410 8.316 0.094 25768 7680 1 9 . 1 1 80 80 LEU N N 80 121.880 121.880 121.789 0.091 25768 7681 1 9 . 1 1 80 80 LEU C C 80 177.100 177.100 177.789 -0.689 25768 7682 1 9 . 1 1 80 80 LEU CA C 80 55.720 55.720 56.338 -0.618 25768 7683 1 9 . 1 1 80 80 LEU CB C 80 42.580 42.580 42.285 0.295 25768 7684 1 9 . 1 1 80 80 LEU H H 80 8.010 8.010 8.298 -0.288 25768 7685 1 9 . 1 1 81 81 ASP N N 81 119.990 119.990 119.341 0.649 25768 7686 1 9 . 1 1 81 81 ASP C C 81 176.880 176.880 176.567 0.313 25768 7687 1 9 . 1 1 81 81 ASP CA C 81 54.770 54.770 54.498 0.272 25768 7688 1 9 . 1 1 81 81 ASP CB C 81 41.390 41.390 41.457 -0.067 25768 7689 1 9 . 1 1 81 81 ASP H H 81 8.220 8.220 8.207 0.013 25768 7690 1 9 . 1 1 82 82 GLY N N 82 109.270 109.270 106.836 2.434 25768 7691 1 9 . 1 1 82 82 GLY C C 82 174.190 174.190 174.385 -0.195 25768 7692 1 9 . 1 1 82 82 GLY CA C 82 45.990 45.990 44.922 1.068 25768 7693 1 9 . 1 1 82 82 GLY H H 82 8.170 8.170 8.635 -0.465 25768 7694 1 9 . 1 1 83 83 LYS N N 83 121.000 121.000 120.253 0.747 25768 7695 1 9 . 1 1 83 83 LYS C C 83 176.610 176.610 176.988 -0.378 25768 7696 1 9 . 1 1 83 83 LYS CA C 83 56.620 56.620 57.742 -1.122 25768 7697 1 9 . 1 1 83 83 LYS CB C 83 33.020 33.020 32.862 0.158 25768 7698 1 9 . 1 1 83 83 LYS H H 83 7.970 7.970 8.356 -0.386 25768 7699 1 9 . 1 1 84 84 LEU N N 84 123.120 123.120 119.716 3.404 25768 7700 1 9 . 1 1 84 84 LEU C C 84 176.920 176.920 175.997 0.923 25768 7701 1 9 . 1 1 84 84 LEU CA C 84 55.550 55.550 54.617 0.933 25768 7702 1 9 . 1 1 84 84 LEU CB C 84 42.430 42.430 42.368 0.062 25768 7703 1 9 . 1 1 84 84 LEU H H 84 8.130 8.130 8.115 0.015 25768 7704 1 9 . 1 1 85 85 ALA N N 85 123.930 123.930 123.375 0.555 25768 7705 1 9 . 1 1 85 85 ALA C C 85 177.060 177.060 176.267 0.793 25768 7706 1 9 . 1 1 85 85 ALA CA C 85 52.790 52.790 51.658 1.131 25768 7707 1 9 . 1 1 85 85 ALA CB C 85 19.670 19.670 19.462 0.208 25768 7708 1 9 . 1 1 85 85 ALA H H 85 8.040 8.040 7.497 0.543 25768 7709 1 9 . 1 1 86 86 ASP N N 86 119.760 119.760 120.873 -1.113 25768 7710 1 9 . 1 1 86 86 ASP C C 86 175.820 175.820 175.286 0.534 25768 7711 1 9 . 1 1 86 86 ASP CA C 86 54.520 54.520 53.385 1.135 25768 7712 1 9 . 1 1 86 86 ASP CB C 86 41.390 41.390 44.489 -3.099 25768 7713 1 9 . 1 1 86 86 ASP H H 86 8.110 8.110 8.102 0.008 25768 7714 1 9 . 1 1 87 87 ILE N N 87 120.620 120.620 117.892 2.728 25768 7715 1 9 . 1 1 87 87 ILE C C 87 175.740 175.740 174.837 0.903 25768 7716 1 9 . 1 1 87 87 ILE CA C 87 61.160 61.160 61.042 0.118 25768 7717 1 9 . 1 1 87 87 ILE CB C 87 39.260 39.260 38.913 0.347 25768 7718 1 9 . 1 1 87 87 ILE H H 87 7.800 7.800 8.237 -0.437 25768 7719 1 9 . 1 1 88 88 LYS N N 88 125.820 125.820 125.021 0.799 25768 7720 1 9 . 1 1 88 88 LYS C C 88 175.340 175.340 175.857 -0.517 25768 7721 1 9 . 1 1 88 88 LYS CA C 88 56.300 56.300 55.733 0.567 25768 7722 1 9 . 1 1 88 88 LYS CB C 88 32.900 32.900 35.305 -2.405 25768 7723 1 9 . 1 1 88 88 LYS H H 88 8.250 8.250 8.367 -0.117 25768 7724 1 9 . 1 1 89 89 GLN N N 89 121.750 121.750 122.462 -0.712 25768 7725 1 9 . 1 1 89 89 GLN C C 89 175.000 175.000 174.592 0.408 25768 7726 1 9 . 1 1 89 89 GLN CA C 89 55.210 55.210 55.331 -0.121 25768 7727 1 9 . 1 1 89 89 GLN CB C 89 30.570 30.570 29.997 0.573 25768 7728 1 9 . 1 1 89 89 GLN H H 89 8.000 8.000 8.553 -0.553 25768 7729 1 9 . 1 1 90 90 LEU N N 90 126.660 126.660 126.643 0.017 25768 7730 1 9 . 1 1 90 90 LEU C C 90 174.240 174.240 175.131 -0.891 25768 7731 1 9 . 1 1 90 90 LEU CA C 90 52.720 52.720 52.569 0.151 25768 7732 1 9 . 1 1 90 90 LEU CB C 90 42.350 42.350 42.956 -0.606 25768 7733 1 9 . 1 1 90 90 LEU H H 90 8.630 8.630 8.596 0.034 25768 7734 1 9 . 1 1 92 92 PRO C C 92 173.900 173.900 175.982 -2.082 25768 7735 1 9 . 1 1 92 92 PRO CA C 92 63.320 63.320 62.855 0.465 25768 7736 1 9 . 1 1 92 92 PRO CB C 92 31.920 31.920 32.194 -0.275 25768 7737 1 9 . 1 1 93 93 THR N N 93 119.770 119.770 115.641 4.129 25768 7738 1 9 . 1 1 93 93 THR C C 93 171.360 171.360 173.055 -1.695 25768 7739 1 9 . 1 1 93 93 THR CA C 93 62.610 62.610 61.859 0.751 25768 7740 1 9 . 1 1 93 93 THR CB C 93 72.680 72.680 71.116 1.564 25768 7741 1 9 . 1 1 93 93 THR H H 93 8.290 8.290 8.183 0.107 25768 7742 1 9 . 1 1 94 94 LEU N N 94 128.880 128.880 126.316 2.564 25768 7743 1 9 . 1 1 94 94 LEU C C 94 175.130 175.130 174.833 0.297 25768 7744 1 9 . 1 1 94 94 LEU CA C 94 53.520 53.520 54.874 -1.354 25768 7745 1 9 . 1 1 94 94 LEU CB C 94 46.140 46.140 43.943 2.197 25768 7746 1 9 . 1 1 94 94 LEU H H 94 8.680 8.680 8.982 -0.302 25768 7747 1 9 . 1 1 95 95 LEU N N 95 123.630 123.630 125.488 -1.858 25768 7748 1 9 . 1 1 95 95 LEU C C 95 175.540 175.540 174.352 1.188 25768 7749 1 9 . 1 1 95 95 LEU CA C 95 55.190 55.190 53.796 1.394 25768 7750 1 9 . 1 1 95 95 LEU CB C 95 45.300 45.300 46.155 -0.855 25768 7751 1 9 . 1 1 95 95 LEU H H 95 9.580 9.580 8.986 0.594 25768 7752 1 9 . 1 1 96 96 LEU N N 96 123.150 123.150 127.443 -4.293 25768 7753 1 9 . 1 1 96 96 LEU C C 96 174.960 174.960 175.066 -0.106 25768 7754 1 9 . 1 1 96 96 LEU CA C 96 54.420 54.420 54.915 -0.495 25768 7755 1 9 . 1 1 96 96 LEU CB C 96 44.560 44.560 43.030 1.530 25768 7756 1 9 . 1 1 96 96 LEU H H 96 8.770 8.770 9.143 -0.373 25768 7757 1 9 . 1 1 97 97 GLN N N 97 121.290 121.290 126.231 -4.941 25768 7758 1 9 . 1 1 97 97 GLN C C 97 174.380 174.380 174.231 0.149 25768 7759 1 9 . 1 1 97 97 GLN CA C 97 54.740 54.740 53.517 1.223 25768 7760 1 9 . 1 1 97 97 GLN CB C 97 36.600 36.600 31.991 4.609 25768 7761 1 9 . 1 1 97 97 GLN H H 97 9.480 9.480 8.965 0.515 25768 7762 1 9 . 1 1 98 98 TYR N N 98 122.250 122.250 119.081 3.169 25768 7763 1 9 . 1 1 98 98 TYR C C 98 173.460 173.460 173.407 0.053 25768 7764 1 9 . 1 1 98 98 TYR CA C 98 55.160 55.160 55.236 -0.076 25768 7765 1 9 . 1 1 98 98 TYR CB C 98 42.420 42.420 40.492 1.928 25768 7766 1 9 . 1 1 98 98 TYR H H 98 9.010 9.010 8.670 0.340 25768 7767 1 9 . 1 1 99 99 TYR N N 99 126.860 126.860 122.092 4.768 25768 7768 1 9 . 1 1 99 99 TYR C C 99 175.380 175.380 175.535 -0.155 25768 7769 1 9 . 1 1 99 99 TYR CA C 99 54.220 54.220 56.367 -2.147 25768 7770 1 9 . 1 1 99 99 TYR CB C 99 38.890 38.890 38.034 0.856 25768 7771 1 9 . 1 1 99 99 TYR H H 99 8.300 8.300 7.941 0.359 25768 7772 1 9 . 1 1 100 100 PRO C C 100 178.330 178.330 176.803 1.527 25768 7773 1 9 . 1 1 100 100 PRO CA C 100 64.750 64.750 64.733 0.017 25768 7774 1 9 . 1 1 100 100 PRO CB C 100 32.130 32.130 32.153 -0.023 25768 7775 1 9 . 1 1 101 101 MET N N 101 114.520 114.520 117.705 -3.185 25768 7776 1 9 . 1 1 101 101 MET C C 101 178.240 178.240 175.249 2.991 25768 7777 1 9 . 1 1 101 101 MET CA C 101 53.500 53.500 54.421 -0.921 25768 7778 1 9 . 1 1 101 101 MET CB C 101 30.160 30.160 33.953 -3.793 25768 7779 1 9 . 1 1 101 101 MET H H 101 9.390 9.390 7.854 1.536 25768 7780 1 9 . 1 1 102 102 GLY N N 102 117.500 117.500 107.546 9.954 25768 7781 1 9 . 1 1 102 102 GLY C C 102 175.690 175.690 173.972 1.718 25768 7782 1 9 . 1 1 102 102 GLY CA C 102 46.760 46.760 45.025 1.736 25768 7783 1 9 . 1 1 102 102 GLY H H 102 8.640 8.640 7.864 0.776 25768 7784 1 9 . 1 1 103 103 GLY N N 103 111.030 111.030 110.230 0.800 25768 7785 1 9 . 1 1 103 103 GLY C C 103 174.070 174.070 173.711 0.359 25768 7786 1 9 . 1 1 103 103 GLY CA C 103 46.140 46.140 44.562 1.578 25768 7787 1 9 . 1 1 103 103 GLY H H 103 9.390 9.390 8.263 1.127 25768 7788 1 9 . 1 1 104 104 THR N N 104 109.290 109.290 112.369 -3.079 25768 7789 1 9 . 1 1 104 104 THR C C 104 174.290 174.290 173.812 0.478 25768 7790 1 9 . 1 1 104 104 THR CA C 104 60.900 60.900 60.178 0.722 25768 7791 1 9 . 1 1 104 104 THR CB C 104 72.070 72.070 69.874 2.196 25768 7792 1 9 . 1 1 104 104 THR H H 104 7.290 7.290 7.443 -0.153 25768 7793 1 9 . 1 1 105 105 ASN C C 105 175.050 175.050 174.237 0.813 25768 7794 1 9 . 1 1 105 105 ASN CA C 105 52.880 52.880 52.883 -0.003 25768 7795 1 9 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.749 -0.489 25768 7796 1 9 . 1 1 106 106 SER N N 106 113.000 113.000 115.890 -2.890 25768 7797 1 9 . 1 1 106 106 SER C C 106 176.000 176.000 174.259 1.741 25768 7798 1 9 . 1 1 106 106 SER CA C 106 58.700 58.700 58.196 0.504 25768 7799 1 9 . 1 1 106 106 SER CB C 106 64.540 64.540 64.152 0.388 25768 7800 1 9 . 1 1 106 106 SER H H 106 7.450 7.450 7.296 0.154 25768 7801 1 9 . 1 1 107 107 ALA N N 107 132.220 132.220 122.733 9.487 25768 7802 1 9 . 1 1 107 107 ALA C C 107 176.610 176.610 176.946 -0.336 25768 7803 1 9 . 1 1 107 107 ALA CA C 107 54.380 54.380 53.062 1.318 25768 7804 1 9 . 1 1 107 107 ALA CB C 107 18.690 18.690 19.654 -0.964 25768 7805 1 9 . 1 1 107 107 ALA H H 107 8.870 8.870 8.392 0.478 25768 7806 1 9 . 1 1 108 108 PHE N N 108 116.050 116.050 116.699 -0.649 25768 7807 1 9 . 1 1 108 108 PHE C C 108 174.270 174.270 174.878 -0.608 25768 7808 1 9 . 1 1 108 108 PHE CA C 108 56.140 56.140 55.870 0.270 25768 7809 1 9 . 1 1 108 108 PHE CB C 108 40.520 40.520 39.312 1.208 25768 7810 1 9 . 1 1 108 108 PHE H H 108 7.550 7.550 7.365 0.185 25768 7811 1 9 . 1 1 109 109 GLN N N 109 128.260 128.260 125.956 2.304 25768 7812 1 9 . 1 1 109 109 GLN C C 109 172.300 172.300 174.058 -1.758 25768 7813 1 9 . 1 1 109 109 GLN CA C 109 52.310 52.310 53.291 -0.981 25768 7814 1 9 . 1 1 109 109 GLN CB C 109 29.050 29.050 30.805 -1.755 25768 7815 1 9 . 1 1 109 109 GLN H H 109 9.060 9.060 8.378 0.682 25768 7816 1 9 . 1 1 110 110 PRO C C 110 175.020 175.020 176.070 -1.050 25768 7817 1 9 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.816 -1.266 25768 7818 1 9 . 1 1 110 110 PRO CB C 110 33.280 33.280 32.072 1.208 25768 7819 1 9 . 1 1 111 111 TYR N N 111 115.730 115.730 119.213 -3.483 25768 7820 1 9 . 1 1 111 111 TYR C C 111 173.850 173.850 174.608 -0.758 25768 7821 1 9 . 1 1 111 111 TYR CA C 111 56.470 56.470 57.256 -0.786 25768 7822 1 9 . 1 1 111 111 TYR CB C 111 38.650 38.650 41.878 -3.228 25768 7823 1 9 . 1 1 111 111 TYR H H 111 8.500 8.500 8.133 0.367 25768 7824 1 9 . 1 1 112 112 GLY N N 112 103.570 103.570 113.248 -9.678 25768 7825 1 9 . 1 1 112 112 GLY C C 112 172.020 172.020 172.452 -0.432 25768 7826 1 9 . 1 1 112 112 GLY CA C 112 43.950 43.950 43.664 0.286 25768 7827 1 9 . 1 1 112 112 GLY H H 112 8.110 8.110 7.984 0.126 25768 7828 1 9 . 1 1 113 113 GLY N N 113 108.510 108.510 112.526 -4.016 25768 7829 1 9 . 1 1 113 113 GLY C C 113 171.540 171.540 172.197 -0.657 25768 7830 1 9 . 1 1 113 113 GLY CA C 113 46.120 46.120 43.214 2.906 25768 7831 1 9 . 1 1 113 113 GLY H H 113 9.080 9.080 8.204 0.876 25768 7832 1 9 . 1 1 114 114 LEU N N 114 120.270 120.270 122.310 -2.040 25768 7833 1 9 . 1 1 114 114 LEU C C 114 175.810 175.810 175.020 0.790 25768 7834 1 9 . 1 1 114 114 LEU CA C 114 53.920 53.920 55.269 -1.349 25768 7835 1 9 . 1 1 114 114 LEU CB C 114 47.940 47.940 47.353 0.587 25768 7836 1 9 . 1 1 114 114 LEU H H 114 8.620 8.620 8.136 0.484 25768 7837 1 9 . 1 1 115 115 GLY N N 115 110.620 110.620 111.329 -0.709 25768 7838 1 9 . 1 1 115 115 GLY C C 115 171.560 171.560 173.084 -1.524 25768 7839 1 9 . 1 1 115 115 GLY CA C 115 46.940 46.940 44.437 2.503 25768 7840 1 9 . 1 1 115 115 GLY H H 115 9.000 9.000 9.097 -0.097 25768 7841 1 9 . 1 1 116 116 VAL N N 116 113.600 113.600 119.742 -6.142 25768 7842 1 9 . 1 1 116 116 VAL C C 116 174.120 174.120 173.982 0.138 25768 7843 1 9 . 1 1 116 116 VAL CA C 116 58.970 58.970 60.201 -1.231 25768 7844 1 9 . 1 1 116 116 VAL CB C 116 36.600 36.600 33.952 2.648 25768 7845 1 9 . 1 1 116 116 VAL H H 116 8.680 8.680 7.609 1.071 25768 7846 1 9 . 1 1 117 117 ASN N N 117 120.020 120.020 121.357 -1.337 25768 7847 1 9 . 1 1 117 117 ASN CA C 117 52.190 52.190 52.335 -0.145 25768 7848 1 9 . 1 1 117 117 ASN CB C 117 42.450 42.450 40.148 2.302 25768 7849 1 9 . 1 1 117 117 ASN H H 117 8.840 8.840 8.307 0.533 25768 7850 1 9 . 1 1 119 119 THR C C 119 174.350 174.350 173.343 1.007 25768 7851 1 9 . 1 1 119 119 THR CA C 119 63.140 63.140 61.574 1.566 25768 7852 1 9 . 1 1 119 119 THR CB C 119 70.170 70.170 71.125 -0.955 25768 7853 1 9 . 1 1 120 120 THR N N 120 114.120 114.120 113.958 0.162 25768 7854 1 9 . 1 1 120 120 THR C C 120 174.220 174.220 172.725 1.495 25768 7855 1 9 . 1 1 120 120 THR CA C 120 61.900 61.900 61.852 0.048 25768 7856 1 9 . 1 1 120 120 THR CB C 120 70.140 70.140 69.957 0.183 25768 7857 1 9 . 1 1 120 120 THR H H 120 7.570 7.570 7.870 -0.300 25768 7858 1 9 . 1 1 121 121 PHE N N 121 121.230 121.230 126.449 -5.219 25768 7859 1 9 . 1 1 121 121 PHE C C 121 174.910 174.910 175.194 -0.284 25768 7860 1 9 . 1 1 121 121 PHE CA C 121 58.720 58.720 58.219 0.501 25768 7861 1 9 . 1 1 121 121 PHE CB C 121 40.470 40.470 38.299 2.171 25768 7862 1 9 . 1 1 121 121 PHE H H 121 7.830 7.830 8.586 -0.756 25768 7863 1 9 . 1 1 122 122 PHE C C 122 175.070 175.070 174.604 0.466 25768 7864 1 9 . 1 1 122 122 PHE CA C 122 57.890 57.890 59.286 -1.396 25768 7865 1 9 . 1 1 122 122 PHE CB C 122 39.870 39.870 39.191 0.679 25768 7866 1 9 . 1 1 123 123 ASP N N 123 122.170 122.170 119.315 2.855 25768 7867 1 9 . 1 1 123 123 ASP C C 123 176.150 176.150 176.176 -0.026 25768 7868 1 9 . 1 1 123 123 ASP CA C 123 54.530 54.530 53.794 0.736 25768 7869 1 9 . 1 1 123 123 ASP CB C 123 41.830 41.830 42.081 -0.251 25768 7870 1 9 . 1 1 123 123 ASP H H 123 7.950 7.950 8.204 -0.254 25768 7871 1 9 . 1 1 124 124 GLU N N 124 122.690 122.690 119.545 3.145 25768 7872 1 9 . 1 1 124 124 GLU C C 124 176.630 176.630 177.861 -1.231 25768 7873 1 9 . 1 1 124 124 GLU CA C 124 57.620 57.620 58.800 -1.179 25768 7874 1 9 . 1 1 124 124 GLU CB C 124 30.450 30.450 29.978 0.472 25768 7875 1 9 . 1 1 124 124 GLU H H 124 8.340 8.340 8.709 -0.369 25768 7876 1 9 . 1 1 125 125 ASP N N 125 121.280 121.280 119.351 1.929 25768 7877 1 9 . 1 1 125 125 ASP C C 125 176.940 176.940 177.299 -0.359 25768 7878 1 9 . 1 1 125 125 ASP CA C 125 55.180 55.180 56.736 -1.556 25768 7879 1 9 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.862 0.358 25768 7880 1 9 . 1 1 125 125 ASP H H 125 8.310 8.310 8.354 -0.044 25768 7881 1 9 . 1 1 126 126 LEU N N 126 122.830 122.830 117.671 5.159 25768 7882 1 9 . 1 1 126 126 LEU C C 126 178.020 178.020 177.990 0.030 25768 7883 1 9 . 1 1 126 126 LEU CA C 126 56.450 56.450 56.178 0.272 25768 7884 1 9 . 1 1 126 126 LEU CB C 126 42.150 42.150 41.956 0.194 25768 7885 1 9 . 1 1 126 126 LEU H H 126 8.010 8.010 7.604 0.406 25768 7886 1 9 . 1 1 127 127 ALA N N 127 122.660 122.660 120.516 2.144 25768 7887 1 9 . 1 1 127 127 ALA C C 127 178.600 178.600 177.451 1.149 25768 7888 1 9 . 1 1 127 127 ALA CA C 127 53.780 53.780 53.884 -0.104 25768 7889 1 9 . 1 1 127 127 ALA CB C 127 19.000 19.000 19.473 -0.473 25768 7890 1 9 . 1 1 127 127 ALA H H 127 8.100 8.100 7.629 0.471 25768 7891 1 9 . 1 1 128 128 SER N N 128 113.740 113.740 109.997 3.743 25768 7892 1 9 . 1 1 128 128 SER C C 128 175.010 175.010 173.260 1.750 25768 7893 1 9 . 1 1 128 128 SER CA C 128 59.580 59.580 58.125 1.455 25768 7894 1 9 . 1 1 128 128 SER CB C 128 63.800 63.800 64.816 -1.016 25768 7895 1 9 . 1 1 128 128 SER H H 128 7.920 7.920 7.604 0.316 25768 7896 1 9 . 1 1 129 129 ASN N N 129 120.300 120.300 120.767 -0.467 25768 7897 1 9 . 1 1 129 129 ASN C C 129 175.590 175.590 175.228 0.362 25768 7898 1 9 . 1 1 129 129 ASN CA C 129 54.180 54.180 52.370 1.810 25768 7899 1 9 . 1 1 129 129 ASN CB C 129 38.900 38.900 38.384 0.516 25768 7900 1 9 . 1 1 129 129 ASN H H 129 8.120 8.120 8.585 -0.465 25768 7901 1 9 . 1 1 130 130 ARG N N 130 120.630 120.630 119.380 1.250 25768 7902 1 9 . 1 1 130 130 ARG C C 130 176.720 176.720 175.307 1.413 25768 7903 1 9 . 1 1 130 130 ARG CA C 130 57.240 57.240 56.631 0.609 25768 7904 1 9 . 1 1 130 130 ARG CB C 130 30.500 30.500 29.578 0.922 25768 7905 1 9 . 1 1 130 130 ARG H H 130 8.050 8.050 8.059 -0.009 25768 7906 1 9 . 1 1 131 131 LYS N N 131 121.150 121.150 122.946 -1.796 25768 7907 1 9 . 1 1 131 131 LYS C C 131 176.750 176.750 176.184 0.566 25768 7908 1 9 . 1 1 131 131 LYS CA C 131 57.050 57.050 56.090 0.960 25768 7909 1 9 . 1 1 131 131 LYS CB C 131 32.870 32.870 33.484 -0.614 25768 7910 1 9 . 1 1 131 131 LYS H H 131 8.020 8.020 8.232 -0.212 25768 7911 1 9 . 1 1 132 132 ALA N N 132 124.110 124.110 122.407 1.703 25768 7912 1 9 . 1 1 132 132 ALA C C 132 177.680 177.680 176.366 1.314 25768 7913 1 9 . 1 1 132 132 ALA CA C 132 53.070 53.070 51.482 1.588 25768 7914 1 9 . 1 1 132 132 ALA CB C 132 19.250 19.250 20.770 -1.520 25768 7915 1 9 . 1 1 132 132 ALA H H 132 8.010 8.010 8.159 -0.149 25768 7916 1 9 . 1 1 133 133 GLN N N 133 118.830 118.830 121.397 -2.567 25768 7917 1 9 . 1 1 133 133 GLN C C 133 176.380 176.380 175.744 0.636 25768 7918 1 9 . 1 1 133 133 GLN CA C 133 56.400 56.400 55.608 0.791 25768 7919 1 9 . 1 1 133 133 GLN CB C 133 29.670 29.670 29.445 0.225 25768 7920 1 9 . 1 1 133 133 GLN H H 133 8.070 8.070 8.554 -0.484 25768 7921 1 9 . 1 1 134 134 GLY N N 134 109.400 109.400 110.624 -1.224 25768 7922 1 9 . 1 1 134 134 GLY C C 134 174.060 174.060 173.242 0.818 25768 7923 1 9 . 1 1 134 134 GLY CA C 134 45.690 45.690 45.087 0.603 25768 7924 1 9 . 1 1 134 134 GLY H H 134 8.150 8.150 8.504 -0.354 25768 7925 1 9 . 1 1 135 135 PHE N N 135 120.480 120.480 120.144 0.336 25768 7926 1 9 . 1 1 135 135 PHE C C 135 176.000 176.000 174.917 1.083 25768 7927 1 9 . 1 1 135 135 PHE CA C 135 58.370 58.370 58.471 -0.102 25768 7928 1 9 . 1 1 135 135 PHE CB C 135 39.710 39.710 39.579 0.131 25768 7929 1 9 . 1 1 135 135 PHE H H 135 8.060 8.060 8.552 -0.492 25768 7930 1 9 . 1 1 136 136 SER N N 136 116.740 116.740 115.796 0.944 25768 7931 1 9 . 1 1 136 136 SER C C 136 174.620 174.620 172.555 2.065 25768 7932 1 9 . 1 1 136 136 SER CA C 136 58.870 58.870 58.238 0.632 25768 7933 1 9 . 1 1 136 136 SER CB C 136 64.200 64.200 64.356 -0.156 25768 7934 1 9 . 1 1 136 136 SER H H 136 8.160 8.160 7.803 0.356 25768 7935 1 9 . 1 1 137 137 SER N N 137 117.650 117.650 116.723 0.927 25768 7936 1 9 . 1 1 137 137 SER C C 137 174.410 174.410 174.139 0.271 25768 7937 1 9 . 1 1 137 137 SER CA C 137 58.880 58.880 58.556 0.324 25768 7938 1 9 . 1 1 137 137 SER CB C 137 64.140 64.140 64.554 -0.414 25768 7939 1 9 . 1 1 137 137 SER H H 137 8.140 8.140 8.241 -0.101 25768 7940 1 9 . 1 1 138 138 MET N N 138 121.980 121.980 124.203 -2.223 25768 7941 1 9 . 1 1 138 138 MET C C 138 175.680 175.680 175.656 0.024 25768 7942 1 9 . 1 1 138 138 MET CA C 138 56.180 56.180 54.251 1.929 25768 7943 1 9 . 1 1 138 138 MET CB C 138 33.240 33.240 31.126 2.114 25768 7944 1 9 . 1 1 138 138 MET H H 138 8.110 8.110 8.728 -0.618 25768 7945 1 9 . 1 1 139 139 LYS N N 139 122.110 122.110 122.336 -0.226 25768 7946 1 9 . 1 1 139 139 LYS C C 139 176.220 176.220 176.373 -0.153 25768 7947 1 9 . 1 1 139 139 LYS CA C 139 56.370 56.370 56.614 -0.244 25768 7948 1 9 . 1 1 139 139 LYS CB C 139 33.220 33.220 31.254 1.966 25768 7949 1 9 . 1 1 139 139 LYS H H 139 8.140 8.140 7.883 0.257 25768 7950 1 9 . 1 1 140 140 LEU N N 140 123.860 123.860 125.197 -1.337 25768 7951 1 9 . 1 1 140 140 LEU C C 140 177.100 177.100 174.826 2.274 25768 7952 1 9 . 1 1 140 140 LEU CA C 140 55.710 55.710 54.929 0.780 25768 7953 1 9 . 1 1 140 140 LEU CB C 140 42.460 42.460 43.016 -0.556 25768 7954 1 9 . 1 1 140 140 LEU H H 140 8.140 8.140 8.078 0.062 25768 7955 1 9 . 1 1 141 141 GLN N N 141 120.350 120.350 119.336 1.014 25768 7956 1 9 . 1 1 141 141 GLN C C 141 175.170 175.170 174.957 0.213 25768 7957 1 9 . 1 1 141 141 GLN CA C 141 56.200 56.200 55.802 0.398 25768 7958 1 9 . 1 1 141 141 GLN CB C 141 29.950 29.950 30.453 -0.503 25768 7959 1 9 . 1 1 141 141 GLN H H 141 8.210 8.210 7.855 0.355 25768 7960 1 9 . 1 1 142 142 ASP N N 142 120.950 120.950 126.325 -5.375 25768 7961 1 9 . 1 1 142 142 ASP C C 142 175.840 175.840 176.207 -0.367 25768 7962 1 9 . 1 1 142 142 ASP CA C 142 54.700 54.700 54.108 0.592 25768 7963 1 9 . 1 1 142 142 ASP CB C 142 41.760 41.760 40.333 1.427 25768 7964 1 9 . 1 1 142 142 ASP H H 142 8.120 8.120 8.922 -0.802 25768 7965 1 9 . 1 1 143 143 SER N N 143 114.880 114.880 114.078 0.802 25768 7966 1 9 . 1 1 143 143 SER C C 143 173.290 173.290 172.700 0.590 25768 7967 1 9 . 1 1 143 143 SER CA C 143 58.450 58.450 59.997 -1.547 25768 7968 1 9 . 1 1 143 143 SER CB C 143 64.760 64.760 62.791 1.969 25768 7969 1 9 . 1 1 143 143 SER H H 143 7.960 7.960 8.741 -0.781 25768 7970 1 9 . 1 1 144 144 TRP N N 144 123.110 123.110 118.606 4.504 25768 7971 1 9 . 1 1 144 144 TRP C C 144 175.880 175.880 175.815 0.065 25768 7972 1 9 . 1 1 144 144 TRP CA C 144 56.420 56.420 57.011 -0.591 25768 7973 1 9 . 1 1 144 144 TRP CB C 144 31.160 31.160 30.889 0.271 25768 7974 1 9 . 1 1 144 144 TRP H H 144 8.080 8.080 7.658 0.422 25768 7975 1 9 . 1 1 145 145 GLY N N 145 110.410 110.410 108.978 1.432 25768 7976 1 9 . 1 1 145 145 GLY C C 145 172.870 172.870 175.177 -2.307 25768 7977 1 9 . 1 1 145 145 GLY CA C 145 45.130 45.130 45.013 0.117 25768 7978 1 9 . 1 1 145 145 GLY H H 145 8.660 8.660 8.837 -0.177 25768 7979 1 9 . 1 1 148 148 GLY C C 148 171.800 171.800 173.088 -1.288 25768 7980 1 9 . 1 1 148 148 GLY CA C 148 44.140 44.140 44.344 -0.204 25768 7981 1 9 . 1 1 149 149 GLU N N 149 123.070 123.070 120.855 2.215 25768 7982 1 9 . 1 1 149 149 GLU C C 149 174.210 174.210 174.345 -0.135 25768 7983 1 9 . 1 1 149 149 GLU CA C 149 55.120 55.120 55.339 -0.219 25768 7984 1 9 . 1 1 149 149 GLU CB C 149 37.410 37.410 34.201 3.209 25768 7985 1 9 . 1 1 149 149 GLU H H 149 8.550 8.550 8.474 0.076 25768 7986 1 9 . 1 1 150 150 LEU N N 150 126.130 126.130 123.108 3.022 25768 7987 1 9 . 1 1 150 150 LEU C C 150 174.410 174.410 175.552 -1.142 25768 7988 1 9 . 1 1 150 150 LEU CA C 150 54.260 54.260 54.003 0.257 25768 7989 1 9 . 1 1 150 150 LEU CB C 150 47.510 47.510 44.653 2.857 25768 7990 1 9 . 1 1 150 150 LEU H H 150 8.550 8.550 7.974 0.576 25768 7991 1 9 . 1 1 151 151 GLY N N 151 109.500 109.500 109.825 -0.325 25768 7992 1 9 . 1 1 151 151 GLY C C 151 170.610 170.610 172.328 -1.718 25768 7993 1 9 . 1 1 151 151 GLY CA C 151 45.980 45.980 44.534 1.446 25768 7994 1 9 . 1 1 151 151 GLY H H 151 8.090 8.090 8.090 0.000 25768 7995 1 9 . 1 1 152 152 PHE N N 152 110.960 110.960 116.597 -5.637 25768 7996 1 9 . 1 1 152 152 PHE C C 152 171.510 171.510 173.441 -1.931 25768 7997 1 9 . 1 1 152 152 PHE CA C 152 58.170 58.170 57.577 0.593 25768 7998 1 9 . 1 1 152 152 PHE CB C 152 41.690 41.690 43.632 -1.942 25768 7999 1 9 . 1 1 152 152 PHE H H 152 8.380 8.380 8.049 0.331 25768 8000 1 9 . 1 1 153 153 ASP N N 153 118.880 118.880 122.389 -3.509 25768 8001 1 9 . 1 1 153 153 ASP C C 153 176.520 176.520 174.703 1.817 25768 8002 1 9 . 1 1 153 153 ASP CA C 153 52.940 52.940 52.479 0.461 25768 8003 1 9 . 1 1 153 153 ASP CB C 153 44.540 44.540 43.912 0.628 25768 8004 1 9 . 1 1 153 153 ASP H H 153 7.970 7.970 8.477 -0.507 25768 8005 1 9 . 1 1 154 154 TYR N N 154 123.630 123.630 123.755 -0.125 25768 8006 1 9 . 1 1 154 154 TYR C C 154 175.610 175.610 174.984 0.626 25768 8007 1 9 . 1 1 154 154 TYR CA C 154 57.310 57.310 57.308 0.002 25768 8008 1 9 . 1 1 154 154 TYR CB C 154 42.040 42.040 40.434 1.606 25768 8009 1 9 . 1 1 154 154 TYR H H 154 9.730 9.730 9.227 0.503 25768 8010 1 9 . 1 1 155 155 MET N N 155 126.190 126.190 125.196 0.994 25768 8011 1 9 . 1 1 155 155 MET C C 155 174.970 174.970 175.220 -0.250 25768 8012 1 9 . 1 1 155 155 MET CA C 155 54.720 54.720 55.840 -1.120 25768 8013 1 9 . 1 1 155 155 MET CB C 155 28.300 28.300 33.122 -4.822 25768 8014 1 9 . 1 1 155 155 MET H H 155 8.600 8.600 9.250 -0.650 25768 8015 1 9 . 1 1 156 156 LEU N N 156 125.290 125.290 125.471 -0.181 25768 8016 1 9 . 1 1 156 156 LEU C C 156 177.680 177.680 177.472 0.208 25768 8017 1 9 . 1 1 156 156 LEU CA C 156 56.040 56.040 54.859 1.181 25768 8018 1 9 . 1 1 156 156 LEU CB C 156 43.040 43.040 43.321 -0.281 25768 8019 1 9 . 1 1 156 156 LEU H H 156 9.190 9.190 8.712 0.478 25768 8020 1 9 . 1 1 157 157 ASN N N 157 114.690 114.690 116.886 -2.196 25768 8021 1 9 . 1 1 157 157 ASN C C 157 173.640 173.640 177.496 -3.856 25768 8022 1 9 . 1 1 157 157 ASN CA C 157 52.650 52.650 56.158 -3.508 25768 8023 1 9 . 1 1 157 157 ASN CB C 157 37.270 37.270 36.984 0.285 25768 8024 1 9 . 1 1 157 157 ASN H H 157 8.060 8.060 8.173 -0.113 25768 8025 1 9 . 1 1 158 158 GLU N N 158 114.530 114.530 119.744 -5.214 25768 8026 1 9 . 1 1 158 158 GLU C C 158 176.090 176.090 177.188 -1.098 25768 8027 1 9 . 1 1 158 158 GLU CA C 158 60.010 60.010 58.560 1.450 25768 8028 1 9 . 1 1 158 158 GLU CB C 158 29.730 29.730 30.029 -0.299 25768 8029 1 9 . 1 1 158 158 GLU H H 158 8.560 8.560 8.330 0.230 25768 8030 1 9 . 1 1 159 159 HIS N N 159 110.480 110.480 117.684 -7.204 25768 8031 1 9 . 1 1 159 159 HIS C C 159 173.130 173.130 174.311 -1.181 25768 8032 1 9 . 1 1 159 159 HIS CA C 159 56.770 56.770 54.849 1.921 25768 8033 1 9 . 1 1 159 159 HIS CB C 159 32.630 32.630 30.147 2.483 25768 8034 1 9 . 1 1 159 159 HIS H H 159 8.190 8.190 7.787 0.403 25768 8035 1 9 . 1 1 160 160 ALA N N 160 122.890 122.890 120.865 2.025 25768 8036 1 9 . 1 1 160 160 ALA C C 160 176.200 176.200 175.133 1.067 25768 8037 1 9 . 1 1 160 160 ALA CA C 160 51.730 51.730 53.631 -1.901 25768 8038 1 9 . 1 1 160 160 ALA CB C 160 21.560 21.560 18.694 2.866 25768 8039 1 9 . 1 1 160 160 ALA H H 160 8.400 8.400 7.770 0.630 25768 8040 1 9 . 1 1 161 161 LEU N N 161 116.540 116.540 117.447 -0.907 25768 8041 1 9 . 1 1 161 161 LEU C C 161 174.930 174.930 176.091 -1.161 25768 8042 1 9 . 1 1 161 161 LEU CA C 161 54.280 54.280 53.922 0.358 25768 8043 1 9 . 1 1 161 161 LEU CB C 161 45.640 45.640 44.522 1.118 25768 8044 1 9 . 1 1 161 161 LEU H H 161 8.590 8.590 7.933 0.657 25768 8045 1 9 . 1 1 162 162 PHE N N 162 121.780 121.780 120.113 1.667 25768 8046 1 9 . 1 1 162 162 PHE C C 162 171.960 171.960 174.619 -2.659 25768 8047 1 9 . 1 1 162 162 PHE CA C 162 56.420 56.420 57.192 -0.772 25768 8048 1 9 . 1 1 162 162 PHE CB C 162 43.340 43.340 43.059 0.281 25768 8049 1 9 . 1 1 162 162 PHE H H 162 9.180 9.180 9.420 -0.240 25768 8050 1 9 . 1 1 163 163 ASN N N 163 127.850 127.850 120.996 6.854 25768 8051 1 9 . 1 1 163 163 ASN C C 163 171.320 171.320 173.836 -2.516 25768 8052 1 9 . 1 1 163 163 ASN CA C 163 52.340 52.340 52.239 0.101 25768 8053 1 9 . 1 1 163 163 ASN CB C 163 46.410 46.410 42.207 4.203 25768 8054 1 9 . 1 1 163 163 ASN H H 163 7.700 7.700 8.515 -0.815 25768 8055 1 9 . 1 1 164 164 MET N N 164 119.950 119.950 122.067 -2.117 25768 8056 1 9 . 1 1 164 164 MET C C 164 172.830 172.830 173.945 -1.115 25768 8057 1 9 . 1 1 164 164 MET CA C 164 55.180 55.180 54.357 0.823 25768 8058 1 9 . 1 1 164 164 MET CB C 164 37.770 37.770 38.570 -0.800 25768 8059 1 9 . 1 1 164 164 MET H H 164 7.070 7.070 8.809 -1.739 25768 8060 1 9 . 1 1 165 165 ALA N N 165 120.600 120.600 121.782 -1.182 25768 8061 1 9 . 1 1 165 165 ALA C C 165 174.240 174.240 174.596 -0.356 25768 8062 1 9 . 1 1 165 165 ALA CA C 165 51.630 51.630 51.755 -0.125 25768 8063 1 9 . 1 1 165 165 ALA CB C 165 22.330 22.330 22.399 -0.069 25768 8064 1 9 . 1 1 165 165 ALA H H 165 8.290 8.290 8.982 -0.692 25768 8065 1 9 . 1 1 166 166 VAL N N 166 117.900 117.900 119.572 -1.672 25768 8066 1 9 . 1 1 166 166 VAL C C 166 172.950 172.950 175.414 -2.464 25768 8067 1 9 . 1 1 166 166 VAL CA C 166 59.710 59.710 61.957 -2.247 25768 8068 1 9 . 1 1 166 166 VAL CB C 166 35.290 35.290 35.698 -0.408 25768 8069 1 9 . 1 1 166 166 VAL H H 166 8.720 8.720 8.766 -0.046 25768 8070 1 9 . 1 1 171 171 ILE C C 171 175.750 175.750 174.681 1.069 25768 8071 1 9 . 1 1 171 171 ILE CA C 171 61.720 61.720 62.132 -0.411 25768 8072 1 9 . 1 1 171 171 ILE CB C 171 39.300 39.300 36.085 3.215 25768 8073 1 9 . 1 1 172 172 ASP N N 172 124.070 124.070 125.042 -0.972 25768 8074 1 9 . 1 1 172 172 ASP C C 172 176.590 176.590 176.277 0.313 25768 8075 1 9 . 1 1 172 172 ASP CA C 172 54.460 54.460 52.940 1.520 25768 8076 1 9 . 1 1 172 172 ASP CB C 172 41.410 41.410 43.453 -2.043 25768 8077 1 9 . 1 1 172 172 ASP H H 172 8.460 8.460 8.246 0.214 25768 8078 1 9 . 1 1 173 173 THR N N 173 115.570 115.570 113.573 1.997 25768 8079 1 9 . 1 1 173 173 THR C C 173 175.030 175.030 173.749 1.281 25768 8080 1 9 . 1 1 173 173 THR CA C 173 62.680 62.680 63.125 -0.445 25768 8081 1 9 . 1 1 173 173 THR CB C 173 69.840 69.840 69.379 0.461 25768 8082 1 9 . 1 1 173 173 THR H H 173 8.080 8.080 8.147 -0.067 25768 8083 1 9 . 1 1 174 174 LYS N N 174 122.680 122.680 127.813 -5.133 25768 8084 1 9 . 1 1 174 174 LYS C C 174 176.340 176.340 176.321 0.019 25768 8085 1 9 . 1 1 174 174 LYS CA C 174 56.820 56.820 55.906 0.914 25768 8086 1 9 . 1 1 174 174 LYS CB C 174 32.790 32.790 31.943 0.847 25768 8087 1 9 . 1 1 174 174 LYS H H 174 8.180 8.180 8.762 -0.582 25768 8088 1 9 . 1 1 175 175 ALA N N 175 124.050 124.050 122.766 1.284 25768 8089 1 9 . 1 1 175 175 ALA C C 175 177.550 177.550 176.324 1.226 25768 8090 1 9 . 1 1 175 175 ALA CA C 175 52.840 52.840 52.817 0.023 25768 8091 1 9 . 1 1 175 175 ALA CB C 175 19.580 19.580 17.487 2.093 25768 8092 1 9 . 1 1 175 175 ALA H H 175 8.050 8.050 7.770 0.280 25768 8093 1 9 . 1 1 176 176 SER N N 176 114.920 114.920 113.717 1.203 25768 8094 1 9 . 1 1 176 176 SER C C 176 174.240 174.240 173.739 0.501 25768 8095 1 9 . 1 1 176 176 SER CA C 176 58.390 58.390 57.734 0.656 25768 8096 1 9 . 1 1 176 176 SER CB C 176 64.370 64.370 65.473 -1.103 25768 8097 1 9 . 1 1 176 176 SER H H 176 8.070 8.070 8.002 0.068 25768 8098 1 9 . 1 1 177 177 ILE N N 177 121.650 121.650 122.949 -1.299 25768 8099 1 9 . 1 1 177 177 ILE C C 177 174.990 174.990 175.954 -0.964 25768 8100 1 9 . 1 1 177 177 ILE CA C 177 61.570 61.570 60.738 0.832 25768 8101 1 9 . 1 1 177 177 ILE CB C 177 39.100 39.100 38.982 0.118 25768 8102 1 9 . 1 1 177 177 ILE H H 177 7.960 7.960 8.182 -0.222 25768 8103 1 9 . 1 1 178 178 ASN N N 178 127.040 127.040 121.606 5.434 25768 8104 1 9 . 1 1 178 178 ASN C C 178 179.160 179.160 175.322 3.838 25768 8105 1 9 . 1 1 178 178 ASN CA C 178 55.100 55.100 53.501 1.599 25768 8106 1 9 . 1 1 178 178 ASN CB C 178 41.300 41.300 39.139 2.161 25768 8107 1 9 . 1 1 178 178 ASN H H 178 7.850 7.850 8.508 -0.658 25768 8108 1 9 . 1 1 180 180 PRO C C 180 177.520 177.520 176.349 1.171 25768 8109 1 9 . 1 1 180 180 PRO CA C 180 63.980 63.980 62.638 1.342 25768 8110 1 9 . 1 1 180 180 PRO CB C 180 32.190 32.190 33.045 -0.855 25768 8111 1 9 . 1 1 181 181 SER N N 181 115.600 115.600 119.533 -3.933 25768 8112 1 9 . 1 1 181 181 SER C C 181 174.710 174.710 175.019 -0.309 25768 8113 1 9 . 1 1 181 181 SER CA C 181 58.900 58.900 59.537 -0.637 25768 8114 1 9 . 1 1 181 181 SER CB C 181 64.070 64.070 63.541 0.529 25768 8115 1 9 . 1 1 181 181 SER H H 181 8.260 8.260 8.581 -0.321 25768 8116 1 9 . 1 1 182 182 ALA N N 182 125.880 125.880 125.377 0.503 25768 8117 1 9 . 1 1 182 182 ALA C C 182 177.560 177.560 176.342 1.218 25768 8118 1 9 . 1 1 182 182 ALA CA C 182 53.090 53.090 51.129 1.961 25768 8119 1 9 . 1 1 182 182 ALA CB C 182 19.310 19.310 19.243 0.067 25768 8120 1 9 . 1 1 182 182 ALA H H 182 8.130 8.130 8.141 -0.011 25768 8121 1 9 . 1 1 183 183 LEU N N 183 119.980 119.980 125.071 -5.091 25768 8122 1 9 . 1 1 183 183 LEU C C 183 177.850 177.850 177.050 0.800 25768 8123 1 9 . 1 1 183 183 LEU CA C 183 55.650 55.650 55.196 0.454 25768 8124 1 9 . 1 1 183 183 LEU CB C 183 42.530 42.530 39.195 3.335 25768 8125 1 9 . 1 1 183 183 LEU H H 183 7.940 7.940 8.999 -1.059 25768 8126 1 9 . 1 1 184 184 GLY N N 184 109.250 109.250 112.840 -3.590 25768 8127 1 9 . 1 1 184 184 GLY C C 184 174.250 174.250 173.257 0.993 25768 8128 1 9 . 1 1 184 184 GLY CA C 184 45.830 45.830 45.484 0.346 25768 8129 1 9 . 1 1 184 184 GLY H H 184 8.150 8.150 8.491 -0.341 25768 8130 1 9 . 1 1 185 185 VAL N N 185 118.830 118.830 123.232 -4.402 25768 8131 1 9 . 1 1 185 185 VAL C C 185 175.890 175.890 173.330 2.560 25768 8132 1 9 . 1 1 185 185 VAL CA C 185 62.740 62.740 61.842 0.898 25768 8133 1 9 . 1 1 185 185 VAL CB C 185 32.770 32.770 32.949 -0.179 25768 8134 1 9 . 1 1 185 185 VAL H H 185 7.760 7.760 7.811 -0.051 25768 8135 1 9 . 1 1 186 186 ASN N N 186 121.850 121.850 123.554 -1.704 25768 8136 1 9 . 1 1 186 186 ASN C C 186 174.970 174.970 173.517 1.453 25768 8137 1 9 . 1 1 186 186 ASN CA C 186 53.590 53.590 52.769 0.821 25768 8138 1 9 . 1 1 186 186 ASN CB C 186 39.160 39.160 39.907 -0.747 25768 8139 1 9 . 1 1 186 186 ASN H H 186 8.380 8.380 8.369 0.011 25768 8140 1 9 . 1 1 187 187 LYS N N 187 122.120 122.120 118.936 3.184 25768 8141 1 9 . 1 1 187 187 LYS C C 187 176.490 176.490 174.339 2.151 25768 8142 1 9 . 1 1 187 187 LYS CA C 187 56.750 56.750 55.960 0.790 25768 8143 1 9 . 1 1 187 187 LYS CB C 187 33.250 33.250 33.964 -0.714 25768 8144 1 9 . 1 1 187 187 LYS H H 187 8.140 8.140 8.639 -0.499 25768 8145 1 9 . 1 1 188 188 THR N N 188 115.250 115.250 114.675 0.575 25768 8146 1 9 . 1 1 188 188 THR C C 188 174.250 174.250 174.231 0.019 25768 8147 1 9 . 1 1 188 188 THR CA C 188 62.360 62.360 61.583 0.777 25768 8148 1 9 . 1 1 188 188 THR CB C 188 70.280 70.280 70.025 0.255 25768 8149 1 9 . 1 1 188 188 THR H H 188 8.100 8.100 8.385 -0.285 25768 8150 1 9 . 1 1 189 189 LYS N N 189 123.780 123.780 123.077 0.703 25768 8151 1 9 . 1 1 189 189 LYS C C 189 176.090 176.090 175.601 0.489 25768 8152 1 9 . 1 1 189 189 LYS CA C 189 56.590 56.590 55.903 0.687 25768 8153 1 9 . 1 1 189 189 LYS CB C 189 33.350 33.350 33.497 -0.147 25768 8154 1 9 . 1 1 189 189 LYS H H 189 8.110 8.110 8.516 -0.406 25768 8155 1 9 . 1 1 190 190 VAL N N 190 120.920 120.920 124.592 -3.672 25768 8156 1 9 . 1 1 190 190 VAL C C 190 175.590 175.590 175.685 -0.095 25768 8157 1 9 . 1 1 190 190 VAL CA C 190 62.400 62.400 62.040 0.360 25768 8158 1 9 . 1 1 190 190 VAL CB C 190 32.990 32.990 32.313 0.677 25768 8159 1 9 . 1 1 190 190 VAL H H 190 8.040 8.040 8.499 -0.459 25768 8160 1 9 . 1 1 191 191 ASP N N 191 123.790 123.790 129.981 -6.191 25768 8161 1 9 . 1 1 191 191 ASP C C 191 175.750 175.750 174.887 0.863 25768 8162 1 9 . 1 1 191 191 ASP CA C 191 54.650 54.650 54.153 0.498 25768 8163 1 9 . 1 1 191 191 ASP CB C 191 41.450 41.450 41.028 0.422 25768 8164 1 9 . 1 1 191 191 ASP H H 191 8.240 8.240 8.800 -0.560 25768 8165 1 9 . 1 1 192 192 VAL N N 192 118.850 118.850 121.195 -2.345 25768 8166 1 9 . 1 1 192 192 VAL C C 192 175.380 175.380 174.924 0.456 25768 8167 1 9 . 1 1 192 192 VAL CA C 192 62.110 62.110 61.816 0.294 25768 8168 1 9 . 1 1 192 192 VAL CB C 192 33.290 33.290 32.288 1.002 25768 8169 1 9 . 1 1 192 192 VAL H H 192 7.860 7.860 7.872 -0.012 25768 8170 1 9 . 1 1 193 193 ASP N N 193 124.190 124.190 120.788 3.402 25768 8171 1 9 . 1 1 193 193 ASP C C 193 175.630 175.630 175.719 -0.089 25768 8172 1 9 . 1 1 193 193 ASP CA C 193 54.540 54.540 54.604 -0.064 25768 8173 1 9 . 1 1 193 193 ASP CB C 193 41.410 41.410 40.435 0.975 25768 8174 1 9 . 1 1 193 193 ASP H H 193 8.310 8.310 8.411 -0.101 25768 8175 1 9 . 1 1 194 194 VAL N N 194 119.580 119.580 115.762 3.818 25768 8176 1 9 . 1 1 194 194 VAL C C 194 174.950 174.950 174.376 0.574 25768 8177 1 9 . 1 1 194 194 VAL CA C 194 61.770 61.770 60.823 0.947 25768 8178 1 9 . 1 1 194 194 VAL CB C 194 33.680 33.680 31.813 1.867 25768 8179 1 9 . 1 1 194 194 VAL H H 194 7.890 7.890 7.409 0.481 25768 8180 1 9 . 1 1 195 195 ASP N N 195 125.660 125.660 124.561 1.099 25768 8181 1 9 . 1 1 195 195 ASP C C 195 174.290 174.290 174.701 -0.411 25768 8182 1 9 . 1 1 195 195 ASP CA C 195 51.940 51.940 52.878 -0.938 25768 8183 1 9 . 1 1 195 195 ASP CB C 195 40.950 40.950 41.077 -0.127 25768 8184 1 9 . 1 1 195 195 ASP H H 195 8.410 8.410 7.848 0.562 25768 8185 1 9 . 1 1 198 198 VAL C C 198 173.940 173.940 175.230 -1.290 25768 8186 1 9 . 1 1 198 198 VAL CA C 198 61.270 61.270 61.466 -0.196 25768 8187 1 9 . 1 1 198 198 VAL CB C 198 35.910 35.910 33.566 2.344 25768 8188 1 9 . 1 1 199 199 TYR N N 199 123.780 123.780 125.198 -1.418 25768 8189 1 9 . 1 1 199 199 TYR C C 199 174.150 174.150 175.374 -1.224 25768 8190 1 9 . 1 1 199 199 TYR CA C 199 56.220 56.220 57.051 -0.831 25768 8191 1 9 . 1 1 199 199 TYR CB C 199 41.660 41.660 41.505 0.154 25768 8192 1 9 . 1 1 199 199 TYR H H 199 8.540 8.540 8.220 0.320 25768 8193 1 9 . 1 1 200 200 MET N N 200 123.920 123.920 121.932 1.988 25768 8194 1 9 . 1 1 200 200 MET C C 200 173.810 173.810 174.637 -0.827 25768 8195 1 9 . 1 1 200 200 MET CA C 200 54.710 54.710 54.261 0.449 25768 8196 1 9 . 1 1 200 200 MET CB C 200 37.110 37.110 33.275 3.835 25768 8197 1 9 . 1 1 200 200 MET H H 200 9.130 9.130 8.449 0.681 25768 8198 1 9 . 1 1 201 201 ILE N N 201 123.670 123.670 124.534 -0.864 25768 8199 1 9 . 1 1 201 201 ILE C C 201 174.030 174.030 173.547 0.483 25768 8200 1 9 . 1 1 201 201 ILE CA C 201 59.820 59.820 59.342 0.478 25768 8201 1 9 . 1 1 201 201 ILE CB C 201 41.720 41.720 42.268 -0.548 25768 8202 1 9 . 1 1 201 201 ILE H H 201 8.030 8.030 8.282 -0.252 25768 8203 1 9 . 1 1 202 202 GLY N N 202 112.910 112.910 113.313 -0.403 25768 8204 1 9 . 1 1 202 202 GLY C C 202 170.280 170.280 172.438 -2.158 25768 8205 1 9 . 1 1 202 202 GLY CA C 202 46.800 46.800 44.325 2.475 25768 8206 1 9 . 1 1 202 202 GLY H H 202 8.580 8.580 8.959 -0.379 25768 8207 1 9 . 1 1 203 203 PHE N N 203 116.240 116.240 118.452 -2.212 25768 8208 1 9 . 1 1 203 203 PHE C C 203 173.940 173.940 175.740 -1.800 25768 8209 1 9 . 1 1 203 203 PHE CA C 203 55.890 55.890 56.750 -0.860 25768 8210 1 9 . 1 1 203 203 PHE CB C 203 45.060 45.060 43.875 1.185 25768 8211 1 9 . 1 1 203 203 PHE H H 203 8.620 8.620 8.581 0.039 25768 8212 1 9 . 1 1 204 204 GLY N N 204 105.610 105.610 106.660 -1.050 25768 8213 1 9 . 1 1 204 204 GLY C C 204 171.190 171.190 172.111 -0.921 25768 8214 1 9 . 1 1 204 204 GLY CA C 204 46.720 46.720 44.840 1.880 25768 8215 1 9 . 1 1 204 204 GLY H H 204 8.960 8.960 8.701 0.259 25768 8216 1 9 . 1 1 205 205 TYR N N 205 121.160 121.160 119.648 1.512 25768 8217 1 9 . 1 1 205 205 TYR C C 205 173.030 173.030 173.980 -0.950 25768 8218 1 9 . 1 1 205 205 TYR CA C 205 57.190 57.190 57.171 0.019 25768 8219 1 9 . 1 1 205 205 TYR CB C 205 44.400 44.400 43.282 1.118 25768 8220 1 9 . 1 1 205 205 TYR H H 205 9.380 9.380 8.853 0.527 25768 8221 1 9 . 1 1 206 206 LYS N N 206 126.970 126.970 125.373 1.597 25768 8222 1 9 . 1 1 206 206 LYS C C 206 174.210 174.210 175.264 -1.054 25768 8223 1 9 . 1 1 206 206 LYS CA C 206 54.770 54.770 55.932 -1.162 25768 8224 1 9 . 1 1 206 206 LYS CB C 206 34.440 34.440 33.191 1.249 25768 8225 1 9 . 1 1 206 206 LYS H H 206 8.380 8.380 8.134 0.246 25768 8226 1 9 . 1 1 207 207 PHE N N 207 126.330 126.330 125.853 0.477 25768 8227 1 9 . 1 1 207 207 PHE C C 207 175.020 175.020 173.346 1.674 25768 8228 1 9 . 1 1 207 207 PHE CA C 207 58.170 58.170 57.099 1.071 25768 8229 1 9 . 1 1 207 207 PHE CB C 207 40.920 40.920 42.464 -1.544 25768 8230 1 9 . 1 1 207 207 PHE H H 207 9.290 9.290 8.872 0.418 25768 8231 1 9 . 1 1 208 208 LEU N N 208 122.740 122.740 123.181 -0.441 25768 8232 1 9 . 1 1 208 208 LEU C C 208 176.510 176.510 174.891 1.619 25768 8233 1 9 . 1 1 208 208 LEU CA C 208 54.910 54.910 53.175 1.735 25768 8234 1 9 . 1 1 208 208 LEU CB C 208 43.830 43.830 44.413 -0.583 25768 8235 1 9 . 1 1 208 208 LEU H H 208 8.310 8.310 7.790 0.520 25768 8236 1 10 . 1 1 2 2 HIS C C 2 175.310 175.310 173.815 1.495 25768 8237 1 10 . 1 1 3 3 LYS N N 3 122.080 122.080 120.991 1.089 25768 8238 1 10 . 1 1 3 3 LYS C C 3 173.490 173.490 174.236 -0.746 25768 8239 1 10 . 1 1 3 3 LYS CA C 3 55.050 55.050 55.636 -0.586 25768 8240 1 10 . 1 1 3 3 LYS CB C 3 35.380 35.380 35.033 0.347 25768 8241 1 10 . 1 1 3 3 LYS H H 3 8.620 8.620 8.335 0.285 25768 8242 1 10 . 1 1 4 4 ALA N N 4 120.860 120.860 124.351 -3.491 25768 8243 1 10 . 1 1 4 4 ALA C C 4 178.190 178.190 177.662 0.528 25768 8244 1 10 . 1 1 4 4 ALA CA C 4 53.480 53.480 52.100 1.380 25768 8245 1 10 . 1 1 4 4 ALA CB C 4 18.140 18.140 17.744 0.396 25768 8246 1 10 . 1 1 4 4 ALA H H 4 8.580 8.580 8.328 0.252 25768 8247 1 10 . 1 1 5 5 GLY N N 5 112.890 112.890 113.723 -0.833 25768 8248 1 10 . 1 1 5 5 GLY C C 5 173.830 173.830 173.338 0.492 25768 8249 1 10 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.435 0.445 25768 8250 1 10 . 1 1 5 5 GLY H H 5 9.210 9.210 8.312 0.898 25768 8251 1 10 . 1 1 6 6 ASP N N 6 121.590 121.590 121.397 0.193 25768 8252 1 10 . 1 1 6 6 ASP C C 6 174.380 174.380 175.082 -0.702 25768 8253 1 10 . 1 1 6 6 ASP CA C 6 55.790 55.790 55.049 0.741 25768 8254 1 10 . 1 1 6 6 ASP CB C 6 41.760 41.760 41.847 -0.087 25768 8255 1 10 . 1 1 6 6 ASP H H 6 7.620 7.620 7.546 0.074 25768 8256 1 10 . 1 1 7 7 PHE N N 7 120.860 120.860 119.787 1.073 25768 8257 1 10 . 1 1 7 7 PHE C C 7 174.050 174.050 175.249 -1.199 25768 8258 1 10 . 1 1 7 7 PHE CA C 7 56.110 56.110 57.146 -1.036 25768 8259 1 10 . 1 1 7 7 PHE CB C 7 42.550 42.550 40.887 1.663 25768 8260 1 10 . 1 1 7 7 PHE H H 7 8.250 8.250 8.228 0.022 25768 8261 1 10 . 1 1 8 8 ILE N N 8 127.950 127.950 120.715 7.235 25768 8262 1 10 . 1 1 8 8 ILE C C 8 174.000 174.000 174.341 -0.341 25768 8263 1 10 . 1 1 8 8 ILE CA C 8 61.160 61.160 60.675 0.485 25768 8264 1 10 . 1 1 8 8 ILE CB C 8 42.660 42.660 42.272 0.388 25768 8265 1 10 . 1 1 8 8 ILE H H 8 9.230 9.230 8.149 1.081 25768 8266 1 10 . 1 1 9 9 ILE N N 9 125.380 125.380 122.718 2.662 25768 8267 1 10 . 1 1 9 9 ILE C C 9 173.630 173.630 174.505 -0.875 25768 8268 1 10 . 1 1 9 9 ILE CA C 9 59.600 59.600 59.596 0.004 25768 8269 1 10 . 1 1 9 9 ILE CB C 9 41.180 41.180 41.602 -0.422 25768 8270 1 10 . 1 1 9 9 ILE H H 9 8.580 8.580 8.238 0.342 25768 8271 1 10 . 1 1 10 10 ARG N N 10 124.950 124.950 122.563 2.387 25768 8272 1 10 . 1 1 10 10 ARG C C 10 175.030 175.030 173.531 1.499 25768 8273 1 10 . 1 1 10 10 ARG CA C 10 53.920 53.920 55.556 -1.636 25768 8274 1 10 . 1 1 10 10 ARG CB C 10 31.880 31.880 34.471 -2.591 25768 8275 1 10 . 1 1 10 10 ARG H H 10 9.230 9.230 8.126 1.104 25768 8276 1 10 . 1 1 11 11 GLY N N 11 105.650 105.650 108.895 -3.245 25768 8277 1 10 . 1 1 11 11 GLY C C 11 172.090 172.090 171.699 0.391 25768 8278 1 10 . 1 1 11 11 GLY CA C 11 44.460 44.460 44.349 0.111 25768 8279 1 10 . 1 1 11 11 GLY H H 11 8.780 8.780 8.498 0.282 25768 8280 1 10 . 1 1 12 12 GLY N N 12 107.800 107.800 106.667 1.133 25768 8281 1 10 . 1 1 12 12 GLY C C 12 171.460 171.460 171.789 -0.329 25768 8282 1 10 . 1 1 12 12 GLY CA C 12 46.630 46.630 45.212 1.419 25768 8283 1 10 . 1 1 12 12 GLY H H 12 8.510 8.510 8.499 0.011 25768 8284 1 10 . 1 1 13 13 PHE N N 13 119.900 119.900 114.430 5.470 25768 8285 1 10 . 1 1 13 13 PHE C C 13 174.190 174.190 173.687 0.503 25768 8286 1 10 . 1 1 13 13 PHE CA C 13 56.340 56.340 55.260 1.081 25768 8287 1 10 . 1 1 13 13 PHE CB C 13 41.090 41.090 40.941 0.150 25768 8288 1 10 . 1 1 13 13 PHE H H 13 8.610 8.610 8.965 -0.355 25768 8289 1 10 . 1 1 14 14 ALA N N 14 128.030 128.030 124.097 3.933 25768 8290 1 10 . 1 1 14 14 ALA C C 14 176.560 176.560 178.176 -1.616 25768 8291 1 10 . 1 1 14 14 ALA CA C 14 49.940 49.940 51.683 -1.743 25768 8292 1 10 . 1 1 14 14 ALA CB C 14 20.360 20.360 19.148 1.212 25768 8293 1 10 . 1 1 14 14 ALA H H 14 9.220 9.220 8.774 0.446 25768 8294 1 10 . 1 1 15 15 THR N N 15 118.620 118.620 118.173 0.447 25768 8295 1 10 . 1 1 15 15 THR CA C 15 61.440 61.440 61.972 -0.532 25768 8296 1 10 . 1 1 15 15 THR CB C 15 71.370 71.370 69.321 2.049 25768 8297 1 10 . 1 1 15 15 THR H H 15 9.220 9.220 8.102 1.118 25768 8298 1 10 . 1 1 18 18 PRO C C 18 176.690 176.690 176.912 -0.222 25768 8299 1 10 . 1 1 18 18 PRO CA C 18 63.610 63.610 63.978 -0.368 25768 8300 1 10 . 1 1 18 18 PRO CB C 18 32.440 32.440 32.243 0.197 25768 8301 1 10 . 1 1 19 19 ASP N N 19 120.320 120.320 120.769 -0.449 25768 8302 1 10 . 1 1 19 19 ASP C C 19 175.950 175.950 176.669 -0.719 25768 8303 1 10 . 1 1 19 19 ASP CA C 19 54.710 54.710 55.258 -0.548 25768 8304 1 10 . 1 1 19 19 ASP CB C 19 41.450 41.450 40.400 1.050 25768 8305 1 10 . 1 1 19 19 ASP H H 19 8.330 8.330 8.422 -0.092 25768 8306 1 10 . 1 1 20 20 ASP N N 20 121.990 121.990 125.295 -3.305 25768 8307 1 10 . 1 1 20 20 ASP C C 20 176.760 176.760 177.596 -0.836 25768 8308 1 10 . 1 1 20 20 ASP CA C 20 54.470 54.470 55.578 -1.109 25768 8309 1 10 . 1 1 20 20 ASP CB C 20 41.310 41.310 42.225 -0.915 25768 8310 1 10 . 1 1 20 20 ASP H H 20 8.240 8.240 8.354 -0.114 25768 8311 1 10 . 1 1 21 21 SER N N 21 117.050 117.050 115.432 1.618 25768 8312 1 10 . 1 1 21 21 SER C C 21 175.170 175.170 174.665 0.505 25768 8313 1 10 . 1 1 21 21 SER CA C 21 59.490 59.490 59.613 -0.123 25768 8314 1 10 . 1 1 21 21 SER CB C 21 64.080 64.080 62.416 1.664 25768 8315 1 10 . 1 1 21 21 SER H H 21 8.360 8.360 8.418 -0.058 25768 8316 1 10 . 1 1 22 22 SER N N 22 117.820 117.820 118.712 -0.892 25768 8317 1 10 . 1 1 22 22 SER C C 22 174.940 174.940 172.787 2.153 25768 8318 1 10 . 1 1 22 22 SER CA C 22 59.160 59.160 58.925 0.235 25768 8319 1 10 . 1 1 22 22 SER CB C 22 64.110 64.110 63.127 0.983 25768 8320 1 10 . 1 1 22 22 SER H H 22 8.310 8.310 8.298 0.012 25768 8321 1 10 . 1 1 23 23 SER N N 23 117.660 117.660 119.154 -1.494 25768 8322 1 10 . 1 1 23 23 SER C C 23 174.340 174.340 174.808 -0.468 25768 8323 1 10 . 1 1 23 23 SER CA C 23 59.050 59.050 57.680 1.370 25768 8324 1 10 . 1 1 23 23 SER CB C 23 64.210 64.210 65.261 -1.051 25768 8325 1 10 . 1 1 23 23 SER H H 23 8.120 8.120 8.412 -0.292 25768 8326 1 10 . 1 1 24 24 ASP N N 24 122.590 122.590 126.181 -3.591 25768 8327 1 10 . 1 1 24 24 ASP C C 24 176.250 176.250 177.316 -1.066 25768 8328 1 10 . 1 1 24 24 ASP CA C 24 54.910 54.910 56.317 -1.407 25768 8329 1 10 . 1 1 24 24 ASP CB C 24 41.270 41.270 40.928 0.342 25768 8330 1 10 . 1 1 24 24 ASP H H 24 8.230 8.230 8.853 -0.623 25768 8331 1 10 . 1 1 25 25 ILE N N 25 120.650 120.650 119.016 1.634 25768 8332 1 10 . 1 1 25 25 ILE C C 25 176.190 176.190 175.240 0.950 25768 8333 1 10 . 1 1 25 25 ILE CA C 25 61.880 61.880 61.362 0.518 25768 8334 1 10 . 1 1 25 25 ILE CB C 25 38.730 38.730 38.498 0.232 25768 8335 1 10 . 1 1 25 25 ILE H H 25 7.860 7.860 7.689 0.171 25768 8336 1 10 . 1 1 26 26 LYS N N 26 124.420 124.420 118.979 5.441 25768 8337 1 10 . 1 1 26 26 LYS C C 26 176.640 176.640 174.772 1.868 25768 8338 1 10 . 1 1 26 26 LYS CA C 26 56.520 56.520 57.157 -0.637 25768 8339 1 10 . 1 1 26 26 LYS CB C 26 32.890 32.890 32.508 0.382 25768 8340 1 10 . 1 1 26 26 LYS H H 26 8.140 8.140 8.097 0.043 25768 8341 1 10 . 1 1 27 27 LEU N N 27 123.120 123.120 122.219 0.901 25768 8342 1 10 . 1 1 27 27 LEU C C 27 177.110 177.110 176.370 0.740 25768 8343 1 10 . 1 1 27 27 LEU CA C 27 55.590 55.590 54.725 0.865 25768 8344 1 10 . 1 1 27 27 LEU CB C 27 42.500 42.500 43.742 -1.242 25768 8345 1 10 . 1 1 27 27 LEU H H 27 8.080 8.080 8.625 -0.545 25768 8346 1 10 . 1 1 28 28 ASP N N 28 120.850 120.850 118.051 2.799 25768 8347 1 10 . 1 1 28 28 ASP C C 28 176.960 176.960 175.991 0.969 25768 8348 1 10 . 1 1 28 28 ASP CA C 28 54.800 54.800 54.222 0.578 25768 8349 1 10 . 1 1 28 28 ASP CB C 28 41.380 41.380 41.562 -0.182 25768 8350 1 10 . 1 1 28 28 ASP H H 28 8.180 8.180 8.771 -0.591 25768 8351 1 10 . 1 1 29 29 GLY N N 29 109.800 109.800 109.053 0.747 25768 8352 1 10 . 1 1 29 29 GLY C C 29 174.370 174.370 173.973 0.397 25768 8353 1 10 . 1 1 29 29 GLY CA C 29 46.150 46.150 45.624 0.526 25768 8354 1 10 . 1 1 29 29 GLY H H 29 8.230 8.230 8.442 -0.212 25768 8355 1 10 . 1 1 30 30 ALA N N 30 123.880 123.880 120.875 3.005 25768 8356 1 10 . 1 1 30 30 ALA C C 30 178.040 178.040 176.032 2.008 25768 8357 1 10 . 1 1 30 30 ALA CA C 30 53.140 53.140 51.671 1.469 25768 8358 1 10 . 1 1 30 30 ALA CB C 30 19.350 19.350 21.089 -1.739 25768 8359 1 10 . 1 1 30 30 ALA H H 30 8.040 8.040 8.251 -0.211 25768 8360 1 10 . 1 1 31 31 LYS N N 31 119.800 119.800 121.277 -1.477 25768 8361 1 10 . 1 1 31 31 LYS C C 31 176.770 176.770 175.894 0.876 25768 8362 1 10 . 1 1 31 31 LYS CA C 31 56.870 56.870 55.597 1.273 25768 8363 1 10 . 1 1 31 31 LYS CB C 31 32.980 32.980 34.380 -1.400 25768 8364 1 10 . 1 1 31 31 LYS H H 31 8.060 8.060 8.380 -0.320 25768 8365 1 10 . 1 1 32 32 GLN N N 32 120.930 120.930 119.745 1.185 25768 8366 1 10 . 1 1 32 32 GLN C C 32 176.000 176.000 175.518 0.482 25768 8367 1 10 . 1 1 32 32 GLN CA C 32 56.280 56.280 55.778 0.502 25768 8368 1 10 . 1 1 32 32 GLN CB C 32 29.580 29.580 30.121 -0.541 25768 8369 1 10 . 1 1 32 32 GLN H H 32 8.170 8.170 8.264 -0.094 25768 8370 1 10 . 1 1 33 33 ARG N N 33 122.370 122.370 124.075 -1.705 25768 8371 1 10 . 1 1 33 33 ARG C C 33 176.820 176.820 175.891 0.929 25768 8372 1 10 . 1 1 33 33 ARG CA C 33 56.680 56.680 56.463 0.217 25768 8373 1 10 . 1 1 33 33 ARG CB C 33 31.040 31.040 30.583 0.457 25768 8374 1 10 . 1 1 33 33 ARG H H 33 8.270 8.270 8.276 -0.006 25768 8375 1 10 . 1 1 34 34 GLY N N 34 110.210 110.210 111.586 -1.376 25768 8376 1 10 . 1 1 34 34 GLY C C 34 174.280 174.280 173.364 0.916 25768 8377 1 10 . 1 1 34 34 GLY CA C 34 45.770 45.770 44.919 0.851 25768 8378 1 10 . 1 1 34 34 GLY H H 34 8.360 8.360 8.225 0.135 25768 8379 1 10 . 1 1 35 35 THR N N 35 114.100 114.100 112.041 2.059 25768 8380 1 10 . 1 1 35 35 THR C C 35 174.550 174.550 173.889 0.661 25768 8381 1 10 . 1 1 35 35 THR CA C 35 62.140 62.140 60.907 1.233 25768 8382 1 10 . 1 1 35 35 THR CB C 35 70.330 70.330 71.194 -0.864 25768 8383 1 10 . 1 1 35 35 THR H H 35 7.970 7.970 7.770 0.200 25768 8384 1 10 . 1 1 36 36 LYS N N 36 123.850 123.850 121.636 2.214 25768 8385 1 10 . 1 1 36 36 LYS C C 36 176.040 176.040 176.111 -0.071 25768 8386 1 10 . 1 1 36 36 LYS CA C 36 56.600 56.600 56.380 0.220 25768 8387 1 10 . 1 1 36 36 LYS CB C 36 33.280 33.280 32.834 0.446 25768 8388 1 10 . 1 1 36 36 LYS H H 36 8.230 8.230 8.484 -0.254 25768 8389 1 10 . 1 1 37 37 ALA N N 37 125.650 125.650 128.437 -2.787 25768 8390 1 10 . 1 1 37 37 ALA C C 37 177.570 177.570 176.770 0.800 25768 8391 1 10 . 1 1 37 37 ALA CA C 37 52.860 52.860 51.900 0.960 25768 8392 1 10 . 1 1 37 37 ALA CB C 37 19.610 19.610 19.242 0.367 25768 8393 1 10 . 1 1 37 37 ALA H H 37 8.290 8.290 8.529 -0.239 25768 8394 1 10 . 1 1 38 38 THR N N 38 113.350 113.350 114.786 -1.436 25768 8395 1 10 . 1 1 38 38 THR C C 38 174.540 174.540 174.537 0.003 25768 8396 1 10 . 1 1 38 38 THR CA C 38 62.010 62.010 62.662 -0.652 25768 8397 1 10 . 1 1 38 38 THR CB C 38 70.350 70.350 69.499 0.851 25768 8398 1 10 . 1 1 38 38 THR H H 38 7.970 7.970 7.691 0.279 25768 8399 1 10 . 1 1 39 39 VAL N N 39 120.790 120.790 122.600 -1.810 25768 8400 1 10 . 1 1 39 39 VAL C C 39 175.620 175.620 175.102 0.518 25768 8401 1 10 . 1 1 39 39 VAL CA C 39 62.470 62.470 60.645 1.825 25768 8402 1 10 . 1 1 39 39 VAL CB C 39 32.940 32.940 32.962 -0.022 25768 8403 1 10 . 1 1 39 39 VAL H H 39 8.020 8.020 8.266 -0.246 25768 8404 1 10 . 1 1 40 40 ASP N N 40 123.690 123.690 122.496 1.194 25768 8405 1 10 . 1 1 40 40 ASP C C 40 176.190 176.190 176.077 0.113 25768 8406 1 10 . 1 1 40 40 ASP CA C 40 54.780 54.780 55.245 -0.465 25768 8407 1 10 . 1 1 40 40 ASP CB C 40 41.590 41.590 39.545 2.045 25768 8408 1 10 . 1 1 40 40 ASP H H 40 8.310 8.310 8.045 0.265 25768 8409 1 10 . 1 1 41 41 SER N N 41 115.470 115.470 115.722 -0.252 25768 8410 1 10 . 1 1 41 41 SER C C 41 174.170 174.170 174.620 -0.450 25768 8411 1 10 . 1 1 41 41 SER CA C 41 59.000 59.000 58.508 0.492 25768 8412 1 10 . 1 1 41 41 SER CB C 41 64.420 64.420 63.871 0.549 25768 8413 1 10 . 1 1 41 41 SER H H 41 8.130 8.130 8.257 -0.127 25768 8414 1 10 . 1 1 42 42 ASP N N 42 122.430 122.430 121.648 0.782 25768 8415 1 10 . 1 1 42 42 ASP C C 42 175.740 175.740 174.825 0.915 25768 8416 1 10 . 1 1 42 42 ASP CA C 42 54.780 54.780 53.932 0.848 25768 8417 1 10 . 1 1 42 42 ASP CB C 42 41.620 41.620 40.719 0.901 25768 8418 1 10 . 1 1 42 42 ASP H H 42 8.410 8.410 8.442 -0.032 25768 8419 1 10 . 1 1 43 43 THR N N 43 117.580 117.580 114.272 3.308 25768 8420 1 10 . 1 1 43 43 THR C C 43 173.630 173.630 173.545 0.085 25768 8421 1 10 . 1 1 43 43 THR CA C 43 63.120 63.120 61.708 1.413 25768 8422 1 10 . 1 1 43 43 THR CB C 43 70.650 70.650 70.943 -0.293 25768 8423 1 10 . 1 1 43 43 THR H H 43 8.010 8.010 7.817 0.193 25768 8424 1 10 . 1 1 44 44 GLN N N 44 125.420 125.420 121.586 3.834 25768 8425 1 10 . 1 1 44 44 GLN C C 44 174.080 174.080 174.952 -0.872 25768 8426 1 10 . 1 1 44 44 GLN CA C 44 55.110 55.110 55.243 -0.133 25768 8427 1 10 . 1 1 44 44 GLN CB C 44 31.570 31.570 31.424 0.146 25768 8428 1 10 . 1 1 44 44 GLN H H 44 9.260 9.260 8.615 0.645 25768 8429 1 10 . 1 1 45 45 LEU N N 45 124.190 124.190 126.960 -2.770 25768 8430 1 10 . 1 1 45 45 LEU C C 45 175.970 175.970 175.965 0.005 25768 8431 1 10 . 1 1 45 45 LEU CA C 45 54.690 54.690 54.852 -0.162 25768 8432 1 10 . 1 1 45 45 LEU CB C 45 42.270 42.270 42.740 -0.470 25768 8433 1 10 . 1 1 45 45 LEU H H 45 8.550 8.550 8.423 0.127 25768 8434 1 10 . 1 1 46 46 GLY N N 46 113.310 113.310 113.273 0.037 25768 8435 1 10 . 1 1 46 46 GLY C C 46 171.180 171.180 172.668 -1.488 25768 8436 1 10 . 1 1 46 46 GLY CA C 46 44.400 44.400 44.161 0.239 25768 8437 1 10 . 1 1 46 46 GLY H H 46 8.810 8.810 8.612 0.198 25768 8438 1 10 . 1 1 47 47 LEU N N 47 123.890 123.890 126.093 -2.203 25768 8439 1 10 . 1 1 47 47 LEU C C 47 175.400 175.400 175.658 -0.258 25768 8440 1 10 . 1 1 47 47 LEU CA C 47 53.750 53.750 54.379 -0.629 25768 8441 1 10 . 1 1 47 47 LEU CB C 47 46.800 46.800 45.906 0.894 25768 8442 1 10 . 1 1 47 47 LEU H H 47 8.590 8.590 7.905 0.685 25768 8443 1 10 . 1 1 48 48 THR N N 48 111.210 111.210 115.668 -4.458 25768 8444 1 10 . 1 1 48 48 THR C C 48 172.520 172.520 172.756 -0.236 25768 8445 1 10 . 1 1 48 48 THR CA C 48 58.950 58.950 61.899 -2.949 25768 8446 1 10 . 1 1 48 48 THR CB C 48 72.360 72.360 71.524 0.836 25768 8447 1 10 . 1 1 48 48 THR H H 48 8.620 8.620 8.420 0.200 25768 8448 1 10 . 1 1 49 49 PHE N N 49 118.810 118.810 126.643 -7.833 25768 8449 1 10 . 1 1 49 49 PHE C C 49 174.700 174.700 175.219 -0.519 25768 8450 1 10 . 1 1 49 49 PHE CA C 49 55.080 55.080 56.478 -1.398 25768 8451 1 10 . 1 1 49 49 PHE CB C 49 42.360 42.360 41.790 0.570 25768 8452 1 10 . 1 1 49 49 PHE H H 49 8.410 8.410 8.406 0.004 25768 8453 1 10 . 1 1 50 50 THR N N 50 121.230 121.230 123.698 -2.468 25768 8454 1 10 . 1 1 50 50 THR C C 50 173.250 173.250 173.210 0.040 25768 8455 1 10 . 1 1 50 50 THR CA C 50 62.740 62.740 61.899 0.841 25768 8456 1 10 . 1 1 50 50 THR CB C 50 73.740 73.740 69.374 4.366 25768 8457 1 10 . 1 1 50 50 THR H H 50 9.330 9.330 8.353 0.977 25768 8458 1 10 . 1 1 51 51 TYR N N 51 126.010 126.010 126.804 -0.794 25768 8459 1 10 . 1 1 51 51 TYR C C 51 174.850 174.850 175.288 -0.438 25768 8460 1 10 . 1 1 51 51 TYR CA C 51 56.240 56.240 56.776 -0.535 25768 8461 1 10 . 1 1 51 51 TYR CB C 51 41.630 41.630 39.614 2.016 25768 8462 1 10 . 1 1 51 51 TYR H H 51 9.150 9.150 9.459 -0.309 25768 8463 1 10 . 1 1 52 52 MET N N 52 127.390 127.390 123.794 3.596 25768 8464 1 10 . 1 1 52 52 MET C C 52 174.490 174.490 174.662 -0.172 25768 8465 1 10 . 1 1 52 52 MET CA C 52 52.450 52.450 56.422 -3.973 25768 8466 1 10 . 1 1 52 52 MET CB C 52 28.590 28.590 33.698 -5.108 25768 8467 1 10 . 1 1 52 52 MET H H 52 7.950 7.950 8.293 -0.343 25768 8468 1 10 . 1 1 53 53 PHE N N 53 123.830 123.830 126.603 -2.773 25768 8469 1 10 . 1 1 53 53 PHE C C 53 173.720 173.720 173.840 -0.120 25768 8470 1 10 . 1 1 53 53 PHE CA C 53 57.110 57.110 56.827 0.283 25768 8471 1 10 . 1 1 53 53 PHE CB C 53 39.420 39.420 41.898 -2.478 25768 8472 1 10 . 1 1 53 53 PHE H H 53 7.720 7.720 8.332 -0.612 25768 8473 1 10 . 1 1 54 54 ALA N N 54 125.650 125.650 127.597 -1.947 25768 8474 1 10 . 1 1 54 54 ALA C C 54 175.020 175.020 176.548 -1.528 25768 8475 1 10 . 1 1 54 54 ALA CA C 54 50.740 50.740 52.850 -2.110 25768 8476 1 10 . 1 1 54 54 ALA CB C 54 22.700 22.700 18.514 4.186 25768 8477 1 10 . 1 1 54 54 ALA H H 54 8.360 8.360 8.219 0.141 25768 8478 1 10 . 1 1 55 55 ASP N N 55 118.790 118.790 117.115 1.675 25768 8479 1 10 . 1 1 55 55 ASP C C 55 174.780 174.780 175.756 -0.976 25768 8480 1 10 . 1 1 55 55 ASP CA C 55 58.590 58.590 54.443 4.147 25768 8481 1 10 . 1 1 55 55 ASP CB C 55 40.430 40.430 39.945 0.485 25768 8482 1 10 . 1 1 55 55 ASP H H 55 8.590 8.590 8.569 0.021 25768 8483 1 10 . 1 1 56 56 LYS N N 56 106.200 106.200 116.875 -10.675 25768 8484 1 10 . 1 1 56 56 LYS C C 56 174.940 174.940 174.330 0.610 25768 8485 1 10 . 1 1 56 56 LYS CA C 56 55.260 55.260 56.416 -1.156 25768 8486 1 10 . 1 1 56 56 LYS CB C 56 34.510 34.510 35.514 -1.004 25768 8487 1 10 . 1 1 56 56 LYS H H 56 7.260 7.260 7.173 0.087 25768 8488 1 10 . 1 1 57 57 TRP N N 57 115.680 115.680 121.980 -6.300 25768 8489 1 10 . 1 1 57 57 TRP C C 57 173.940 173.940 174.228 -0.288 25768 8490 1 10 . 1 1 57 57 TRP CA C 57 55.410 55.410 56.113 -0.703 25768 8491 1 10 . 1 1 57 57 TRP CB C 57 34.470 34.470 32.893 1.577 25768 8492 1 10 . 1 1 57 57 TRP H H 57 6.570 6.570 8.065 -1.495 25768 8493 1 10 . 1 1 58 58 GLY N N 58 107.610 107.610 111.136 -3.526 25768 8494 1 10 . 1 1 58 58 GLY C C 58 172.730 172.730 171.450 1.280 25768 8495 1 10 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.255 -0.205 25768 8496 1 10 . 1 1 58 58 GLY H H 58 9.260 9.260 7.051 2.209 25768 8497 1 10 . 1 1 59 59 VAL N N 59 118.130 118.130 118.183 -0.053 25768 8498 1 10 . 1 1 59 59 VAL C C 59 173.000 173.000 173.854 -0.854 25768 8499 1 10 . 1 1 59 59 VAL CA C 59 59.950 59.950 58.599 1.351 25768 8500 1 10 . 1 1 59 59 VAL CB C 59 35.170 35.170 34.072 1.097 25768 8501 1 10 . 1 1 59 59 VAL H H 59 9.030 9.030 8.029 1.001 25768 8502 1 10 . 1 1 60 60 GLU N N 60 127.900 127.900 121.559 6.341 25768 8503 1 10 . 1 1 60 60 GLU C C 60 174.470 174.470 174.596 -0.126 25768 8504 1 10 . 1 1 60 60 GLU CA C 60 52.940 52.940 54.867 -1.927 25768 8505 1 10 . 1 1 60 60 GLU CB C 60 35.100 35.100 34.422 0.678 25768 8506 1 10 . 1 1 60 60 GLU H H 60 9.440 9.440 8.555 0.885 25768 8507 1 10 . 1 1 61 61 LEU N N 61 127.410 127.410 124.008 3.402 25768 8508 1 10 . 1 1 61 61 LEU C C 61 174.950 174.950 174.822 0.128 25768 8509 1 10 . 1 1 61 61 LEU CA C 61 53.390 53.390 54.165 -0.775 25768 8510 1 10 . 1 1 61 61 LEU CB C 61 45.980 45.980 45.030 0.950 25768 8511 1 10 . 1 1 61 61 LEU H H 61 8.740 8.740 8.562 0.178 25768 8512 1 10 . 1 1 62 62 VAL N N 62 125.750 125.750 122.123 3.627 25768 8513 1 10 . 1 1 62 62 VAL C C 62 173.960 173.960 174.490 -0.530 25768 8514 1 10 . 1 1 62 62 VAL CA C 62 61.350 61.350 60.162 1.188 25768 8515 1 10 . 1 1 62 62 VAL CB C 62 34.740 34.740 34.948 -0.208 25768 8516 1 10 . 1 1 62 62 VAL H H 62 8.790 8.790 8.171 0.619 25768 8517 1 10 . 1 1 63 63 ALA N N 63 127.230 127.230 126.695 0.535 25768 8518 1 10 . 1 1 63 63 ALA C C 63 173.930 173.930 174.958 -1.028 25768 8519 1 10 . 1 1 63 63 ALA CA C 63 51.140 51.140 51.788 -0.648 25768 8520 1 10 . 1 1 63 63 ALA CB C 63 22.500 22.500 22.010 0.490 25768 8521 1 10 . 1 1 63 63 ALA H H 63 8.740 8.740 8.139 0.602 25768 8522 1 10 . 1 1 64 64 ALA N N 64 120.410 120.410 122.467 -2.057 25768 8523 1 10 . 1 1 64 64 ALA C C 64 176.770 176.770 176.010 0.760 25768 8524 1 10 . 1 1 64 64 ALA CA C 64 51.420 51.420 51.733 -0.313 25768 8525 1 10 . 1 1 64 64 ALA CB C 64 22.590 22.590 21.619 0.971 25768 8526 1 10 . 1 1 64 64 ALA H H 64 8.290 8.290 8.219 0.071 25768 8527 1 10 . 1 1 65 65 THR N N 65 116.130 116.130 114.647 1.483 25768 8528 1 10 . 1 1 65 65 THR C C 65 171.220 171.220 172.790 -1.570 25768 8529 1 10 . 1 1 65 65 THR CA C 65 58.860 58.860 58.800 0.060 25768 8530 1 10 . 1 1 65 65 THR CB C 65 72.020 72.020 69.733 2.288 25768 8531 1 10 . 1 1 65 65 THR H H 65 8.760 8.760 7.898 0.862 25768 8532 1 10 . 1 1 66 66 PRO C C 66 176.720 176.720 177.099 -0.379 25768 8533 1 10 . 1 1 66 66 PRO CA C 66 63.610 63.610 64.113 -0.503 25768 8534 1 10 . 1 1 66 66 PRO CB C 66 32.550 32.550 31.943 0.607 25768 8535 1 10 . 1 1 67 67 PHE N N 67 120.360 120.360 114.209 6.151 25768 8536 1 10 . 1 1 67 67 PHE C C 67 175.480 175.480 175.014 0.466 25768 8537 1 10 . 1 1 67 67 PHE CA C 67 58.840 58.840 58.660 0.180 25768 8538 1 10 . 1 1 67 67 PHE CB C 67 40.170 40.170 37.518 2.652 25768 8539 1 10 . 1 1 67 67 PHE H H 67 8.590 8.590 8.054 0.536 25768 8540 1 10 . 1 1 68 68 ASN N N 68 119.030 119.030 117.530 1.500 25768 8541 1 10 . 1 1 68 68 ASN C C 68 174.740 174.740 174.780 -0.040 25768 8542 1 10 . 1 1 68 68 ASN CA C 68 53.430 53.430 52.862 0.568 25768 8543 1 10 . 1 1 68 68 ASN CB C 68 39.420 39.420 38.633 0.787 25768 8544 1 10 . 1 1 68 68 ASN H H 68 8.340 8.340 8.064 0.276 25768 8545 1 10 . 1 1 69 69 HIS N N 69 119.590 119.590 119.441 0.149 25768 8546 1 10 . 1 1 69 69 HIS C C 69 174.370 174.370 175.308 -0.938 25768 8547 1 10 . 1 1 69 69 HIS CA C 69 55.950 55.950 56.993 -1.043 25768 8548 1 10 . 1 1 69 69 HIS CB C 69 29.960 29.960 30.269 -0.309 25768 8549 1 10 . 1 1 69 69 HIS H H 69 8.350 8.350 7.988 0.362 25768 8550 1 10 . 1 1 70 70 GLN N N 70 121.980 121.980 124.932 -2.952 25768 8551 1 10 . 1 1 70 70 GLN C C 70 175.740 175.740 174.790 0.950 25768 8552 1 10 . 1 1 70 70 GLN CA C 70 56.340 56.340 55.426 0.914 25768 8553 1 10 . 1 1 70 70 GLN CB C 70 29.660 29.660 30.506 -0.846 25768 8554 1 10 . 1 1 70 70 GLN H H 70 8.350 8.350 8.588 -0.238 25768 8555 1 10 . 1 1 71 71 VAL N N 71 120.530 120.530 122.795 -2.265 25768 8556 1 10 . 1 1 71 71 VAL C C 71 175.500 175.500 175.064 0.436 25768 8557 1 10 . 1 1 71 71 VAL CA C 71 62.540 62.540 61.221 1.319 25768 8558 1 10 . 1 1 71 71 VAL CB C 71 33.090 33.090 31.977 1.113 25768 8559 1 10 . 1 1 71 71 VAL H H 71 8.020 8.020 8.287 -0.267 25768 8560 1 10 . 1 1 72 72 ASP N N 72 123.910 123.910 126.422 -2.512 25768 8561 1 10 . 1 1 72 72 ASP C C 72 176.300 176.300 174.935 1.365 25768 8562 1 10 . 1 1 72 72 ASP CA C 72 54.340 54.340 54.278 0.062 25768 8563 1 10 . 1 1 72 72 ASP CB C 72 41.480 41.480 43.678 -2.199 25768 8564 1 10 . 1 1 72 72 ASP H H 72 8.280 8.280 8.547 -0.267 25768 8565 1 10 . 1 1 73 73 VAL N N 73 120.580 120.580 121.899 -1.319 25768 8566 1 10 . 1 1 73 73 VAL C C 73 176.350 176.350 175.317 1.033 25768 8567 1 10 . 1 1 73 73 VAL CA C 73 62.970 62.970 62.390 0.580 25768 8568 1 10 . 1 1 73 73 VAL CB C 73 32.550 32.550 32.001 0.549 25768 8569 1 10 . 1 1 73 73 VAL H H 73 7.960 7.960 8.609 -0.649 25768 8570 1 10 . 1 1 74 74 LYS N N 74 123.620 123.620 121.594 2.026 25768 8571 1 10 . 1 1 74 74 LYS C C 74 177.130 177.130 176.396 0.734 25768 8572 1 10 . 1 1 74 74 LYS CA C 74 57.060 57.060 56.764 0.296 25768 8573 1 10 . 1 1 74 74 LYS CB C 74 32.860 32.860 33.006 -0.146 25768 8574 1 10 . 1 1 74 74 LYS H H 74 8.230 8.230 8.075 0.155 25768 8575 1 10 . 1 1 75 75 GLY N N 75 109.370 109.370 107.862 1.508 25768 8576 1 10 . 1 1 75 75 GLY C C 75 174.030 174.030 174.381 -0.351 25768 8577 1 10 . 1 1 75 75 GLY CA C 75 45.800 45.800 44.704 1.096 25768 8578 1 10 . 1 1 75 75 GLY H H 75 8.160 8.160 8.425 -0.265 25768 8579 1 10 . 1 1 76 76 LEU N N 76 121.660 121.660 120.519 1.141 25768 8580 1 10 . 1 1 76 76 LEU C C 76 177.410 177.410 176.461 0.949 25768 8581 1 10 . 1 1 76 76 LEU CA C 76 55.410 55.410 54.553 0.857 25768 8582 1 10 . 1 1 76 76 LEU CB C 76 42.790 42.790 41.469 1.321 25768 8583 1 10 . 1 1 76 76 LEU H H 76 8.030 8.030 7.825 0.205 25768 8584 1 10 . 1 1 77 77 GLY N N 77 109.330 109.330 111.156 -1.826 25768 8585 1 10 . 1 1 77 77 GLY C C 77 171.800 171.800 172.131 -0.331 25768 8586 1 10 . 1 1 77 77 GLY CA C 77 44.990 44.990 44.949 0.041 25768 8587 1 10 . 1 1 77 77 GLY H H 77 8.100 8.100 8.288 -0.188 25768 8588 1 10 . 1 1 78 78 PRO C C 78 177.740 177.740 177.219 0.521 25768 8589 1 10 . 1 1 78 78 PRO CA C 78 63.890 63.890 62.943 0.947 25768 8590 1 10 . 1 1 78 78 PRO CB C 78 32.170 32.170 31.965 0.205 25768 8591 1 10 . 1 1 79 79 GLY N N 79 109.530 109.530 111.228 -1.698 25768 8592 1 10 . 1 1 79 79 GLY C C 79 174.460 174.460 173.862 0.598 25768 8593 1 10 . 1 1 79 79 GLY CA C 79 45.780 45.780 44.486 1.294 25768 8594 1 10 . 1 1 79 79 GLY H H 79 8.410 8.410 8.249 0.161 25768 8595 1 10 . 1 1 80 80 LEU N N 80 121.880 121.880 121.087 0.793 25768 8596 1 10 . 1 1 80 80 LEU C C 80 177.100 177.100 177.012 0.088 25768 8597 1 10 . 1 1 80 80 LEU CA C 80 55.720 55.720 54.887 0.833 25768 8598 1 10 . 1 1 80 80 LEU CB C 80 42.580 42.580 42.958 -0.378 25768 8599 1 10 . 1 1 80 80 LEU H H 80 8.010 8.010 8.451 -0.441 25768 8600 1 10 . 1 1 81 81 ASP N N 81 119.990 119.990 122.060 -2.070 25768 8601 1 10 . 1 1 81 81 ASP C C 81 176.880 176.880 176.495 0.385 25768 8602 1 10 . 1 1 81 81 ASP CA C 81 54.770 54.770 55.002 -0.232 25768 8603 1 10 . 1 1 81 81 ASP CB C 81 41.390 41.390 41.396 -0.006 25768 8604 1 10 . 1 1 81 81 ASP H H 81 8.220 8.220 8.599 -0.379 25768 8605 1 10 . 1 1 82 82 GLY N N 82 109.270 109.270 107.202 2.068 25768 8606 1 10 . 1 1 82 82 GLY C C 82 174.190 174.190 174.836 -0.646 25768 8607 1 10 . 1 1 82 82 GLY CA C 82 45.990 45.990 45.060 0.930 25768 8608 1 10 . 1 1 82 82 GLY H H 82 8.170 8.170 7.938 0.232 25768 8609 1 10 . 1 1 83 83 LYS N N 83 121.000 121.000 120.985 0.015 25768 8610 1 10 . 1 1 83 83 LYS C C 83 176.610 176.610 177.046 -0.436 25768 8611 1 10 . 1 1 83 83 LYS CA C 83 56.620 56.620 56.697 -0.077 25768 8612 1 10 . 1 1 83 83 LYS CB C 83 33.020 33.020 33.087 -0.067 25768 8613 1 10 . 1 1 83 83 LYS H H 83 7.970 7.970 8.224 -0.254 25768 8614 1 10 . 1 1 84 84 LEU N N 84 123.120 123.120 121.791 1.329 25768 8615 1 10 . 1 1 84 84 LEU C C 84 176.920 176.920 175.166 1.754 25768 8616 1 10 . 1 1 84 84 LEU CA C 84 55.550 55.550 53.516 2.034 25768 8617 1 10 . 1 1 84 84 LEU CB C 84 42.430 42.430 42.461 -0.031 25768 8618 1 10 . 1 1 84 84 LEU H H 84 8.130 8.130 7.950 0.180 25768 8619 1 10 . 1 1 85 85 ALA N N 85 123.930 123.930 128.391 -4.461 25768 8620 1 10 . 1 1 85 85 ALA C C 85 177.060 177.060 176.827 0.233 25768 8621 1 10 . 1 1 85 85 ALA CA C 85 52.790 52.790 52.229 0.561 25768 8622 1 10 . 1 1 85 85 ALA CB C 85 19.670 19.670 19.557 0.113 25768 8623 1 10 . 1 1 85 85 ALA H H 85 8.040 8.040 8.394 -0.354 25768 8624 1 10 . 1 1 86 86 ASP N N 86 119.760 119.760 122.102 -2.342 25768 8625 1 10 . 1 1 86 86 ASP C C 86 175.820 175.820 175.006 0.814 25768 8626 1 10 . 1 1 86 86 ASP CA C 86 54.520 54.520 53.840 0.680 25768 8627 1 10 . 1 1 86 86 ASP CB C 86 41.390 41.390 43.295 -1.905 25768 8628 1 10 . 1 1 86 86 ASP H H 86 8.110 8.110 8.554 -0.444 25768 8629 1 10 . 1 1 87 87 ILE N N 87 120.620 120.620 122.334 -1.714 25768 8630 1 10 . 1 1 87 87 ILE C C 87 175.740 175.740 175.232 0.508 25768 8631 1 10 . 1 1 87 87 ILE CA C 87 61.160 61.160 61.130 0.030 25768 8632 1 10 . 1 1 87 87 ILE CB C 87 39.260 39.260 39.032 0.228 25768 8633 1 10 . 1 1 87 87 ILE H H 87 7.800 7.800 8.251 -0.451 25768 8634 1 10 . 1 1 88 88 LYS N N 88 125.820 125.820 126.674 -0.854 25768 8635 1 10 . 1 1 88 88 LYS C C 88 175.340 175.340 175.386 -0.046 25768 8636 1 10 . 1 1 88 88 LYS CA C 88 56.300 56.300 55.658 0.642 25768 8637 1 10 . 1 1 88 88 LYS CB C 88 32.900 32.900 34.031 -1.131 25768 8638 1 10 . 1 1 88 88 LYS H H 88 8.250 8.250 8.430 -0.180 25768 8639 1 10 . 1 1 89 89 GLN N N 89 121.750 121.750 120.742 1.008 25768 8640 1 10 . 1 1 89 89 GLN C C 89 175.000 175.000 175.330 -0.330 25768 8641 1 10 . 1 1 89 89 GLN CA C 89 55.210 55.210 55.292 -0.082 25768 8642 1 10 . 1 1 89 89 GLN CB C 89 30.570 30.570 31.560 -0.990 25768 8643 1 10 . 1 1 89 89 GLN H H 89 8.000 8.000 8.352 -0.352 25768 8644 1 10 . 1 1 90 90 LEU N N 90 126.660 126.660 122.579 4.081 25768 8645 1 10 . 1 1 90 90 LEU C C 90 174.240 174.240 175.970 -1.730 25768 8646 1 10 . 1 1 90 90 LEU CA C 90 52.720 52.720 53.237 -0.517 25768 8647 1 10 . 1 1 90 90 LEU CB C 90 42.350 42.350 41.391 0.959 25768 8648 1 10 . 1 1 90 90 LEU H H 90 8.630 8.630 8.273 0.357 25768 8649 1 10 . 1 1 92 92 PRO C C 92 173.900 173.900 176.638 -2.738 25768 8650 1 10 . 1 1 92 92 PRO CA C 92 63.320 63.320 62.473 0.847 25768 8651 1 10 . 1 1 92 92 PRO CB C 92 31.920 31.920 32.401 -0.481 25768 8652 1 10 . 1 1 93 93 THR N N 93 119.770 119.770 113.032 6.738 25768 8653 1 10 . 1 1 93 93 THR C C 93 171.360 171.360 173.295 -1.935 25768 8654 1 10 . 1 1 93 93 THR CA C 93 62.610 62.610 61.070 1.540 25768 8655 1 10 . 1 1 93 93 THR CB C 93 72.680 72.680 71.614 1.066 25768 8656 1 10 . 1 1 93 93 THR H H 93 8.290 8.290 8.059 0.231 25768 8657 1 10 . 1 1 94 94 LEU N N 94 128.880 128.880 123.980 4.900 25768 8658 1 10 . 1 1 94 94 LEU C C 94 175.130 175.130 174.763 0.367 25768 8659 1 10 . 1 1 94 94 LEU CA C 94 53.520 53.520 54.714 -1.194 25768 8660 1 10 . 1 1 94 94 LEU CB C 94 46.140 46.140 45.185 0.955 25768 8661 1 10 . 1 1 94 94 LEU H H 94 8.680 8.680 8.958 -0.278 25768 8662 1 10 . 1 1 95 95 LEU N N 95 123.630 123.630 123.118 0.512 25768 8663 1 10 . 1 1 95 95 LEU C C 95 175.540 175.540 174.826 0.714 25768 8664 1 10 . 1 1 95 95 LEU CA C 95 55.190 55.190 54.087 1.103 25768 8665 1 10 . 1 1 95 95 LEU CB C 95 45.300 45.300 46.706 -1.406 25768 8666 1 10 . 1 1 95 95 LEU H H 95 9.580 9.580 8.442 1.138 25768 8667 1 10 . 1 1 96 96 LEU N N 96 123.150 123.150 123.461 -0.311 25768 8668 1 10 . 1 1 96 96 LEU C C 96 174.960 174.960 175.179 -0.219 25768 8669 1 10 . 1 1 96 96 LEU CA C 96 54.420 54.420 54.038 0.382 25768 8670 1 10 . 1 1 96 96 LEU CB C 96 44.560 44.560 44.241 0.319 25768 8671 1 10 . 1 1 96 96 LEU H H 96 8.770 8.770 9.215 -0.445 25768 8672 1 10 . 1 1 97 97 GLN N N 97 121.290 121.290 120.667 0.623 25768 8673 1 10 . 1 1 97 97 GLN C C 97 174.380 174.380 173.876 0.504 25768 8674 1 10 . 1 1 97 97 GLN CA C 97 54.740 54.740 54.221 0.519 25768 8675 1 10 . 1 1 97 97 GLN CB C 97 36.600 36.600 32.019 4.582 25768 8676 1 10 . 1 1 97 97 GLN H H 97 9.480 9.480 8.597 0.883 25768 8677 1 10 . 1 1 98 98 TYR N N 98 122.250 122.250 126.063 -3.813 25768 8678 1 10 . 1 1 98 98 TYR C C 98 173.460 173.460 174.133 -0.673 25768 8679 1 10 . 1 1 98 98 TYR CA C 98 55.160 55.160 56.440 -1.280 25768 8680 1 10 . 1 1 98 98 TYR CB C 98 42.420 42.420 42.581 -0.161 25768 8681 1 10 . 1 1 98 98 TYR H H 98 9.010 9.010 8.666 0.344 25768 8682 1 10 . 1 1 99 99 TYR N N 99 126.860 126.860 123.205 3.655 25768 8683 1 10 . 1 1 99 99 TYR C C 99 175.380 175.380 173.779 1.601 25768 8684 1 10 . 1 1 99 99 TYR CA C 99 54.220 54.220 53.809 0.411 25768 8685 1 10 . 1 1 99 99 TYR CB C 99 38.890 38.890 38.326 0.564 25768 8686 1 10 . 1 1 99 99 TYR H H 99 8.300 8.300 7.653 0.647 25768 8687 1 10 . 1 1 100 100 PRO C C 100 178.330 178.330 176.758 1.572 25768 8688 1 10 . 1 1 100 100 PRO CA C 100 64.750 64.750 64.243 0.506 25768 8689 1 10 . 1 1 100 100 PRO CB C 100 32.130 32.130 32.422 -0.291 25768 8690 1 10 . 1 1 101 101 MET N N 101 114.520 114.520 116.528 -2.008 25768 8691 1 10 . 1 1 101 101 MET C C 101 178.240 178.240 175.529 2.711 25768 8692 1 10 . 1 1 101 101 MET CA C 101 53.500 53.500 54.635 -1.135 25768 8693 1 10 . 1 1 101 101 MET CB C 101 30.160 30.160 33.128 -2.968 25768 8694 1 10 . 1 1 101 101 MET H H 101 9.390 9.390 7.823 1.567 25768 8695 1 10 . 1 1 102 102 GLY N N 102 117.500 117.500 108.516 8.984 25768 8696 1 10 . 1 1 102 102 GLY C C 102 175.690 175.690 174.574 1.116 25768 8697 1 10 . 1 1 102 102 GLY CA C 102 46.760 46.760 45.196 1.564 25768 8698 1 10 . 1 1 102 102 GLY H H 102 8.640 8.640 7.698 0.942 25768 8699 1 10 . 1 1 103 103 GLY N N 103 111.030 111.030 110.065 0.965 25768 8700 1 10 . 1 1 103 103 GLY C C 103 174.070 174.070 174.235 -0.165 25768 8701 1 10 . 1 1 103 103 GLY CA C 103 46.140 46.140 44.684 1.456 25768 8702 1 10 . 1 1 103 103 GLY H H 103 9.390 9.390 8.222 1.168 25768 8703 1 10 . 1 1 104 104 THR N N 104 109.290 109.290 113.926 -4.636 25768 8704 1 10 . 1 1 104 104 THR C C 104 174.290 174.290 175.037 -0.747 25768 8705 1 10 . 1 1 104 104 THR CA C 104 60.900 60.900 60.557 0.343 25768 8706 1 10 . 1 1 104 104 THR CB C 104 72.070 72.070 70.337 1.733 25768 8707 1 10 . 1 1 104 104 THR H H 104 7.290 7.290 8.104 -0.814 25768 8708 1 10 . 1 1 105 105 ASN C C 105 175.050 175.050 175.088 -0.038 25768 8709 1 10 . 1 1 105 105 ASN CA C 105 52.880 52.880 52.639 0.242 25768 8710 1 10 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.227 0.033 25768 8711 1 10 . 1 1 106 106 SER N N 106 113.000 113.000 115.176 -2.176 25768 8712 1 10 . 1 1 106 106 SER C C 106 176.000 176.000 175.429 0.571 25768 8713 1 10 . 1 1 106 106 SER CA C 106 58.700 58.700 57.547 1.153 25768 8714 1 10 . 1 1 106 106 SER CB C 106 64.540 64.540 64.215 0.325 25768 8715 1 10 . 1 1 106 106 SER H H 106 7.450 7.450 7.481 -0.031 25768 8716 1 10 . 1 1 107 107 ALA N N 107 132.220 132.220 127.601 4.619 25768 8717 1 10 . 1 1 107 107 ALA C C 107 176.610 176.610 176.679 -0.069 25768 8718 1 10 . 1 1 107 107 ALA CA C 107 54.380 54.380 53.699 0.681 25768 8719 1 10 . 1 1 107 107 ALA CB C 107 18.690 18.690 18.712 -0.021 25768 8720 1 10 . 1 1 107 107 ALA H H 107 8.870 8.870 8.349 0.521 25768 8721 1 10 . 1 1 108 108 PHE N N 108 116.050 116.050 117.894 -1.844 25768 8722 1 10 . 1 1 108 108 PHE C C 108 174.270 174.270 175.974 -1.704 25768 8723 1 10 . 1 1 108 108 PHE CA C 108 56.140 56.140 57.612 -1.472 25768 8724 1 10 . 1 1 108 108 PHE CB C 108 40.520 40.520 39.646 0.874 25768 8725 1 10 . 1 1 108 108 PHE H H 108 7.550 7.550 8.029 -0.479 25768 8726 1 10 . 1 1 109 109 GLN N N 109 128.260 128.260 123.601 4.659 25768 8727 1 10 . 1 1 109 109 GLN C C 109 172.300 172.300 173.871 -1.571 25768 8728 1 10 . 1 1 109 109 GLN CA C 109 52.310 52.310 52.717 -0.407 25768 8729 1 10 . 1 1 109 109 GLN CB C 109 29.050 29.050 29.328 -0.278 25768 8730 1 10 . 1 1 109 109 GLN H H 109 9.060 9.060 8.709 0.351 25768 8731 1 10 . 1 1 110 110 PRO C C 110 175.020 175.020 175.847 -0.827 25768 8732 1 10 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.331 -0.781 25768 8733 1 10 . 1 1 110 110 PRO CB C 110 33.280 33.280 32.299 0.981 25768 8734 1 10 . 1 1 111 111 TYR N N 111 115.730 115.730 118.950 -3.220 25768 8735 1 10 . 1 1 111 111 TYR C C 111 173.850 173.850 175.250 -1.400 25768 8736 1 10 . 1 1 111 111 TYR CA C 111 56.470 56.470 57.400 -0.930 25768 8737 1 10 . 1 1 111 111 TYR CB C 111 38.650 38.650 42.569 -3.919 25768 8738 1 10 . 1 1 111 111 TYR H H 111 8.500 8.500 8.738 -0.238 25768 8739 1 10 . 1 1 112 112 GLY N N 112 103.570 103.570 109.994 -6.424 25768 8740 1 10 . 1 1 112 112 GLY C C 112 172.020 172.020 173.679 -1.659 25768 8741 1 10 . 1 1 112 112 GLY CA C 112 43.950 43.950 44.568 -0.618 25768 8742 1 10 . 1 1 112 112 GLY H H 112 8.110 8.110 8.499 -0.389 25768 8743 1 10 . 1 1 113 113 GLY N N 113 108.510 108.510 113.043 -4.533 25768 8744 1 10 . 1 1 113 113 GLY C C 113 171.540 171.540 172.190 -0.650 25768 8745 1 10 . 1 1 113 113 GLY CA C 113 46.120 46.120 44.031 2.089 25768 8746 1 10 . 1 1 113 113 GLY H H 113 9.080 9.080 8.900 0.180 25768 8747 1 10 . 1 1 114 114 LEU N N 114 120.270 120.270 123.685 -3.415 25768 8748 1 10 . 1 1 114 114 LEU C C 114 175.810 175.810 175.693 0.117 25768 8749 1 10 . 1 1 114 114 LEU CA C 114 53.920 53.920 53.640 0.280 25768 8750 1 10 . 1 1 114 114 LEU CB C 114 47.940 47.940 47.136 0.804 25768 8751 1 10 . 1 1 114 114 LEU H H 114 8.620 8.620 8.537 0.083 25768 8752 1 10 . 1 1 115 115 GLY N N 115 110.620 110.620 110.293 0.327 25768 8753 1 10 . 1 1 115 115 GLY C C 115 171.560 171.560 172.380 -0.820 25768 8754 1 10 . 1 1 115 115 GLY CA C 115 46.940 46.940 44.294 2.646 25768 8755 1 10 . 1 1 115 115 GLY H H 115 9.000 9.000 8.226 0.774 25768 8756 1 10 . 1 1 116 116 VAL N N 116 113.600 113.600 121.594 -7.994 25768 8757 1 10 . 1 1 116 116 VAL C C 116 174.120 174.120 174.235 -0.115 25768 8758 1 10 . 1 1 116 116 VAL CA C 116 58.970 58.970 59.667 -0.697 25768 8759 1 10 . 1 1 116 116 VAL CB C 116 36.600 36.600 35.775 0.825 25768 8760 1 10 . 1 1 116 116 VAL H H 116 8.680 8.680 7.742 0.938 25768 8761 1 10 . 1 1 117 117 ASN N N 117 120.020 120.020 121.931 -1.911 25768 8762 1 10 . 1 1 117 117 ASN CA C 117 52.190 52.190 52.547 -0.357 25768 8763 1 10 . 1 1 117 117 ASN CB C 117 42.450 42.450 40.139 2.311 25768 8764 1 10 . 1 1 117 117 ASN H H 117 8.840 8.840 8.639 0.201 25768 8765 1 10 . 1 1 119 119 THR C C 119 174.350 174.350 173.951 0.399 25768 8766 1 10 . 1 1 119 119 THR CA C 119 63.140 63.140 61.545 1.595 25768 8767 1 10 . 1 1 119 119 THR CB C 119 70.170 70.170 70.126 0.044 25768 8768 1 10 . 1 1 120 120 THR N N 120 114.120 114.120 115.648 -1.528 25768 8769 1 10 . 1 1 120 120 THR C C 120 174.220 174.220 173.531 0.689 25768 8770 1 10 . 1 1 120 120 THR CA C 120 61.900 61.900 61.603 0.297 25768 8771 1 10 . 1 1 120 120 THR CB C 120 70.140 70.140 70.459 -0.319 25768 8772 1 10 . 1 1 120 120 THR H H 120 7.570 7.570 8.112 -0.542 25768 8773 1 10 . 1 1 121 121 PHE N N 121 121.230 121.230 123.680 -2.450 25768 8774 1 10 . 1 1 121 121 PHE C C 121 174.910 174.910 175.817 -0.907 25768 8775 1 10 . 1 1 121 121 PHE CA C 121 58.720 58.720 56.812 1.908 25768 8776 1 10 . 1 1 121 121 PHE CB C 121 40.470 40.470 40.775 -0.305 25768 8777 1 10 . 1 1 121 121 PHE H H 121 7.830 7.830 8.534 -0.704 25768 8778 1 10 . 1 1 122 122 PHE C C 122 175.070 175.070 174.449 0.621 25768 8779 1 10 . 1 1 122 122 PHE CA C 122 57.890 57.890 58.798 -0.908 25768 8780 1 10 . 1 1 122 122 PHE CB C 122 39.870 39.870 40.425 -0.555 25768 8781 1 10 . 1 1 123 123 ASP N N 123 122.170 122.170 117.887 4.283 25768 8782 1 10 . 1 1 123 123 ASP C C 123 176.150 176.150 177.005 -0.855 25768 8783 1 10 . 1 1 123 123 ASP CA C 123 54.530 54.530 55.271 -0.741 25768 8784 1 10 . 1 1 123 123 ASP CB C 123 41.830 41.830 40.915 0.915 25768 8785 1 10 . 1 1 123 123 ASP H H 123 7.950 7.950 8.406 -0.456 25768 8786 1 10 . 1 1 124 124 GLU N N 124 122.690 122.690 120.442 2.248 25768 8787 1 10 . 1 1 124 124 GLU C C 124 176.630 176.630 177.793 -1.163 25768 8788 1 10 . 1 1 124 124 GLU CA C 124 57.620 57.620 58.780 -1.160 25768 8789 1 10 . 1 1 124 124 GLU CB C 124 30.450 30.450 29.652 0.798 25768 8790 1 10 . 1 1 124 124 GLU H H 124 8.340 8.340 8.598 -0.258 25768 8791 1 10 . 1 1 125 125 ASP N N 125 121.280 121.280 118.861 2.419 25768 8792 1 10 . 1 1 125 125 ASP C C 125 176.940 176.940 178.414 -1.474 25768 8793 1 10 . 1 1 125 125 ASP CA C 125 55.180 55.180 57.629 -2.449 25768 8794 1 10 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.336 0.884 25768 8795 1 10 . 1 1 125 125 ASP H H 125 8.310 8.310 8.696 -0.386 25768 8796 1 10 . 1 1 126 126 LEU N N 126 122.830 122.830 114.615 8.215 25768 8797 1 10 . 1 1 126 126 LEU C C 126 178.020 178.020 177.884 0.136 25768 8798 1 10 . 1 1 126 126 LEU CA C 126 56.450 56.450 56.991 -0.541 25768 8799 1 10 . 1 1 126 126 LEU CB C 126 42.150 42.150 41.591 0.559 25768 8800 1 10 . 1 1 126 126 LEU H H 126 8.010 8.010 7.722 0.288 25768 8801 1 10 . 1 1 127 127 ALA N N 127 122.660 122.660 121.341 1.319 25768 8802 1 10 . 1 1 127 127 ALA C C 127 178.600 178.600 178.267 0.333 25768 8803 1 10 . 1 1 127 127 ALA CA C 127 53.780 53.780 53.857 -0.077 25768 8804 1 10 . 1 1 127 127 ALA CB C 127 19.000 19.000 19.012 -0.012 25768 8805 1 10 . 1 1 127 127 ALA H H 127 8.100 8.100 7.682 0.418 25768 8806 1 10 . 1 1 128 128 SER N N 128 113.740 113.740 115.519 -1.779 25768 8807 1 10 . 1 1 128 128 SER C C 128 175.010 175.010 173.350 1.660 25768 8808 1 10 . 1 1 128 128 SER CA C 128 59.580 59.580 57.771 1.809 25768 8809 1 10 . 1 1 128 128 SER CB C 128 63.800 63.800 63.809 -0.009 25768 8810 1 10 . 1 1 128 128 SER H H 128 7.920 7.920 7.689 0.231 25768 8811 1 10 . 1 1 129 129 ASN N N 129 120.300 120.300 117.290 3.010 25768 8812 1 10 . 1 1 129 129 ASN C C 129 175.590 175.590 175.635 -0.045 25768 8813 1 10 . 1 1 129 129 ASN CA C 129 54.180 54.180 52.719 1.461 25768 8814 1 10 . 1 1 129 129 ASN CB C 129 38.900 38.900 38.953 -0.053 25768 8815 1 10 . 1 1 129 129 ASN H H 129 8.120 8.120 8.314 -0.194 25768 8816 1 10 . 1 1 130 130 ARG N N 130 120.630 120.630 123.118 -2.488 25768 8817 1 10 . 1 1 130 130 ARG C C 130 176.720 176.720 177.039 -0.319 25768 8818 1 10 . 1 1 130 130 ARG CA C 130 57.240 57.240 57.576 -0.336 25768 8819 1 10 . 1 1 130 130 ARG CB C 130 30.500 30.500 30.268 0.232 25768 8820 1 10 . 1 1 130 130 ARG H H 130 8.050 8.050 8.567 -0.517 25768 8821 1 10 . 1 1 131 131 LYS N N 131 121.150 121.150 119.939 1.211 25768 8822 1 10 . 1 1 131 131 LYS C C 131 176.750 176.750 174.856 1.894 25768 8823 1 10 . 1 1 131 131 LYS CA C 131 57.050 57.050 56.884 0.166 25768 8824 1 10 . 1 1 131 131 LYS CB C 131 32.870 32.870 33.938 -1.068 25768 8825 1 10 . 1 1 131 131 LYS H H 131 8.020 8.020 8.069 -0.049 25768 8826 1 10 . 1 1 132 132 ALA N N 132 124.110 124.110 123.794 0.316 25768 8827 1 10 . 1 1 132 132 ALA C C 132 177.680 177.680 175.602 2.078 25768 8828 1 10 . 1 1 132 132 ALA CA C 132 53.070 53.070 51.495 1.575 25768 8829 1 10 . 1 1 132 132 ALA CB C 132 19.250 19.250 21.481 -2.231 25768 8830 1 10 . 1 1 132 132 ALA H H 132 8.010 8.010 8.288 -0.278 25768 8831 1 10 . 1 1 133 133 GLN N N 133 118.830 118.830 118.329 0.501 25768 8832 1 10 . 1 1 133 133 GLN C C 133 176.380 176.380 174.515 1.865 25768 8833 1 10 . 1 1 133 133 GLN CA C 133 56.400 56.400 55.253 1.147 25768 8834 1 10 . 1 1 133 133 GLN CB C 133 29.670 29.670 31.966 -2.296 25768 8835 1 10 . 1 1 133 133 GLN H H 133 8.070 8.070 9.220 -1.150 25768 8836 1 10 . 1 1 134 134 GLY N N 134 109.400 109.400 109.517 -0.117 25768 8837 1 10 . 1 1 134 134 GLY C C 134 174.060 174.060 172.319 1.741 25768 8838 1 10 . 1 1 134 134 GLY CA C 134 45.690 45.690 44.821 0.869 25768 8839 1 10 . 1 1 134 134 GLY H H 134 8.150 8.150 8.059 0.091 25768 8840 1 10 . 1 1 135 135 PHE N N 135 120.480 120.480 121.957 -1.477 25768 8841 1 10 . 1 1 135 135 PHE C C 135 176.000 176.000 175.340 0.660 25768 8842 1 10 . 1 1 135 135 PHE CA C 135 58.370 58.370 57.232 1.138 25768 8843 1 10 . 1 1 135 135 PHE CB C 135 39.710 39.710 39.696 0.014 25768 8844 1 10 . 1 1 135 135 PHE H H 135 8.060 8.060 8.378 -0.318 25768 8845 1 10 . 1 1 136 136 SER N N 136 116.740 116.740 120.080 -3.340 25768 8846 1 10 . 1 1 136 136 SER C C 136 174.620 174.620 173.494 1.126 25768 8847 1 10 . 1 1 136 136 SER CA C 136 58.870 58.870 57.623 1.248 25768 8848 1 10 . 1 1 136 136 SER CB C 136 64.200 64.200 64.863 -0.663 25768 8849 1 10 . 1 1 136 136 SER H H 136 8.160 8.160 8.648 -0.488 25768 8850 1 10 . 1 1 137 137 SER N N 137 117.650 117.650 121.311 -3.661 25768 8851 1 10 . 1 1 137 137 SER C C 137 174.410 174.410 174.219 0.191 25768 8852 1 10 . 1 1 137 137 SER CA C 137 58.880 58.880 58.285 0.595 25768 8853 1 10 . 1 1 137 137 SER CB C 137 64.140 64.140 63.421 0.719 25768 8854 1 10 . 1 1 137 137 SER H H 137 8.140 8.140 8.431 -0.291 25768 8855 1 10 . 1 1 138 138 MET N N 138 121.980 121.980 124.924 -2.944 25768 8856 1 10 . 1 1 138 138 MET C C 138 175.680 175.680 175.380 0.300 25768 8857 1 10 . 1 1 138 138 MET CA C 138 56.180 56.180 55.736 0.444 25768 8858 1 10 . 1 1 138 138 MET CB C 138 33.240 33.240 34.416 -1.176 25768 8859 1 10 . 1 1 138 138 MET H H 138 8.110 8.110 8.302 -0.192 25768 8860 1 10 . 1 1 139 139 LYS N N 139 122.110 122.110 124.378 -2.268 25768 8861 1 10 . 1 1 139 139 LYS C C 139 176.220 176.220 176.191 0.029 25768 8862 1 10 . 1 1 139 139 LYS CA C 139 56.370 56.370 56.576 -0.206 25768 8863 1 10 . 1 1 139 139 LYS CB C 139 33.220 33.220 32.548 0.672 25768 8864 1 10 . 1 1 139 139 LYS H H 139 8.140 8.140 8.613 -0.473 25768 8865 1 10 . 1 1 140 140 LEU N N 140 123.860 123.860 119.582 4.278 25768 8866 1 10 . 1 1 140 140 LEU C C 140 177.100 177.100 176.058 1.042 25768 8867 1 10 . 1 1 140 140 LEU CA C 140 55.710 55.710 55.734 -0.025 25768 8868 1 10 . 1 1 140 140 LEU CB C 140 42.460 42.460 43.251 -0.791 25768 8869 1 10 . 1 1 140 140 LEU H H 140 8.140 8.140 7.886 0.254 25768 8870 1 10 . 1 1 141 141 GLN N N 141 120.350 120.350 121.453 -1.103 25768 8871 1 10 . 1 1 141 141 GLN C C 141 175.170 175.170 175.246 -0.076 25768 8872 1 10 . 1 1 141 141 GLN CA C 141 56.200 56.200 56.606 -0.406 25768 8873 1 10 . 1 1 141 141 GLN CB C 141 29.950 29.950 27.560 2.390 25768 8874 1 10 . 1 1 141 141 GLN H H 141 8.210 8.210 8.375 -0.165 25768 8875 1 10 . 1 1 142 142 ASP N N 142 120.950 120.950 122.722 -1.772 25768 8876 1 10 . 1 1 142 142 ASP C C 142 175.840 175.840 176.401 -0.561 25768 8877 1 10 . 1 1 142 142 ASP CA C 142 54.700 54.700 54.838 -0.138 25768 8878 1 10 . 1 1 142 142 ASP CB C 142 41.760 41.760 42.590 -0.830 25768 8879 1 10 . 1 1 142 142 ASP H H 142 8.120 8.120 8.449 -0.329 25768 8880 1 10 . 1 1 143 143 SER N N 143 114.880 114.880 114.369 0.511 25768 8881 1 10 . 1 1 143 143 SER C C 143 173.290 173.290 173.740 -0.450 25768 8882 1 10 . 1 1 143 143 SER CA C 143 58.450 58.450 58.697 -0.247 25768 8883 1 10 . 1 1 143 143 SER CB C 143 64.760 64.760 64.229 0.531 25768 8884 1 10 . 1 1 143 143 SER H H 143 7.960 7.960 8.441 -0.481 25768 8885 1 10 . 1 1 144 144 TRP N N 144 123.110 123.110 121.731 1.379 25768 8886 1 10 . 1 1 144 144 TRP C C 144 175.880 175.880 176.917 -1.037 25768 8887 1 10 . 1 1 144 144 TRP CA C 144 56.420 56.420 56.759 -0.339 25768 8888 1 10 . 1 1 144 144 TRP CB C 144 31.160 31.160 30.178 0.982 25768 8889 1 10 . 1 1 144 144 TRP H H 144 8.080 8.080 7.641 0.439 25768 8890 1 10 . 1 1 145 145 GLY N N 145 110.410 110.410 108.206 2.204 25768 8891 1 10 . 1 1 145 145 GLY C C 145 172.870 172.870 174.728 -1.858 25768 8892 1 10 . 1 1 145 145 GLY CA C 145 45.130 45.130 44.606 0.524 25768 8893 1 10 . 1 1 145 145 GLY H H 145 8.660 8.660 8.788 -0.128 25768 8894 1 10 . 1 1 148 148 GLY C C 148 171.800 171.800 173.339 -1.539 25768 8895 1 10 . 1 1 148 148 GLY CA C 148 44.140 44.140 45.540 -1.400 25768 8896 1 10 . 1 1 149 149 GLU N N 149 123.070 123.070 122.654 0.416 25768 8897 1 10 . 1 1 149 149 GLU C C 149 174.210 174.210 174.868 -0.658 25768 8898 1 10 . 1 1 149 149 GLU CA C 149 55.120 55.120 55.319 -0.199 25768 8899 1 10 . 1 1 149 149 GLU CB C 149 37.410 37.410 34.530 2.880 25768 8900 1 10 . 1 1 149 149 GLU H H 149 8.550 8.550 8.431 0.119 25768 8901 1 10 . 1 1 150 150 LEU N N 150 126.130 126.130 123.466 2.664 25768 8902 1 10 . 1 1 150 150 LEU C C 150 174.410 174.410 175.755 -1.345 25768 8903 1 10 . 1 1 150 150 LEU CA C 150 54.260 54.260 53.710 0.550 25768 8904 1 10 . 1 1 150 150 LEU CB C 150 47.510 47.510 44.297 3.213 25768 8905 1 10 . 1 1 150 150 LEU H H 150 8.550 8.550 8.307 0.243 25768 8906 1 10 . 1 1 151 151 GLY N N 151 109.500 109.500 109.781 -0.281 25768 8907 1 10 . 1 1 151 151 GLY C C 151 170.610 170.610 172.243 -1.633 25768 8908 1 10 . 1 1 151 151 GLY CA C 151 45.980 45.980 44.175 1.805 25768 8909 1 10 . 1 1 151 151 GLY H H 151 8.090 8.090 8.231 -0.141 25768 8910 1 10 . 1 1 152 152 PHE N N 152 110.960 110.960 123.983 -13.023 25768 8911 1 10 . 1 1 152 152 PHE C C 152 171.510 171.510 174.192 -2.682 25768 8912 1 10 . 1 1 152 152 PHE CA C 152 58.170 58.170 56.172 1.998 25768 8913 1 10 . 1 1 152 152 PHE CB C 152 41.690 41.690 41.890 -0.200 25768 8914 1 10 . 1 1 152 152 PHE H H 152 8.380 8.380 8.212 0.168 25768 8915 1 10 . 1 1 153 153 ASP N N 153 118.880 118.880 126.927 -8.047 25768 8916 1 10 . 1 1 153 153 ASP C C 153 176.520 176.520 174.716 1.804 25768 8917 1 10 . 1 1 153 153 ASP CA C 153 52.940 52.940 53.488 -0.548 25768 8918 1 10 . 1 1 153 153 ASP CB C 153 44.540 44.540 43.693 0.847 25768 8919 1 10 . 1 1 153 153 ASP H H 153 7.970 7.970 8.779 -0.809 25768 8920 1 10 . 1 1 154 154 TYR N N 154 123.630 123.630 127.444 -3.814 25768 8921 1 10 . 1 1 154 154 TYR C C 154 175.610 175.610 173.613 1.997 25768 8922 1 10 . 1 1 154 154 TYR CA C 154 57.310 57.310 57.029 0.281 25768 8923 1 10 . 1 1 154 154 TYR CB C 154 42.040 42.040 42.125 -0.085 25768 8924 1 10 . 1 1 154 154 TYR H H 154 9.730 9.730 9.401 0.329 25768 8925 1 10 . 1 1 155 155 MET N N 155 126.190 126.190 125.996 0.194 25768 8926 1 10 . 1 1 155 155 MET C C 155 174.970 174.970 174.411 0.559 25768 8927 1 10 . 1 1 155 155 MET CA C 155 54.720 54.720 54.894 -0.174 25768 8928 1 10 . 1 1 155 155 MET CB C 155 28.300 28.300 32.745 -4.445 25768 8929 1 10 . 1 1 155 155 MET H H 155 8.600 8.600 8.501 0.099 25768 8930 1 10 . 1 1 156 156 LEU N N 156 125.290 125.290 127.521 -2.231 25768 8931 1 10 . 1 1 156 156 LEU C C 156 177.680 177.680 177.659 0.021 25768 8932 1 10 . 1 1 156 156 LEU CA C 156 56.040 56.040 54.756 1.284 25768 8933 1 10 . 1 1 156 156 LEU CB C 156 43.040 43.040 44.335 -1.295 25768 8934 1 10 . 1 1 156 156 LEU H H 156 9.190 9.190 8.575 0.615 25768 8935 1 10 . 1 1 157 157 ASN N N 157 114.690 114.690 116.830 -2.140 25768 8936 1 10 . 1 1 157 157 ASN C C 157 173.640 173.640 177.761 -4.121 25768 8937 1 10 . 1 1 157 157 ASN CA C 157 52.650 52.650 56.460 -3.810 25768 8938 1 10 . 1 1 157 157 ASN CB C 157 37.270 37.270 36.809 0.461 25768 8939 1 10 . 1 1 157 157 ASN H H 157 8.060 8.060 8.259 -0.199 25768 8940 1 10 . 1 1 158 158 GLU N N 158 114.530 114.530 121.695 -7.165 25768 8941 1 10 . 1 1 158 158 GLU C C 158 176.090 176.090 177.288 -1.198 25768 8942 1 10 . 1 1 158 158 GLU CA C 158 60.010 60.010 58.370 1.640 25768 8943 1 10 . 1 1 158 158 GLU CB C 158 29.730 29.730 29.923 -0.193 25768 8944 1 10 . 1 1 158 158 GLU H H 158 8.560 8.560 8.491 0.069 25768 8945 1 10 . 1 1 159 159 HIS N N 159 110.480 110.480 116.473 -5.993 25768 8946 1 10 . 1 1 159 159 HIS C C 159 173.130 173.130 174.539 -1.409 25768 8947 1 10 . 1 1 159 159 HIS CA C 159 56.770 56.770 55.191 1.579 25768 8948 1 10 . 1 1 159 159 HIS CB C 159 32.630 32.630 29.550 3.080 25768 8949 1 10 . 1 1 159 159 HIS H H 159 8.190 8.190 7.727 0.463 25768 8950 1 10 . 1 1 160 160 ALA N N 160 122.890 122.890 120.127 2.763 25768 8951 1 10 . 1 1 160 160 ALA C C 160 176.200 176.200 175.333 0.867 25768 8952 1 10 . 1 1 160 160 ALA CA C 160 51.730 51.730 53.670 -1.940 25768 8953 1 10 . 1 1 160 160 ALA CB C 160 21.560 21.560 18.860 2.700 25768 8954 1 10 . 1 1 160 160 ALA H H 160 8.400 8.400 7.620 0.780 25768 8955 1 10 . 1 1 161 161 LEU N N 161 116.540 116.540 118.219 -1.679 25768 8956 1 10 . 1 1 161 161 LEU C C 161 174.930 174.930 176.334 -1.404 25768 8957 1 10 . 1 1 161 161 LEU CA C 161 54.280 54.280 54.292 -0.012 25768 8958 1 10 . 1 1 161 161 LEU CB C 161 45.640 45.640 44.318 1.323 25768 8959 1 10 . 1 1 161 161 LEU H H 161 8.590 8.590 8.508 0.082 25768 8960 1 10 . 1 1 162 162 PHE N N 162 121.780 121.780 122.621 -0.841 25768 8961 1 10 . 1 1 162 162 PHE C C 162 171.960 171.960 175.016 -3.056 25768 8962 1 10 . 1 1 162 162 PHE CA C 162 56.420 56.420 57.196 -0.776 25768 8963 1 10 . 1 1 162 162 PHE CB C 162 43.340 43.340 41.749 1.591 25768 8964 1 10 . 1 1 162 162 PHE H H 162 9.180 9.180 8.765 0.415 25768 8965 1 10 . 1 1 163 163 ASN N N 163 127.850 127.850 121.935 5.915 25768 8966 1 10 . 1 1 163 163 ASN C C 163 171.320 171.320 174.524 -3.204 25768 8967 1 10 . 1 1 163 163 ASN CA C 163 52.340 52.340 52.557 -0.217 25768 8968 1 10 . 1 1 163 163 ASN CB C 163 46.410 46.410 41.917 4.493 25768 8969 1 10 . 1 1 163 163 ASN H H 163 7.700 7.700 8.651 -0.951 25768 8970 1 10 . 1 1 164 164 MET N N 164 119.950 119.950 123.550 -3.600 25768 8971 1 10 . 1 1 164 164 MET C C 164 172.830 172.830 174.608 -1.778 25768 8972 1 10 . 1 1 164 164 MET CA C 164 55.180 55.180 54.394 0.786 25768 8973 1 10 . 1 1 164 164 MET CB C 164 37.770 37.770 36.110 1.660 25768 8974 1 10 . 1 1 164 164 MET H H 164 7.070 7.070 9.039 -1.969 25768 8975 1 10 . 1 1 165 165 ALA N N 165 120.600 120.600 123.530 -2.930 25768 8976 1 10 . 1 1 165 165 ALA C C 165 174.240 174.240 175.601 -1.361 25768 8977 1 10 . 1 1 165 165 ALA CA C 165 51.630 51.630 51.015 0.615 25768 8978 1 10 . 1 1 165 165 ALA CB C 165 22.330 22.330 21.038 1.292 25768 8979 1 10 . 1 1 165 165 ALA H H 165 8.290 8.290 8.317 -0.027 25768 8980 1 10 . 1 1 166 166 VAL N N 166 117.900 117.900 118.636 -0.736 25768 8981 1 10 . 1 1 166 166 VAL C C 166 172.950 172.950 175.178 -2.228 25768 8982 1 10 . 1 1 166 166 VAL CA C 166 59.710 59.710 59.088 0.622 25768 8983 1 10 . 1 1 166 166 VAL CB C 166 35.290 35.290 34.846 0.444 25768 8984 1 10 . 1 1 166 166 VAL H H 166 8.720 8.720 7.891 0.829 25768 8985 1 10 . 1 1 171 171 ILE C C 171 175.750 175.750 175.114 0.636 25768 8986 1 10 . 1 1 171 171 ILE CA C 171 61.720 61.720 61.955 -0.234 25768 8987 1 10 . 1 1 171 171 ILE CB C 171 39.300 39.300 38.344 0.956 25768 8988 1 10 . 1 1 172 172 ASP N N 172 124.070 124.070 120.963 3.107 25768 8989 1 10 . 1 1 172 172 ASP C C 172 176.590 176.590 174.864 1.726 25768 8990 1 10 . 1 1 172 172 ASP CA C 172 54.460 54.460 54.790 -0.330 25768 8991 1 10 . 1 1 172 172 ASP CB C 172 41.410 41.410 40.919 0.491 25768 8992 1 10 . 1 1 172 172 ASP H H 172 8.460 8.460 8.453 0.007 25768 8993 1 10 . 1 1 173 173 THR N N 173 115.570 115.570 115.196 0.374 25768 8994 1 10 . 1 1 173 173 THR C C 173 175.030 175.030 174.837 0.193 25768 8995 1 10 . 1 1 173 173 THR CA C 173 62.680 62.680 62.133 0.547 25768 8996 1 10 . 1 1 173 173 THR CB C 173 69.840 69.840 69.336 0.504 25768 8997 1 10 . 1 1 173 173 THR H H 173 8.080 8.080 8.416 -0.336 25768 8998 1 10 . 1 1 174 174 LYS N N 174 122.680 122.680 126.385 -3.705 25768 8999 1 10 . 1 1 174 174 LYS C C 174 176.340 176.340 176.152 0.188 25768 9000 1 10 . 1 1 174 174 LYS CA C 174 56.820 56.820 56.523 0.297 25768 9001 1 10 . 1 1 174 174 LYS CB C 174 32.790 32.790 32.337 0.453 25768 9002 1 10 . 1 1 174 174 LYS H H 174 8.180 8.180 8.655 -0.475 25768 9003 1 10 . 1 1 175 175 ALA N N 175 124.050 124.050 124.578 -0.528 25768 9004 1 10 . 1 1 175 175 ALA C C 175 177.550 177.550 177.751 -0.201 25768 9005 1 10 . 1 1 175 175 ALA CA C 175 52.840 52.840 52.158 0.682 25768 9006 1 10 . 1 1 175 175 ALA CB C 175 19.580 19.580 17.589 1.991 25768 9007 1 10 . 1 1 175 175 ALA H H 175 8.050 8.050 8.109 -0.059 25768 9008 1 10 . 1 1 176 176 SER N N 176 114.920 114.920 120.419 -5.499 25768 9009 1 10 . 1 1 176 176 SER C C 176 174.240 174.240 175.498 -1.258 25768 9010 1 10 . 1 1 176 176 SER CA C 176 58.390 58.390 59.686 -1.296 25768 9011 1 10 . 1 1 176 176 SER CB C 176 64.370 64.370 63.670 0.700 25768 9012 1 10 . 1 1 176 176 SER H H 176 8.070 8.070 8.249 -0.179 25768 9013 1 10 . 1 1 177 177 ILE N N 177 121.650 121.650 124.874 -3.224 25768 9014 1 10 . 1 1 177 177 ILE C C 177 174.990 174.990 175.138 -0.148 25768 9015 1 10 . 1 1 177 177 ILE CA C 177 61.570 61.570 61.170 0.400 25768 9016 1 10 . 1 1 177 177 ILE CB C 177 39.100 39.100 37.521 1.579 25768 9017 1 10 . 1 1 177 177 ILE H H 177 7.960 7.960 8.012 -0.052 25768 9018 1 10 . 1 1 178 178 ASN N N 178 127.040 127.040 126.226 0.814 25768 9019 1 10 . 1 1 178 178 ASN C C 178 179.160 179.160 175.107 4.053 25768 9020 1 10 . 1 1 178 178 ASN CA C 178 55.100 55.100 53.078 2.022 25768 9021 1 10 . 1 1 178 178 ASN CB C 178 41.300 41.300 39.329 1.971 25768 9022 1 10 . 1 1 178 178 ASN H H 178 7.850 7.850 8.624 -0.774 25768 9023 1 10 . 1 1 180 180 PRO C C 180 177.520 177.520 176.494 1.026 25768 9024 1 10 . 1 1 180 180 PRO CA C 180 63.980 63.980 62.988 0.992 25768 9025 1 10 . 1 1 180 180 PRO CB C 180 32.190 32.190 33.047 -0.857 25768 9026 1 10 . 1 1 181 181 SER N N 181 115.600 115.600 114.076 1.524 25768 9027 1 10 . 1 1 181 181 SER C C 181 174.710 174.710 174.048 0.662 25768 9028 1 10 . 1 1 181 181 SER CA C 181 58.900 58.900 58.818 0.082 25768 9029 1 10 . 1 1 181 181 SER CB C 181 64.070 64.070 64.252 -0.183 25768 9030 1 10 . 1 1 181 181 SER H H 181 8.260 8.260 8.357 -0.097 25768 9031 1 10 . 1 1 182 182 ALA N N 182 125.880 125.880 125.148 0.732 25768 9032 1 10 . 1 1 182 182 ALA C C 182 177.560 177.560 176.014 1.546 25768 9033 1 10 . 1 1 182 182 ALA CA C 182 53.090 53.090 52.532 0.558 25768 9034 1 10 . 1 1 182 182 ALA CB C 182 19.310 19.310 18.691 0.619 25768 9035 1 10 . 1 1 182 182 ALA H H 182 8.130 8.130 8.059 0.071 25768 9036 1 10 . 1 1 183 183 LEU N N 183 119.980 119.980 121.384 -1.404 25768 9037 1 10 . 1 1 183 183 LEU C C 183 177.850 177.850 177.380 0.470 25768 9038 1 10 . 1 1 183 183 LEU CA C 183 55.650 55.650 54.499 1.151 25768 9039 1 10 . 1 1 183 183 LEU CB C 183 42.530 42.530 44.046 -1.516 25768 9040 1 10 . 1 1 183 183 LEU H H 183 7.940 7.940 7.840 0.100 25768 9041 1 10 . 1 1 184 184 GLY N N 184 109.250 109.250 110.212 -0.962 25768 9042 1 10 . 1 1 184 184 GLY C C 184 174.250 174.250 174.162 0.088 25768 9043 1 10 . 1 1 184 184 GLY CA C 184 45.830 45.830 44.934 0.896 25768 9044 1 10 . 1 1 184 184 GLY H H 184 8.150 8.150 8.376 -0.226 25768 9045 1 10 . 1 1 185 185 VAL N N 185 118.830 118.830 118.512 0.318 25768 9046 1 10 . 1 1 185 185 VAL C C 185 175.890 175.890 175.338 0.552 25768 9047 1 10 . 1 1 185 185 VAL CA C 185 62.740 62.740 60.794 1.946 25768 9048 1 10 . 1 1 185 185 VAL CB C 185 32.770 32.770 32.953 -0.183 25768 9049 1 10 . 1 1 185 185 VAL H H 185 7.760 7.760 8.005 -0.245 25768 9050 1 10 . 1 1 186 186 ASN N N 186 121.850 121.850 122.909 -1.059 25768 9051 1 10 . 1 1 186 186 ASN C C 186 174.970 174.970 174.427 0.543 25768 9052 1 10 . 1 1 186 186 ASN CA C 186 53.590 53.590 53.620 -0.030 25768 9053 1 10 . 1 1 186 186 ASN CB C 186 39.160 39.160 39.420 -0.260 25768 9054 1 10 . 1 1 186 186 ASN H H 186 8.380 8.380 8.634 -0.254 25768 9055 1 10 . 1 1 187 187 LYS N N 187 122.120 122.120 123.552 -1.432 25768 9056 1 10 . 1 1 187 187 LYS C C 187 176.490 176.490 175.702 0.788 25768 9057 1 10 . 1 1 187 187 LYS CA C 187 56.750 56.750 56.220 0.530 25768 9058 1 10 . 1 1 187 187 LYS CB C 187 33.250 33.250 33.546 -0.296 25768 9059 1 10 . 1 1 187 187 LYS H H 187 8.140 8.140 8.414 -0.274 25768 9060 1 10 . 1 1 188 188 THR N N 188 115.250 115.250 113.517 1.733 25768 9061 1 10 . 1 1 188 188 THR C C 188 174.250 174.250 173.483 0.767 25768 9062 1 10 . 1 1 188 188 THR CA C 188 62.360 62.360 61.625 0.735 25768 9063 1 10 . 1 1 188 188 THR CB C 188 70.280 70.280 70.255 0.025 25768 9064 1 10 . 1 1 188 188 THR H H 188 8.100 8.100 7.961 0.139 25768 9065 1 10 . 1 1 189 189 LYS N N 189 123.780 123.780 126.746 -2.966 25768 9066 1 10 . 1 1 189 189 LYS C C 189 176.090 176.090 175.828 0.262 25768 9067 1 10 . 1 1 189 189 LYS CA C 189 56.590 56.590 56.712 -0.123 25768 9068 1 10 . 1 1 189 189 LYS CB C 189 33.350 33.350 31.484 1.866 25768 9069 1 10 . 1 1 189 189 LYS H H 189 8.110 8.110 8.624 -0.514 25768 9070 1 10 . 1 1 190 190 VAL N N 190 120.920 120.920 117.399 3.521 25768 9071 1 10 . 1 1 190 190 VAL C C 190 175.590 175.590 174.971 0.619 25768 9072 1 10 . 1 1 190 190 VAL CA C 190 62.400 62.400 60.352 2.047 25768 9073 1 10 . 1 1 190 190 VAL CB C 190 32.990 32.990 33.783 -0.793 25768 9074 1 10 . 1 1 190 190 VAL H H 190 8.040 8.040 7.980 0.060 25768 9075 1 10 . 1 1 191 191 ASP N N 191 123.790 123.790 121.197 2.593 25768 9076 1 10 . 1 1 191 191 ASP C C 191 175.750 175.750 177.004 -1.254 25768 9077 1 10 . 1 1 191 191 ASP CA C 191 54.650 54.650 54.397 0.253 25768 9078 1 10 . 1 1 191 191 ASP CB C 191 41.450 41.450 42.055 -0.605 25768 9079 1 10 . 1 1 191 191 ASP H H 191 8.240 8.240 8.380 -0.140 25768 9080 1 10 . 1 1 192 192 VAL N N 192 118.850 118.850 120.479 -1.629 25768 9081 1 10 . 1 1 192 192 VAL C C 192 175.380 175.380 174.295 1.085 25768 9082 1 10 . 1 1 192 192 VAL CA C 192 62.110 62.110 63.140 -1.030 25768 9083 1 10 . 1 1 192 192 VAL CB C 192 33.290 33.290 31.686 1.604 25768 9084 1 10 . 1 1 192 192 VAL H H 192 7.860 7.860 7.948 -0.088 25768 9085 1 10 . 1 1 193 193 ASP N N 193 124.190 124.190 118.480 5.710 25768 9086 1 10 . 1 1 193 193 ASP C C 193 175.630 175.630 174.310 1.320 25768 9087 1 10 . 1 1 193 193 ASP CA C 193 54.540 54.540 54.101 0.439 25768 9088 1 10 . 1 1 193 193 ASP CB C 193 41.410 41.410 41.955 -0.545 25768 9089 1 10 . 1 1 193 193 ASP H H 193 8.310 8.310 7.932 0.378 25768 9090 1 10 . 1 1 194 194 VAL N N 194 119.580 119.580 120.980 -1.400 25768 9091 1 10 . 1 1 194 194 VAL C C 194 174.950 174.950 174.222 0.728 25768 9092 1 10 . 1 1 194 194 VAL CA C 194 61.770 61.770 61.610 0.160 25768 9093 1 10 . 1 1 194 194 VAL CB C 194 33.680 33.680 34.311 -0.631 25768 9094 1 10 . 1 1 194 194 VAL H H 194 7.890 7.890 7.915 -0.025 25768 9095 1 10 . 1 1 195 195 ASP N N 195 125.660 125.660 127.789 -2.129 25768 9096 1 10 . 1 1 195 195 ASP C C 195 174.290 174.290 174.200 0.090 25768 9097 1 10 . 1 1 195 195 ASP CA C 195 51.940 51.940 51.995 -0.055 25768 9098 1 10 . 1 1 195 195 ASP CB C 195 40.950 40.950 41.178 -0.228 25768 9099 1 10 . 1 1 195 195 ASP H H 195 8.410 8.410 8.424 -0.014 25768 9100 1 10 . 1 1 198 198 VAL C C 198 173.940 173.940 173.282 0.658 25768 9101 1 10 . 1 1 198 198 VAL CA C 198 61.270 61.270 60.260 1.010 25768 9102 1 10 . 1 1 198 198 VAL CB C 198 35.910 35.910 33.458 2.452 25768 9103 1 10 . 1 1 199 199 TYR N N 199 123.780 123.780 119.232 4.548 25768 9104 1 10 . 1 1 199 199 TYR C C 199 174.150 174.150 174.121 0.029 25768 9105 1 10 . 1 1 199 199 TYR CA C 199 56.220 56.220 56.216 0.004 25768 9106 1 10 . 1 1 199 199 TYR CB C 199 41.660 41.660 41.865 -0.206 25768 9107 1 10 . 1 1 199 199 TYR H H 199 8.540 8.540 8.170 0.370 25768 9108 1 10 . 1 1 200 200 MET N N 200 123.920 123.920 121.339 2.581 25768 9109 1 10 . 1 1 200 200 MET C C 200 173.810 173.810 174.125 -0.315 25768 9110 1 10 . 1 1 200 200 MET CA C 200 54.710 54.710 54.921 -0.211 25768 9111 1 10 . 1 1 200 200 MET CB C 200 37.110 37.110 34.177 2.933 25768 9112 1 10 . 1 1 200 200 MET H H 200 9.130 9.130 8.518 0.612 25768 9113 1 10 . 1 1 201 201 ILE N N 201 123.670 123.670 125.432 -1.762 25768 9114 1 10 . 1 1 201 201 ILE C C 201 174.030 174.030 173.530 0.500 25768 9115 1 10 . 1 1 201 201 ILE CA C 201 59.820 59.820 58.853 0.967 25768 9116 1 10 . 1 1 201 201 ILE CB C 201 41.720 41.720 41.609 0.111 25768 9117 1 10 . 1 1 201 201 ILE H H 201 8.030 8.030 8.002 0.028 25768 9118 1 10 . 1 1 202 202 GLY N N 202 112.910 112.910 114.425 -1.515 25768 9119 1 10 . 1 1 202 202 GLY C C 202 170.280 170.280 171.891 -1.611 25768 9120 1 10 . 1 1 202 202 GLY CA C 202 46.800 46.800 45.355 1.445 25768 9121 1 10 . 1 1 202 202 GLY H H 202 8.580 8.580 8.026 0.554 25768 9122 1 10 . 1 1 203 203 PHE N N 203 116.240 116.240 114.867 1.373 25768 9123 1 10 . 1 1 203 203 PHE C C 203 173.940 173.940 173.482 0.458 25768 9124 1 10 . 1 1 203 203 PHE CA C 203 55.890 55.890 54.555 1.335 25768 9125 1 10 . 1 1 203 203 PHE CB C 203 45.060 45.060 41.116 3.944 25768 9126 1 10 . 1 1 203 203 PHE H H 203 8.620 8.620 8.518 0.102 25768 9127 1 10 . 1 1 204 204 GLY N N 204 105.610 105.610 106.188 -0.578 25768 9128 1 10 . 1 1 204 204 GLY C C 204 171.190 171.190 171.168 0.022 25768 9129 1 10 . 1 1 204 204 GLY CA C 204 46.720 46.720 45.452 1.268 25768 9130 1 10 . 1 1 204 204 GLY H H 204 8.960 8.960 8.859 0.101 25768 9131 1 10 . 1 1 205 205 TYR N N 205 121.160 121.160 118.674 2.486 25768 9132 1 10 . 1 1 205 205 TYR C C 205 173.030 173.030 173.680 -0.650 25768 9133 1 10 . 1 1 205 205 TYR CA C 205 57.190 57.190 56.368 0.822 25768 9134 1 10 . 1 1 205 205 TYR CB C 205 44.400 44.400 43.312 1.088 25768 9135 1 10 . 1 1 205 205 TYR H H 205 9.380 9.380 8.107 1.273 25768 9136 1 10 . 1 1 206 206 LYS N N 206 126.970 126.970 123.820 3.150 25768 9137 1 10 . 1 1 206 206 LYS C C 206 174.210 174.210 175.046 -0.836 25768 9138 1 10 . 1 1 206 206 LYS CA C 206 54.770 54.770 54.694 0.076 25768 9139 1 10 . 1 1 206 206 LYS CB C 206 34.440 34.440 33.893 0.547 25768 9140 1 10 . 1 1 206 206 LYS H H 206 8.380 8.380 7.748 0.632 25768 9141 1 10 . 1 1 207 207 PHE N N 207 126.330 126.330 123.705 2.625 25768 9142 1 10 . 1 1 207 207 PHE C C 207 175.020 175.020 175.607 -0.587 25768 9143 1 10 . 1 1 207 207 PHE CA C 207 58.170 58.170 59.127 -0.957 25768 9144 1 10 . 1 1 207 207 PHE CB C 207 40.920 40.920 40.025 0.895 25768 9145 1 10 . 1 1 207 207 PHE H H 207 9.290 9.290 8.188 1.102 25768 9146 1 10 . 1 1 208 208 LEU N N 208 122.740 122.740 126.419 -3.679 25768 9147 1 10 . 1 1 208 208 LEU C C 208 176.510 176.510 177.164 -0.654 25768 9148 1 10 . 1 1 208 208 LEU CA C 208 54.910 54.910 54.571 0.339 25768 9149 1 10 . 1 1 208 208 LEU CB C 208 43.830 43.830 41.761 2.069 25768 9150 1 10 . 1 1 208 208 LEU H H 208 8.310 8.310 8.469 -0.159 25768 9151 1 11 . 1 1 2 2 HIS C C 2 175.310 175.310 174.090 1.220 25768 9152 1 11 . 1 1 3 3 LYS N N 3 122.080 122.080 123.621 -1.541 25768 9153 1 11 . 1 1 3 3 LYS C C 3 173.490 173.490 174.225 -0.735 25768 9154 1 11 . 1 1 3 3 LYS CA C 3 55.050 55.050 55.400 -0.350 25768 9155 1 11 . 1 1 3 3 LYS CB C 3 35.380 35.380 35.759 -0.379 25768 9156 1 11 . 1 1 3 3 LYS H H 3 8.620 8.620 8.169 0.451 25768 9157 1 11 . 1 1 4 4 ALA N N 4 120.860 120.860 121.837 -0.977 25768 9158 1 11 . 1 1 4 4 ALA C C 4 178.190 178.190 178.083 0.107 25768 9159 1 11 . 1 1 4 4 ALA CA C 4 53.480 53.480 52.862 0.618 25768 9160 1 11 . 1 1 4 4 ALA CB C 4 18.140 18.140 18.455 -0.315 25768 9161 1 11 . 1 1 4 4 ALA H H 4 8.580 8.580 8.241 0.339 25768 9162 1 11 . 1 1 5 5 GLY N N 5 112.890 112.890 112.228 0.662 25768 9163 1 11 . 1 1 5 5 GLY C C 5 173.830 173.830 173.120 0.710 25768 9164 1 11 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.140 0.740 25768 9165 1 11 . 1 1 5 5 GLY H H 5 9.210 9.210 8.028 1.182 25768 9166 1 11 . 1 1 6 6 ASP N N 6 121.590 121.590 120.783 0.807 25768 9167 1 11 . 1 1 6 6 ASP C C 6 174.380 174.380 174.949 -0.569 25768 9168 1 11 . 1 1 6 6 ASP CA C 6 55.790 55.790 53.855 1.935 25768 9169 1 11 . 1 1 6 6 ASP CB C 6 41.760 41.760 42.228 -0.468 25768 9170 1 11 . 1 1 6 6 ASP H H 6 7.620 7.620 7.437 0.183 25768 9171 1 11 . 1 1 7 7 PHE N N 7 120.860 120.860 118.775 2.085 25768 9172 1 11 . 1 1 7 7 PHE C C 7 174.050 174.050 174.989 -0.939 25768 9173 1 11 . 1 1 7 7 PHE CA C 7 56.110 56.110 56.713 -0.603 25768 9174 1 11 . 1 1 7 7 PHE CB C 7 42.550 42.550 41.907 0.643 25768 9175 1 11 . 1 1 7 7 PHE H H 7 8.250 8.250 8.192 0.058 25768 9176 1 11 . 1 1 8 8 ILE N N 8 127.950 127.950 119.999 7.951 25768 9177 1 11 . 1 1 8 8 ILE C C 8 174.000 174.000 174.513 -0.513 25768 9178 1 11 . 1 1 8 8 ILE CA C 8 61.160 61.160 60.278 0.882 25768 9179 1 11 . 1 1 8 8 ILE CB C 8 42.660 42.660 42.431 0.229 25768 9180 1 11 . 1 1 8 8 ILE H H 8 9.230 9.230 8.317 0.913 25768 9181 1 11 . 1 1 9 9 ILE N N 9 125.380 125.380 123.534 1.846 25768 9182 1 11 . 1 1 9 9 ILE C C 9 173.630 173.630 174.982 -1.352 25768 9183 1 11 . 1 1 9 9 ILE CA C 9 59.600 59.600 60.370 -0.770 25768 9184 1 11 . 1 1 9 9 ILE CB C 9 41.180 41.180 40.171 1.009 25768 9185 1 11 . 1 1 9 9 ILE H H 9 8.580 8.580 7.819 0.761 25768 9186 1 11 . 1 1 10 10 ARG N N 10 124.950 124.950 123.020 1.930 25768 9187 1 11 . 1 1 10 10 ARG C C 10 175.030 175.030 174.122 0.908 25768 9188 1 11 . 1 1 10 10 ARG CA C 10 53.920 53.920 55.446 -1.526 25768 9189 1 11 . 1 1 10 10 ARG CB C 10 31.880 31.880 35.147 -3.267 25768 9190 1 11 . 1 1 10 10 ARG H H 10 9.230 9.230 8.069 1.161 25768 9191 1 11 . 1 1 11 11 GLY N N 11 105.650 105.650 108.543 -2.893 25768 9192 1 11 . 1 1 11 11 GLY C C 11 172.090 172.090 171.811 0.279 25768 9193 1 11 . 1 1 11 11 GLY CA C 11 44.460 44.460 45.010 -0.550 25768 9194 1 11 . 1 1 11 11 GLY H H 11 8.780 8.780 8.323 0.457 25768 9195 1 11 . 1 1 12 12 GLY N N 12 107.800 107.800 108.656 -0.856 25768 9196 1 11 . 1 1 12 12 GLY C C 12 171.460 171.460 172.340 -0.880 25768 9197 1 11 . 1 1 12 12 GLY CA C 12 46.630 46.630 45.595 1.035 25768 9198 1 11 . 1 1 12 12 GLY H H 12 8.510 8.510 8.599 -0.089 25768 9199 1 11 . 1 1 13 13 PHE N N 13 119.900 119.900 118.666 1.234 25768 9200 1 11 . 1 1 13 13 PHE C C 13 174.190 174.190 173.640 0.550 25768 9201 1 11 . 1 1 13 13 PHE CA C 13 56.340 56.340 56.985 -0.645 25768 9202 1 11 . 1 1 13 13 PHE CB C 13 41.090 41.090 44.481 -3.391 25768 9203 1 11 . 1 1 13 13 PHE H H 13 8.610 8.610 8.927 -0.317 25768 9204 1 11 . 1 1 14 14 ALA N N 14 128.030 128.030 122.527 5.503 25768 9205 1 11 . 1 1 14 14 ALA C C 14 176.560 176.560 176.254 0.306 25768 9206 1 11 . 1 1 14 14 ALA CA C 14 49.940 49.940 51.092 -1.152 25768 9207 1 11 . 1 1 14 14 ALA CB C 14 20.360 20.360 21.741 -1.381 25768 9208 1 11 . 1 1 14 14 ALA H H 14 9.220 9.220 8.969 0.251 25768 9209 1 11 . 1 1 15 15 THR N N 15 118.620 118.620 113.457 5.163 25768 9210 1 11 . 1 1 15 15 THR CA C 15 61.440 61.440 61.379 0.061 25768 9211 1 11 . 1 1 15 15 THR CB C 15 71.370 71.370 71.991 -0.621 25768 9212 1 11 . 1 1 15 15 THR H H 15 9.220 9.220 8.631 0.589 25768 9213 1 11 . 1 1 18 18 PRO C C 18 176.690 176.690 176.064 0.626 25768 9214 1 11 . 1 1 18 18 PRO CA C 18 63.610 63.610 64.125 -0.515 25768 9215 1 11 . 1 1 18 18 PRO CB C 18 32.440 32.440 32.040 0.400 25768 9216 1 11 . 1 1 19 19 ASP N N 19 120.320 120.320 118.982 1.338 25768 9217 1 11 . 1 1 19 19 ASP C C 19 175.950 175.950 175.147 0.803 25768 9218 1 11 . 1 1 19 19 ASP CA C 19 54.710 54.710 53.583 1.127 25768 9219 1 11 . 1 1 19 19 ASP CB C 19 41.450 41.450 42.688 -1.238 25768 9220 1 11 . 1 1 19 19 ASP H H 19 8.330 8.330 7.941 0.389 25768 9221 1 11 . 1 1 20 20 ASP N N 20 121.990 121.990 122.627 -0.637 25768 9222 1 11 . 1 1 20 20 ASP C C 20 176.760 176.760 175.684 1.076 25768 9223 1 11 . 1 1 20 20 ASP CA C 20 54.470 54.470 55.757 -1.287 25768 9224 1 11 . 1 1 20 20 ASP CB C 20 41.310 41.310 41.611 -0.301 25768 9225 1 11 . 1 1 20 20 ASP H H 20 8.240 8.240 8.730 -0.490 25768 9226 1 11 . 1 1 21 21 SER N N 21 117.050 117.050 112.970 4.080 25768 9227 1 11 . 1 1 21 21 SER C C 21 175.170 175.170 173.080 2.090 25768 9228 1 11 . 1 1 21 21 SER CA C 21 59.490 59.490 57.548 1.942 25768 9229 1 11 . 1 1 21 21 SER CB C 21 64.080 64.080 63.981 0.099 25768 9230 1 11 . 1 1 21 21 SER H H 21 8.360 8.360 7.738 0.622 25768 9231 1 11 . 1 1 22 22 SER N N 22 117.820 117.820 118.327 -0.507 25768 9232 1 11 . 1 1 22 22 SER C C 22 174.940 174.940 173.677 1.263 25768 9233 1 11 . 1 1 22 22 SER CA C 22 59.160 59.160 57.924 1.236 25768 9234 1 11 . 1 1 22 22 SER CB C 22 64.110 64.110 63.155 0.955 25768 9235 1 11 . 1 1 22 22 SER H H 22 8.310 8.310 8.553 -0.243 25768 9236 1 11 . 1 1 23 23 SER N N 23 117.660 117.660 120.944 -3.284 25768 9237 1 11 . 1 1 23 23 SER C C 23 174.340 174.340 173.836 0.504 25768 9238 1 11 . 1 1 23 23 SER CA C 23 59.050 59.050 58.187 0.863 25768 9239 1 11 . 1 1 23 23 SER CB C 23 64.210 64.210 64.239 -0.029 25768 9240 1 11 . 1 1 23 23 SER H H 23 8.120 8.120 8.462 -0.342 25768 9241 1 11 . 1 1 24 24 ASP N N 24 122.590 122.590 121.471 1.119 25768 9242 1 11 . 1 1 24 24 ASP C C 24 176.250 176.250 174.833 1.417 25768 9243 1 11 . 1 1 24 24 ASP CA C 24 54.910 54.910 54.705 0.205 25768 9244 1 11 . 1 1 24 24 ASP CB C 24 41.270 41.270 41.308 -0.038 25768 9245 1 11 . 1 1 24 24 ASP H H 24 8.230 8.230 8.497 -0.267 25768 9246 1 11 . 1 1 25 25 ILE N N 25 120.650 120.650 121.685 -1.035 25768 9247 1 11 . 1 1 25 25 ILE C C 25 176.190 176.190 176.037 0.153 25768 9248 1 11 . 1 1 25 25 ILE CA C 25 61.880 61.880 60.475 1.405 25768 9249 1 11 . 1 1 25 25 ILE CB C 25 38.730 38.730 38.567 0.163 25768 9250 1 11 . 1 1 25 25 ILE H H 25 7.860 7.860 8.319 -0.459 25768 9251 1 11 . 1 1 26 26 LYS N N 26 124.420 124.420 125.963 -1.543 25768 9252 1 11 . 1 1 26 26 LYS C C 26 176.640 176.640 176.117 0.523 25768 9253 1 11 . 1 1 26 26 LYS CA C 26 56.520 56.520 55.912 0.608 25768 9254 1 11 . 1 1 26 26 LYS CB C 26 32.890 32.890 34.727 -1.837 25768 9255 1 11 . 1 1 26 26 LYS H H 26 8.140 8.140 8.321 -0.181 25768 9256 1 11 . 1 1 27 27 LEU N N 27 123.120 123.120 121.938 1.182 25768 9257 1 11 . 1 1 27 27 LEU C C 27 177.110 177.110 176.777 0.333 25768 9258 1 11 . 1 1 27 27 LEU CA C 27 55.590 55.590 56.464 -0.874 25768 9259 1 11 . 1 1 27 27 LEU CB C 27 42.500 42.500 42.345 0.155 25768 9260 1 11 . 1 1 27 27 LEU H H 27 8.080 8.080 8.444 -0.364 25768 9261 1 11 . 1 1 28 28 ASP N N 28 120.850 120.850 121.036 -0.186 25768 9262 1 11 . 1 1 28 28 ASP C C 28 176.960 176.960 175.610 1.350 25768 9263 1 11 . 1 1 28 28 ASP CA C 28 54.800 54.800 53.944 0.856 25768 9264 1 11 . 1 1 28 28 ASP CB C 28 41.380 41.380 40.441 0.939 25768 9265 1 11 . 1 1 28 28 ASP H H 28 8.180 8.180 8.163 0.017 25768 9266 1 11 . 1 1 29 29 GLY N N 29 109.800 109.800 110.579 -0.779 25768 9267 1 11 . 1 1 29 29 GLY C C 29 174.370 174.370 172.413 1.957 25768 9268 1 11 . 1 1 29 29 GLY CA C 29 46.150 46.150 45.249 0.901 25768 9269 1 11 . 1 1 29 29 GLY H H 29 8.230 8.230 8.119 0.111 25768 9270 1 11 . 1 1 30 30 ALA N N 30 123.880 123.880 121.653 2.227 25768 9271 1 11 . 1 1 30 30 ALA C C 30 178.040 178.040 177.414 0.626 25768 9272 1 11 . 1 1 30 30 ALA CA C 30 53.140 53.140 51.585 1.555 25768 9273 1 11 . 1 1 30 30 ALA CB C 30 19.350 19.350 21.327 -1.977 25768 9274 1 11 . 1 1 30 30 ALA H H 30 8.040 8.040 8.219 -0.179 25768 9275 1 11 . 1 1 31 31 LYS N N 31 119.800 119.800 122.367 -2.567 25768 9276 1 11 . 1 1 31 31 LYS C C 31 176.770 176.770 176.206 0.564 25768 9277 1 11 . 1 1 31 31 LYS CA C 31 56.870 56.870 55.911 0.959 25768 9278 1 11 . 1 1 31 31 LYS CB C 31 32.980 32.980 31.189 1.792 25768 9279 1 11 . 1 1 31 31 LYS H H 31 8.060 8.060 8.573 -0.513 25768 9280 1 11 . 1 1 32 32 GLN N N 32 120.930 120.930 123.399 -2.469 25768 9281 1 11 . 1 1 32 32 GLN C C 32 176.000 176.000 176.706 -0.706 25768 9282 1 11 . 1 1 32 32 GLN CA C 32 56.280 56.280 57.270 -0.990 25768 9283 1 11 . 1 1 32 32 GLN CB C 32 29.580 29.580 28.837 0.743 25768 9284 1 11 . 1 1 32 32 GLN H H 32 8.170 8.170 8.238 -0.068 25768 9285 1 11 . 1 1 33 33 ARG N N 33 122.370 122.370 120.877 1.493 25768 9286 1 11 . 1 1 33 33 ARG C C 33 176.820 176.820 176.618 0.202 25768 9287 1 11 . 1 1 33 33 ARG CA C 33 56.680 56.680 57.774 -1.094 25768 9288 1 11 . 1 1 33 33 ARG CB C 33 31.040 31.040 28.973 2.067 25768 9289 1 11 . 1 1 33 33 ARG H H 33 8.270 8.270 8.932 -0.662 25768 9290 1 11 . 1 1 34 34 GLY N N 34 110.210 110.210 108.451 1.759 25768 9291 1 11 . 1 1 34 34 GLY C C 34 174.280 174.280 173.296 0.984 25768 9292 1 11 . 1 1 34 34 GLY CA C 34 45.770 45.770 44.400 1.370 25768 9293 1 11 . 1 1 34 34 GLY H H 34 8.360 8.360 8.251 0.109 25768 9294 1 11 . 1 1 35 35 THR N N 35 114.100 114.100 109.047 5.053 25768 9295 1 11 . 1 1 35 35 THR C C 35 174.550 174.550 173.641 0.909 25768 9296 1 11 . 1 1 35 35 THR CA C 35 62.140 62.140 63.039 -0.899 25768 9297 1 11 . 1 1 35 35 THR CB C 35 70.330 70.330 68.919 1.411 25768 9298 1 11 . 1 1 35 35 THR H H 35 7.970 7.970 8.278 -0.308 25768 9299 1 11 . 1 1 36 36 LYS N N 36 123.850 123.850 123.409 0.441 25768 9300 1 11 . 1 1 36 36 LYS C C 36 176.040 176.040 175.007 1.033 25768 9301 1 11 . 1 1 36 36 LYS CA C 36 56.600 56.600 56.263 0.337 25768 9302 1 11 . 1 1 36 36 LYS CB C 36 33.280 33.280 32.684 0.596 25768 9303 1 11 . 1 1 36 36 LYS H H 36 8.230 8.230 8.606 -0.376 25768 9304 1 11 . 1 1 37 37 ALA N N 37 125.650 125.650 127.112 -1.462 25768 9305 1 11 . 1 1 37 37 ALA C C 37 177.570 177.570 177.048 0.522 25768 9306 1 11 . 1 1 37 37 ALA CA C 37 52.860 52.860 53.147 -0.287 25768 9307 1 11 . 1 1 37 37 ALA CB C 37 19.610 19.610 19.611 -0.001 25768 9308 1 11 . 1 1 37 37 ALA H H 37 8.290 8.290 8.641 -0.351 25768 9309 1 11 . 1 1 38 38 THR N N 38 113.350 113.350 112.638 0.712 25768 9310 1 11 . 1 1 38 38 THR C C 38 174.540 174.540 173.706 0.834 25768 9311 1 11 . 1 1 38 38 THR CA C 38 62.010 62.010 63.193 -1.183 25768 9312 1 11 . 1 1 38 38 THR CB C 38 70.350 70.350 69.771 0.579 25768 9313 1 11 . 1 1 38 38 THR H H 38 7.970 7.970 8.301 -0.331 25768 9314 1 11 . 1 1 39 39 VAL N N 39 120.790 120.790 119.333 1.457 25768 9315 1 11 . 1 1 39 39 VAL C C 39 175.620 175.620 173.876 1.744 25768 9316 1 11 . 1 1 39 39 VAL CA C 39 62.470 62.470 61.587 0.882 25768 9317 1 11 . 1 1 39 39 VAL CB C 39 32.940 32.940 31.958 0.982 25768 9318 1 11 . 1 1 39 39 VAL H H 39 8.020 8.020 7.937 0.083 25768 9319 1 11 . 1 1 40 40 ASP N N 40 123.690 123.690 121.686 2.004 25768 9320 1 11 . 1 1 40 40 ASP C C 40 176.190 176.190 176.159 0.031 25768 9321 1 11 . 1 1 40 40 ASP CA C 40 54.780 54.780 53.754 1.026 25768 9322 1 11 . 1 1 40 40 ASP CB C 40 41.590 41.590 43.977 -2.387 25768 9323 1 11 . 1 1 40 40 ASP H H 40 8.310 8.310 8.151 0.159 25768 9324 1 11 . 1 1 41 41 SER N N 41 115.470 115.470 114.101 1.369 25768 9325 1 11 . 1 1 41 41 SER C C 41 174.170 174.170 174.901 -0.731 25768 9326 1 11 . 1 1 41 41 SER CA C 41 59.000 59.000 58.415 0.585 25768 9327 1 11 . 1 1 41 41 SER CB C 41 64.420 64.420 63.610 0.810 25768 9328 1 11 . 1 1 41 41 SER H H 41 8.130 8.130 8.755 -0.625 25768 9329 1 11 . 1 1 42 42 ASP N N 42 122.430 122.430 118.455 3.975 25768 9330 1 11 . 1 1 42 42 ASP C C 42 175.740 175.740 174.679 1.061 25768 9331 1 11 . 1 1 42 42 ASP CA C 42 54.780 54.780 55.069 -0.289 25768 9332 1 11 . 1 1 42 42 ASP CB C 42 41.620 41.620 40.617 1.003 25768 9333 1 11 . 1 1 42 42 ASP H H 42 8.410 8.410 8.527 -0.117 25768 9334 1 11 . 1 1 43 43 THR N N 43 117.580 117.580 110.988 6.592 25768 9335 1 11 . 1 1 43 43 THR C C 43 173.630 173.630 172.696 0.934 25768 9336 1 11 . 1 1 43 43 THR CA C 43 63.120 63.120 60.576 2.544 25768 9337 1 11 . 1 1 43 43 THR CB C 43 70.650 70.650 71.657 -1.007 25768 9338 1 11 . 1 1 43 43 THR H H 43 8.010 8.010 7.503 0.507 25768 9339 1 11 . 1 1 44 44 GLN N N 44 125.420 125.420 122.841 2.579 25768 9340 1 11 . 1 1 44 44 GLN C C 44 174.080 174.080 174.002 0.078 25768 9341 1 11 . 1 1 44 44 GLN CA C 44 55.110 55.110 54.658 0.452 25768 9342 1 11 . 1 1 44 44 GLN CB C 44 31.570 31.570 30.154 1.416 25768 9343 1 11 . 1 1 44 44 GLN H H 44 9.260 9.260 8.499 0.761 25768 9344 1 11 . 1 1 45 45 LEU N N 45 124.190 124.190 124.859 -0.669 25768 9345 1 11 . 1 1 45 45 LEU C C 45 175.970 175.970 176.239 -0.269 25768 9346 1 11 . 1 1 45 45 LEU CA C 45 54.690 54.690 55.370 -0.680 25768 9347 1 11 . 1 1 45 45 LEU CB C 45 42.270 42.270 43.084 -0.814 25768 9348 1 11 . 1 1 45 45 LEU H H 45 8.550 8.550 8.684 -0.134 25768 9349 1 11 . 1 1 46 46 GLY N N 46 113.310 113.310 111.536 1.774 25768 9350 1 11 . 1 1 46 46 GLY C C 46 171.180 171.180 172.447 -1.267 25768 9351 1 11 . 1 1 46 46 GLY CA C 46 44.400 44.400 43.968 0.432 25768 9352 1 11 . 1 1 46 46 GLY H H 46 8.810 8.810 7.783 1.027 25768 9353 1 11 . 1 1 47 47 LEU N N 47 123.890 123.890 127.392 -3.502 25768 9354 1 11 . 1 1 47 47 LEU C C 47 175.400 175.400 175.268 0.132 25768 9355 1 11 . 1 1 47 47 LEU CA C 47 53.750 53.750 53.570 0.180 25768 9356 1 11 . 1 1 47 47 LEU CB C 47 46.800 46.800 45.998 0.802 25768 9357 1 11 . 1 1 47 47 LEU H H 47 8.590 8.590 8.035 0.555 25768 9358 1 11 . 1 1 48 48 THR N N 48 111.210 111.210 117.980 -6.770 25768 9359 1 11 . 1 1 48 48 THR C C 48 172.520 172.520 172.410 0.110 25768 9360 1 11 . 1 1 48 48 THR CA C 48 58.950 58.950 61.365 -2.415 25768 9361 1 11 . 1 1 48 48 THR CB C 48 72.360 72.360 71.793 0.567 25768 9362 1 11 . 1 1 48 48 THR H H 48 8.620 8.620 8.401 0.219 25768 9363 1 11 . 1 1 49 49 PHE N N 49 118.810 118.810 122.534 -3.724 25768 9364 1 11 . 1 1 49 49 PHE C C 49 174.700 174.700 175.171 -0.471 25768 9365 1 11 . 1 1 49 49 PHE CA C 49 55.080 55.080 56.066 -0.986 25768 9366 1 11 . 1 1 49 49 PHE CB C 49 42.360 42.360 41.635 0.726 25768 9367 1 11 . 1 1 49 49 PHE H H 49 8.410 8.410 8.822 -0.412 25768 9368 1 11 . 1 1 50 50 THR N N 50 121.230 121.230 121.714 -0.484 25768 9369 1 11 . 1 1 50 50 THR C C 50 173.250 173.250 173.877 -0.627 25768 9370 1 11 . 1 1 50 50 THR CA C 50 62.740 62.740 61.521 1.219 25768 9371 1 11 . 1 1 50 50 THR CB C 50 73.740 73.740 68.984 4.756 25768 9372 1 11 . 1 1 50 50 THR H H 50 9.330 9.330 8.428 0.902 25768 9373 1 11 . 1 1 51 51 TYR N N 51 126.010 126.010 127.186 -1.176 25768 9374 1 11 . 1 1 51 51 TYR C C 51 174.850 174.850 175.461 -0.611 25768 9375 1 11 . 1 1 51 51 TYR CA C 51 56.240 56.240 56.850 -0.610 25768 9376 1 11 . 1 1 51 51 TYR CB C 51 41.630 41.630 38.808 2.822 25768 9377 1 11 . 1 1 51 51 TYR H H 51 9.150 9.150 9.565 -0.415 25768 9378 1 11 . 1 1 52 52 MET N N 52 127.390 127.390 123.637 3.753 25768 9379 1 11 . 1 1 52 52 MET C C 52 174.490 174.490 174.731 -0.241 25768 9380 1 11 . 1 1 52 52 MET CA C 52 52.450 52.450 56.704 -4.254 25768 9381 1 11 . 1 1 52 52 MET CB C 52 28.590 28.590 33.573 -4.983 25768 9382 1 11 . 1 1 52 52 MET H H 52 7.950 7.950 8.313 -0.363 25768 9383 1 11 . 1 1 53 53 PHE N N 53 123.830 123.830 126.811 -2.981 25768 9384 1 11 . 1 1 53 53 PHE C C 53 173.720 173.720 174.167 -0.447 25768 9385 1 11 . 1 1 53 53 PHE CA C 53 57.110 57.110 56.941 0.169 25768 9386 1 11 . 1 1 53 53 PHE CB C 53 39.420 39.420 40.824 -1.404 25768 9387 1 11 . 1 1 53 53 PHE H H 53 7.720 7.720 8.383 -0.663 25768 9388 1 11 . 1 1 54 54 ALA N N 54 125.650 125.650 127.868 -2.218 25768 9389 1 11 . 1 1 54 54 ALA C C 54 175.020 175.020 176.092 -1.072 25768 9390 1 11 . 1 1 54 54 ALA CA C 54 50.740 50.740 52.829 -2.089 25768 9391 1 11 . 1 1 54 54 ALA CB C 54 22.700 22.700 18.593 4.107 25768 9392 1 11 . 1 1 54 54 ALA H H 54 8.360 8.360 8.133 0.227 25768 9393 1 11 . 1 1 55 55 ASP N N 55 118.790 118.790 121.037 -2.247 25768 9394 1 11 . 1 1 55 55 ASP C C 55 174.780 174.780 176.048 -1.268 25768 9395 1 11 . 1 1 55 55 ASP CA C 55 58.590 58.590 55.041 3.549 25768 9396 1 11 . 1 1 55 55 ASP CB C 55 40.430 40.430 40.625 -0.195 25768 9397 1 11 . 1 1 55 55 ASP H H 55 8.590 8.590 8.586 0.004 25768 9398 1 11 . 1 1 56 56 LYS N N 56 106.200 106.200 116.181 -9.981 25768 9399 1 11 . 1 1 56 56 LYS C C 56 174.940 174.940 175.760 -0.820 25768 9400 1 11 . 1 1 56 56 LYS CA C 56 55.260 55.260 56.675 -1.415 25768 9401 1 11 . 1 1 56 56 LYS CB C 56 34.510 34.510 33.801 0.709 25768 9402 1 11 . 1 1 56 56 LYS H H 56 7.260 7.260 7.471 -0.211 25768 9403 1 11 . 1 1 57 57 TRP N N 57 115.680 115.680 123.149 -7.469 25768 9404 1 11 . 1 1 57 57 TRP C C 57 173.940 173.940 176.250 -2.310 25768 9405 1 11 . 1 1 57 57 TRP CA C 57 55.410 55.410 58.304 -2.894 25768 9406 1 11 . 1 1 57 57 TRP CB C 57 34.470 34.470 31.571 2.899 25768 9407 1 11 . 1 1 57 57 TRP H H 57 6.570 6.570 8.259 -1.689 25768 9408 1 11 . 1 1 58 58 GLY N N 58 107.610 107.610 109.596 -1.986 25768 9409 1 11 . 1 1 58 58 GLY C C 58 172.730 172.730 172.158 0.572 25768 9410 1 11 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.722 -0.672 25768 9411 1 11 . 1 1 58 58 GLY H H 58 9.260 9.260 7.975 1.285 25768 9412 1 11 . 1 1 59 59 VAL N N 59 118.130 118.130 119.292 -1.162 25768 9413 1 11 . 1 1 59 59 VAL C C 59 173.000 173.000 174.180 -1.180 25768 9414 1 11 . 1 1 59 59 VAL CA C 59 59.950 59.950 59.889 0.061 25768 9415 1 11 . 1 1 59 59 VAL CB C 59 35.170 35.170 33.701 1.469 25768 9416 1 11 . 1 1 59 59 VAL H H 59 9.030 9.030 7.841 1.189 25768 9417 1 11 . 1 1 60 60 GLU N N 60 127.900 127.900 123.505 4.395 25768 9418 1 11 . 1 1 60 60 GLU C C 60 174.470 174.470 175.493 -1.023 25768 9419 1 11 . 1 1 60 60 GLU CA C 60 52.940 52.940 55.202 -2.261 25768 9420 1 11 . 1 1 60 60 GLU CB C 60 35.100 35.100 32.656 2.444 25768 9421 1 11 . 1 1 60 60 GLU H H 60 9.440 9.440 8.998 0.442 25768 9422 1 11 . 1 1 61 61 LEU N N 61 127.410 127.410 126.775 0.635 25768 9423 1 11 . 1 1 61 61 LEU C C 61 174.950 174.950 176.175 -1.225 25768 9424 1 11 . 1 1 61 61 LEU CA C 61 53.390 53.390 54.675 -1.285 25768 9425 1 11 . 1 1 61 61 LEU CB C 61 45.980 45.980 42.671 3.309 25768 9426 1 11 . 1 1 61 61 LEU H H 61 8.740 8.740 8.963 -0.223 25768 9427 1 11 . 1 1 62 62 VAL N N 62 125.750 125.750 118.236 7.514 25768 9428 1 11 . 1 1 62 62 VAL C C 62 173.960 173.960 174.269 -0.309 25768 9429 1 11 . 1 1 62 62 VAL CA C 62 61.350 61.350 59.102 2.248 25768 9430 1 11 . 1 1 62 62 VAL CB C 62 34.740 34.740 34.009 0.731 25768 9431 1 11 . 1 1 62 62 VAL H H 62 8.790 8.790 8.071 0.719 25768 9432 1 11 . 1 1 63 63 ALA N N 63 127.230 127.230 126.672 0.558 25768 9433 1 11 . 1 1 63 63 ALA C C 63 173.930 173.930 175.368 -1.438 25768 9434 1 11 . 1 1 63 63 ALA CA C 63 51.140 51.140 50.937 0.203 25768 9435 1 11 . 1 1 63 63 ALA CB C 63 22.500 22.500 21.764 0.737 25768 9436 1 11 . 1 1 63 63 ALA H H 63 8.740 8.740 8.497 0.243 25768 9437 1 11 . 1 1 64 64 ALA N N 64 120.410 120.410 125.519 -5.109 25768 9438 1 11 . 1 1 64 64 ALA C C 64 176.770 176.770 176.801 -0.031 25768 9439 1 11 . 1 1 64 64 ALA CA C 64 51.420 51.420 50.696 0.724 25768 9440 1 11 . 1 1 64 64 ALA CB C 64 22.590 22.590 21.726 0.864 25768 9441 1 11 . 1 1 64 64 ALA H H 64 8.290 8.290 8.263 0.027 25768 9442 1 11 . 1 1 65 65 THR N N 65 116.130 116.130 115.414 0.716 25768 9443 1 11 . 1 1 65 65 THR C C 65 171.220 171.220 172.965 -1.745 25768 9444 1 11 . 1 1 65 65 THR CA C 65 58.860 58.860 58.929 -0.069 25768 9445 1 11 . 1 1 65 65 THR CB C 65 72.020 72.020 69.580 2.440 25768 9446 1 11 . 1 1 65 65 THR H H 65 8.760 8.760 8.441 0.319 25768 9447 1 11 . 1 1 66 66 PRO C C 66 176.720 176.720 175.096 1.624 25768 9448 1 11 . 1 1 66 66 PRO CA C 66 63.610 63.610 63.395 0.215 25768 9449 1 11 . 1 1 66 66 PRO CB C 66 32.550 32.550 32.382 0.168 25768 9450 1 11 . 1 1 67 67 PHE N N 67 120.360 120.360 113.951 6.409 25768 9451 1 11 . 1 1 67 67 PHE C C 67 175.480 175.480 173.386 2.094 25768 9452 1 11 . 1 1 67 67 PHE CA C 67 58.840 58.840 56.884 1.956 25768 9453 1 11 . 1 1 67 67 PHE CB C 67 40.170 40.170 40.367 -0.197 25768 9454 1 11 . 1 1 67 67 PHE H H 67 8.590 8.590 7.483 1.107 25768 9455 1 11 . 1 1 68 68 ASN N N 68 119.030 119.030 121.384 -2.354 25768 9456 1 11 . 1 1 68 68 ASN C C 68 174.740 174.740 173.568 1.172 25768 9457 1 11 . 1 1 68 68 ASN CA C 68 53.430 53.430 52.529 0.901 25768 9458 1 11 . 1 1 68 68 ASN CB C 68 39.420 39.420 40.340 -0.920 25768 9459 1 11 . 1 1 68 68 ASN H H 68 8.340 8.340 8.794 -0.454 25768 9460 1 11 . 1 1 69 69 HIS N N 69 119.590 119.590 114.899 4.691 25768 9461 1 11 . 1 1 69 69 HIS C C 69 174.370 174.370 174.566 -0.196 25768 9462 1 11 . 1 1 69 69 HIS CA C 69 55.950 55.950 55.571 0.379 25768 9463 1 11 . 1 1 69 69 HIS CB C 69 29.960 29.960 30.608 -0.648 25768 9464 1 11 . 1 1 69 69 HIS H H 69 8.350 8.350 7.897 0.453 25768 9465 1 11 . 1 1 70 70 GLN N N 70 121.980 121.980 120.793 1.187 25768 9466 1 11 . 1 1 70 70 GLN C C 70 175.740 175.740 175.342 0.398 25768 9467 1 11 . 1 1 70 70 GLN CA C 70 56.340 56.340 56.199 0.141 25768 9468 1 11 . 1 1 70 70 GLN CB C 70 29.660 29.660 29.607 0.053 25768 9469 1 11 . 1 1 70 70 GLN H H 70 8.350 8.350 8.852 -0.502 25768 9470 1 11 . 1 1 71 71 VAL N N 71 120.530 120.530 116.268 4.262 25768 9471 1 11 . 1 1 71 71 VAL C C 71 175.500 175.500 175.868 -0.368 25768 9472 1 11 . 1 1 71 71 VAL CA C 71 62.540 62.540 62.351 0.189 25768 9473 1 11 . 1 1 71 71 VAL CB C 71 33.090 33.090 32.980 0.110 25768 9474 1 11 . 1 1 71 71 VAL H H 71 8.020 8.020 8.394 -0.374 25768 9475 1 11 . 1 1 72 72 ASP N N 72 123.910 123.910 121.038 2.872 25768 9476 1 11 . 1 1 72 72 ASP C C 72 176.300 176.300 175.928 0.372 25768 9477 1 11 . 1 1 72 72 ASP CA C 72 54.340 54.340 54.422 -0.082 25768 9478 1 11 . 1 1 72 72 ASP CB C 72 41.480 41.480 41.787 -0.307 25768 9479 1 11 . 1 1 72 72 ASP H H 72 8.280 8.280 7.793 0.487 25768 9480 1 11 . 1 1 73 73 VAL N N 73 120.580 120.580 115.717 4.863 25768 9481 1 11 . 1 1 73 73 VAL C C 73 176.350 176.350 176.508 -0.158 25768 9482 1 11 . 1 1 73 73 VAL CA C 73 62.970 62.970 63.229 -0.259 25768 9483 1 11 . 1 1 73 73 VAL CB C 73 32.550 32.550 33.175 -0.625 25768 9484 1 11 . 1 1 73 73 VAL H H 73 7.960 7.960 8.712 -0.752 25768 9485 1 11 . 1 1 74 74 LYS N N 74 123.620 123.620 118.879 4.741 25768 9486 1 11 . 1 1 74 74 LYS C C 74 177.130 177.130 177.458 -0.328 25768 9487 1 11 . 1 1 74 74 LYS CA C 74 57.060 57.060 56.386 0.674 25768 9488 1 11 . 1 1 74 74 LYS CB C 74 32.860 32.860 33.700 -0.840 25768 9489 1 11 . 1 1 74 74 LYS H H 74 8.230 8.230 8.269 -0.039 25768 9490 1 11 . 1 1 75 75 GLY N N 75 109.370 109.370 109.111 0.259 25768 9491 1 11 . 1 1 75 75 GLY C C 75 174.030 174.030 174.212 -0.182 25768 9492 1 11 . 1 1 75 75 GLY CA C 75 45.800 45.800 44.969 0.830 25768 9493 1 11 . 1 1 75 75 GLY H H 75 8.160 8.160 8.136 0.024 25768 9494 1 11 . 1 1 76 76 LEU N N 76 121.660 121.660 122.819 -1.159 25768 9495 1 11 . 1 1 76 76 LEU C C 76 177.410 177.410 176.344 1.066 25768 9496 1 11 . 1 1 76 76 LEU CA C 76 55.410 55.410 55.595 -0.185 25768 9497 1 11 . 1 1 76 76 LEU CB C 76 42.790 42.790 42.575 0.215 25768 9498 1 11 . 1 1 76 76 LEU H H 76 8.030 8.030 8.176 -0.146 25768 9499 1 11 . 1 1 77 77 GLY N N 77 109.330 109.330 106.022 3.308 25768 9500 1 11 . 1 1 77 77 GLY C C 77 171.800 171.800 172.206 -0.406 25768 9501 1 11 . 1 1 77 77 GLY CA C 77 44.990 44.990 43.847 1.143 25768 9502 1 11 . 1 1 77 77 GLY H H 77 8.100 8.100 8.136 -0.036 25768 9503 1 11 . 1 1 78 78 PRO C C 78 177.740 177.740 176.782 0.958 25768 9504 1 11 . 1 1 78 78 PRO CA C 78 63.890 63.890 63.497 0.393 25768 9505 1 11 . 1 1 78 78 PRO CB C 78 32.170 32.170 31.476 0.694 25768 9506 1 11 . 1 1 79 79 GLY N N 79 109.530 109.530 110.824 -1.294 25768 9507 1 11 . 1 1 79 79 GLY C C 79 174.460 174.460 173.131 1.329 25768 9508 1 11 . 1 1 79 79 GLY CA C 79 45.780 45.780 45.066 0.714 25768 9509 1 11 . 1 1 79 79 GLY H H 79 8.410 8.410 8.254 0.156 25768 9510 1 11 . 1 1 80 80 LEU N N 80 121.880 121.880 121.311 0.569 25768 9511 1 11 . 1 1 80 80 LEU C C 80 177.100 177.100 175.276 1.824 25768 9512 1 11 . 1 1 80 80 LEU CA C 80 55.720 55.720 54.912 0.808 25768 9513 1 11 . 1 1 80 80 LEU CB C 80 42.580 42.580 43.566 -0.986 25768 9514 1 11 . 1 1 80 80 LEU H H 80 8.010 8.010 8.007 0.003 25768 9515 1 11 . 1 1 81 81 ASP N N 81 119.990 119.990 124.340 -4.350 25768 9516 1 11 . 1 1 81 81 ASP C C 81 176.880 176.880 176.417 0.463 25768 9517 1 11 . 1 1 81 81 ASP CA C 81 54.770 54.770 54.399 0.371 25768 9518 1 11 . 1 1 81 81 ASP CB C 81 41.390 41.390 41.995 -0.605 25768 9519 1 11 . 1 1 81 81 ASP H H 81 8.220 8.220 8.767 -0.547 25768 9520 1 11 . 1 1 82 82 GLY N N 82 109.270 109.270 108.908 0.362 25768 9521 1 11 . 1 1 82 82 GLY C C 82 174.190 174.190 173.894 0.296 25768 9522 1 11 . 1 1 82 82 GLY CA C 82 45.990 45.990 44.649 1.341 25768 9523 1 11 . 1 1 82 82 GLY H H 82 8.170 8.170 7.846 0.324 25768 9524 1 11 . 1 1 83 83 LYS N N 83 121.000 121.000 119.657 1.343 25768 9525 1 11 . 1 1 83 83 LYS C C 83 176.610 176.610 175.753 0.857 25768 9526 1 11 . 1 1 83 83 LYS CA C 83 56.620 56.620 56.489 0.131 25768 9527 1 11 . 1 1 83 83 LYS CB C 83 33.020 33.020 32.573 0.447 25768 9528 1 11 . 1 1 83 83 LYS H H 83 7.970 7.970 8.181 -0.211 25768 9529 1 11 . 1 1 84 84 LEU N N 84 123.120 123.120 126.071 -2.951 25768 9530 1 11 . 1 1 84 84 LEU C C 84 176.920 176.920 177.744 -0.824 25768 9531 1 11 . 1 1 84 84 LEU CA C 84 55.550 55.550 55.584 -0.034 25768 9532 1 11 . 1 1 84 84 LEU CB C 84 42.430 42.430 42.379 0.051 25768 9533 1 11 . 1 1 84 84 LEU H H 84 8.130 8.130 8.694 -0.564 25768 9534 1 11 . 1 1 85 85 ALA N N 85 123.930 123.930 122.701 1.229 25768 9535 1 11 . 1 1 85 85 ALA C C 85 177.060 177.060 177.718 -0.658 25768 9536 1 11 . 1 1 85 85 ALA CA C 85 52.790 52.790 53.012 -0.222 25768 9537 1 11 . 1 1 85 85 ALA CB C 85 19.670 19.670 18.822 0.848 25768 9538 1 11 . 1 1 85 85 ALA H H 85 8.040 8.040 8.187 -0.147 25768 9539 1 11 . 1 1 86 86 ASP N N 86 119.760 119.760 118.831 0.929 25768 9540 1 11 . 1 1 86 86 ASP C C 86 175.820 175.820 174.845 0.975 25768 9541 1 11 . 1 1 86 86 ASP CA C 86 54.520 54.520 54.688 -0.168 25768 9542 1 11 . 1 1 86 86 ASP CB C 86 41.390 41.390 41.377 0.013 25768 9543 1 11 . 1 1 86 86 ASP H H 86 8.110 8.110 8.150 -0.040 25768 9544 1 11 . 1 1 87 87 ILE N N 87 120.620 120.620 113.830 6.790 25768 9545 1 11 . 1 1 87 87 ILE C C 87 175.740 175.740 175.042 0.698 25768 9546 1 11 . 1 1 87 87 ILE CA C 87 61.160 61.160 60.306 0.854 25768 9547 1 11 . 1 1 87 87 ILE CB C 87 39.260 39.260 40.128 -0.868 25768 9548 1 11 . 1 1 87 87 ILE H H 87 7.800 7.800 8.166 -0.366 25768 9549 1 11 . 1 1 88 88 LYS N N 88 125.820 125.820 124.074 1.746 25768 9550 1 11 . 1 1 88 88 LYS C C 88 175.340 175.340 176.541 -1.201 25768 9551 1 11 . 1 1 88 88 LYS CA C 88 56.300 56.300 55.392 0.908 25768 9552 1 11 . 1 1 88 88 LYS CB C 88 32.900 32.900 33.392 -0.492 25768 9553 1 11 . 1 1 88 88 LYS H H 88 8.250 8.250 8.404 -0.154 25768 9554 1 11 . 1 1 89 89 GLN N N 89 121.750 121.750 121.450 0.300 25768 9555 1 11 . 1 1 89 89 GLN C C 89 175.000 175.000 175.542 -0.542 25768 9556 1 11 . 1 1 89 89 GLN CA C 89 55.210 55.210 55.865 -0.655 25768 9557 1 11 . 1 1 89 89 GLN CB C 89 30.570 30.570 28.434 2.136 25768 9558 1 11 . 1 1 89 89 GLN H H 89 8.000 8.000 8.339 -0.339 25768 9559 1 11 . 1 1 90 90 LEU N N 90 126.660 126.660 125.063 1.597 25768 9560 1 11 . 1 1 90 90 LEU C C 90 174.240 174.240 175.523 -1.283 25768 9561 1 11 . 1 1 90 90 LEU CA C 90 52.720 52.720 52.087 0.633 25768 9562 1 11 . 1 1 90 90 LEU CB C 90 42.350 42.350 40.711 1.639 25768 9563 1 11 . 1 1 90 90 LEU H H 90 8.630 8.630 8.246 0.384 25768 9564 1 11 . 1 1 92 92 PRO C C 92 173.900 173.900 176.520 -2.620 25768 9565 1 11 . 1 1 92 92 PRO CA C 92 63.320 63.320 63.407 -0.087 25768 9566 1 11 . 1 1 92 92 PRO CB C 92 31.920 31.920 32.053 -0.133 25768 9567 1 11 . 1 1 93 93 THR N N 93 119.770 119.770 116.663 3.107 25768 9568 1 11 . 1 1 93 93 THR C C 93 171.360 171.360 173.966 -2.606 25768 9569 1 11 . 1 1 93 93 THR CA C 93 62.610 62.610 62.235 0.375 25768 9570 1 11 . 1 1 93 93 THR CB C 93 72.680 72.680 69.905 2.775 25768 9571 1 11 . 1 1 93 93 THR H H 93 8.290 8.290 8.189 0.101 25768 9572 1 11 . 1 1 94 94 LEU N N 94 128.880 128.880 123.681 5.199 25768 9573 1 11 . 1 1 94 94 LEU C C 94 175.130 175.130 174.381 0.749 25768 9574 1 11 . 1 1 94 94 LEU CA C 94 53.520 53.520 53.620 -0.100 25768 9575 1 11 . 1 1 94 94 LEU CB C 94 46.140 46.140 44.082 2.058 25768 9576 1 11 . 1 1 94 94 LEU H H 94 8.680 8.680 8.089 0.591 25768 9577 1 11 . 1 1 95 95 LEU N N 95 123.630 123.630 120.184 3.446 25768 9578 1 11 . 1 1 95 95 LEU C C 95 175.540 175.540 175.445 0.095 25768 9579 1 11 . 1 1 95 95 LEU CA C 95 55.190 55.190 54.050 1.140 25768 9580 1 11 . 1 1 95 95 LEU CB C 95 45.300 45.300 44.929 0.371 25768 9581 1 11 . 1 1 95 95 LEU H H 95 9.580 9.580 8.184 1.396 25768 9582 1 11 . 1 1 96 96 LEU N N 96 123.150 123.150 120.691 2.459 25768 9583 1 11 . 1 1 96 96 LEU C C 96 174.960 174.960 175.423 -0.463 25768 9584 1 11 . 1 1 96 96 LEU CA C 96 54.420 54.420 53.603 0.817 25768 9585 1 11 . 1 1 96 96 LEU CB C 96 44.560 44.560 42.717 1.843 25768 9586 1 11 . 1 1 96 96 LEU H H 96 8.770 8.770 8.298 0.472 25768 9587 1 11 . 1 1 97 97 GLN N N 97 121.290 121.290 117.933 3.357 25768 9588 1 11 . 1 1 97 97 GLN C C 97 174.380 174.380 173.786 0.594 25768 9589 1 11 . 1 1 97 97 GLN CA C 97 54.740 54.740 54.536 0.204 25768 9590 1 11 . 1 1 97 97 GLN CB C 97 36.600 36.600 33.879 2.721 25768 9591 1 11 . 1 1 97 97 GLN H H 97 9.480 9.480 7.876 1.604 25768 9592 1 11 . 1 1 98 98 TYR N N 98 122.250 122.250 114.273 7.977 25768 9593 1 11 . 1 1 98 98 TYR C C 98 173.460 173.460 174.348 -0.888 25768 9594 1 11 . 1 1 98 98 TYR CA C 98 55.160 55.160 55.736 -0.577 25768 9595 1 11 . 1 1 98 98 TYR CB C 98 42.420 42.420 40.692 1.728 25768 9596 1 11 . 1 1 98 98 TYR H H 98 9.010 9.010 8.202 0.808 25768 9597 1 11 . 1 1 99 99 TYR N N 99 126.860 126.860 122.271 4.589 25768 9598 1 11 . 1 1 99 99 TYR C C 99 175.380 175.380 176.196 -0.816 25768 9599 1 11 . 1 1 99 99 TYR CA C 99 54.220 54.220 57.533 -3.313 25768 9600 1 11 . 1 1 99 99 TYR CB C 99 38.890 38.890 37.099 1.791 25768 9601 1 11 . 1 1 99 99 TYR H H 99 8.300 8.300 8.026 0.274 25768 9602 1 11 . 1 1 100 100 PRO C C 100 178.330 178.330 177.213 1.117 25768 9603 1 11 . 1 1 100 100 PRO CA C 100 64.750 64.750 64.808 -0.058 25768 9604 1 11 . 1 1 100 100 PRO CB C 100 32.130 32.130 31.963 0.167 25768 9605 1 11 . 1 1 101 101 MET N N 101 114.520 114.520 117.281 -2.761 25768 9606 1 11 . 1 1 101 101 MET C C 101 178.240 178.240 176.493 1.747 25768 9607 1 11 . 1 1 101 101 MET CA C 101 53.500 53.500 54.737 -1.237 25768 9608 1 11 . 1 1 101 101 MET CB C 101 30.160 30.160 31.937 -1.777 25768 9609 1 11 . 1 1 101 101 MET H H 101 9.390 9.390 7.968 1.422 25768 9610 1 11 . 1 1 102 102 GLY N N 102 117.500 117.500 107.679 9.821 25768 9611 1 11 . 1 1 102 102 GLY C C 102 175.690 175.690 175.029 0.661 25768 9612 1 11 . 1 1 102 102 GLY CA C 102 46.760 46.760 45.775 0.985 25768 9613 1 11 . 1 1 102 102 GLY H H 102 8.640 8.640 7.588 1.052 25768 9614 1 11 . 1 1 103 103 GLY N N 103 111.030 111.030 111.592 -0.562 25768 9615 1 11 . 1 1 103 103 GLY C C 103 174.070 174.070 173.977 0.093 25768 9616 1 11 . 1 1 103 103 GLY CA C 103 46.140 46.140 45.001 1.139 25768 9617 1 11 . 1 1 103 103 GLY H H 103 9.390 9.390 8.635 0.755 25768 9618 1 11 . 1 1 104 104 THR N N 104 109.290 109.290 113.889 -4.599 25768 9619 1 11 . 1 1 104 104 THR C C 104 174.290 174.290 174.497 -0.207 25768 9620 1 11 . 1 1 104 104 THR CA C 104 60.900 60.900 60.024 0.876 25768 9621 1 11 . 1 1 104 104 THR CB C 104 72.070 72.070 70.268 1.802 25768 9622 1 11 . 1 1 104 104 THR H H 104 7.290 7.290 7.742 -0.452 25768 9623 1 11 . 1 1 105 105 ASN C C 105 175.050 175.050 174.467 0.583 25768 9624 1 11 . 1 1 105 105 ASN CA C 105 52.880 52.880 53.125 -0.245 25768 9625 1 11 . 1 1 105 105 ASN CB C 105 38.260 38.260 39.029 -0.769 25768 9626 1 11 . 1 1 106 106 SER N N 106 113.000 113.000 115.832 -2.832 25768 9627 1 11 . 1 1 106 106 SER C C 106 176.000 176.000 174.070 1.930 25768 9628 1 11 . 1 1 106 106 SER CA C 106 58.700 58.700 57.966 0.734 25768 9629 1 11 . 1 1 106 106 SER CB C 106 64.540 64.540 63.139 1.401 25768 9630 1 11 . 1 1 106 106 SER H H 106 7.450 7.450 7.375 0.075 25768 9631 1 11 . 1 1 107 107 ALA N N 107 132.220 132.220 127.869 4.351 25768 9632 1 11 . 1 1 107 107 ALA C C 107 176.610 176.610 176.778 -0.168 25768 9633 1 11 . 1 1 107 107 ALA CA C 107 54.380 54.380 53.292 1.088 25768 9634 1 11 . 1 1 107 107 ALA CB C 107 18.690 18.690 19.170 -0.480 25768 9635 1 11 . 1 1 107 107 ALA H H 107 8.870 8.870 8.391 0.479 25768 9636 1 11 . 1 1 108 108 PHE N N 108 116.050 116.050 115.433 0.617 25768 9637 1 11 . 1 1 108 108 PHE C C 108 174.270 174.270 175.148 -0.878 25768 9638 1 11 . 1 1 108 108 PHE CA C 108 56.140 56.140 55.895 0.244 25768 9639 1 11 . 1 1 108 108 PHE CB C 108 40.520 40.520 38.793 1.727 25768 9640 1 11 . 1 1 108 108 PHE H H 108 7.550 7.550 7.010 0.540 25768 9641 1 11 . 1 1 109 109 GLN N N 109 128.260 128.260 124.673 3.587 25768 9642 1 11 . 1 1 109 109 GLN C C 109 172.300 172.300 174.479 -2.179 25768 9643 1 11 . 1 1 109 109 GLN CA C 109 52.310 52.310 52.357 -0.047 25768 9644 1 11 . 1 1 109 109 GLN CB C 109 29.050 29.050 29.988 -0.938 25768 9645 1 11 . 1 1 109 109 GLN H H 109 9.060 9.060 8.311 0.749 25768 9646 1 11 . 1 1 110 110 PRO C C 110 175.020 175.020 175.773 -0.753 25768 9647 1 11 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.399 -0.849 25768 9648 1 11 . 1 1 110 110 PRO CB C 110 33.280 33.280 32.572 0.708 25768 9649 1 11 . 1 1 111 111 TYR N N 111 115.730 115.730 122.210 -6.480 25768 9650 1 11 . 1 1 111 111 TYR C C 111 173.850 173.850 174.880 -1.030 25768 9651 1 11 . 1 1 111 111 TYR CA C 111 56.470 56.470 56.976 -0.506 25768 9652 1 11 . 1 1 111 111 TYR CB C 111 38.650 38.650 40.014 -1.363 25768 9653 1 11 . 1 1 111 111 TYR H H 111 8.500 8.500 8.024 0.476 25768 9654 1 11 . 1 1 112 112 GLY N N 112 103.570 103.570 111.490 -7.920 25768 9655 1 11 . 1 1 112 112 GLY C C 112 172.020 172.020 172.449 -0.429 25768 9656 1 11 . 1 1 112 112 GLY CA C 112 43.950 43.950 43.539 0.411 25768 9657 1 11 . 1 1 112 112 GLY H H 112 8.110 8.110 7.897 0.213 25768 9658 1 11 . 1 1 113 113 GLY N N 113 108.510 108.510 112.203 -3.693 25768 9659 1 11 . 1 1 113 113 GLY C C 113 171.540 171.540 171.974 -0.434 25768 9660 1 11 . 1 1 113 113 GLY CA C 113 46.120 46.120 45.357 0.763 25768 9661 1 11 . 1 1 113 113 GLY H H 113 9.080 9.080 7.868 1.212 25768 9662 1 11 . 1 1 114 114 LEU N N 114 120.270 120.270 117.778 2.492 25768 9663 1 11 . 1 1 114 114 LEU C C 114 175.810 175.810 175.963 -0.153 25768 9664 1 11 . 1 1 114 114 LEU CA C 114 53.920 53.920 54.495 -0.575 25768 9665 1 11 . 1 1 114 114 LEU CB C 114 47.940 47.940 46.332 1.608 25768 9666 1 11 . 1 1 114 114 LEU H H 114 8.620 8.620 8.409 0.211 25768 9667 1 11 . 1 1 115 115 GLY N N 115 110.620 110.620 108.194 2.426 25768 9668 1 11 . 1 1 115 115 GLY C C 115 171.560 171.560 172.522 -0.962 25768 9669 1 11 . 1 1 115 115 GLY CA C 115 46.940 46.940 43.126 3.814 25768 9670 1 11 . 1 1 115 115 GLY H H 115 9.000 9.000 8.897 0.103 25768 9671 1 11 . 1 1 116 116 VAL N N 116 113.600 113.600 117.780 -4.180 25768 9672 1 11 . 1 1 116 116 VAL C C 116 174.120 174.120 174.127 -0.007 25768 9673 1 11 . 1 1 116 116 VAL CA C 116 58.970 58.970 60.919 -1.949 25768 9674 1 11 . 1 1 116 116 VAL CB C 116 36.600 36.600 35.270 1.331 25768 9675 1 11 . 1 1 116 116 VAL H H 116 8.680 8.680 7.821 0.859 25768 9676 1 11 . 1 1 117 117 ASN N N 117 120.020 120.020 125.961 -5.941 25768 9677 1 11 . 1 1 117 117 ASN CA C 117 52.190 52.190 52.000 0.190 25768 9678 1 11 . 1 1 117 117 ASN CB C 117 42.450 42.450 38.663 3.787 25768 9679 1 11 . 1 1 117 117 ASN H H 117 8.840 8.840 8.599 0.241 25768 9680 1 11 . 1 1 119 119 THR C C 119 174.350 174.350 173.370 0.980 25768 9681 1 11 . 1 1 119 119 THR CA C 119 63.140 63.140 59.565 3.575 25768 9682 1 11 . 1 1 119 119 THR CB C 119 70.170 70.170 71.347 -1.178 25768 9683 1 11 . 1 1 120 120 THR N N 120 114.120 114.120 113.755 0.365 25768 9684 1 11 . 1 1 120 120 THR C C 120 174.220 174.220 173.309 0.911 25768 9685 1 11 . 1 1 120 120 THR CA C 120 61.900 61.900 61.616 0.284 25768 9686 1 11 . 1 1 120 120 THR CB C 120 70.140 70.140 68.941 1.199 25768 9687 1 11 . 1 1 120 120 THR H H 120 7.570 7.570 8.041 -0.471 25768 9688 1 11 . 1 1 121 121 PHE N N 121 121.230 121.230 124.835 -3.605 25768 9689 1 11 . 1 1 121 121 PHE C C 121 174.910 174.910 174.507 0.403 25768 9690 1 11 . 1 1 121 121 PHE CA C 121 58.720 58.720 57.566 1.153 25768 9691 1 11 . 1 1 121 121 PHE CB C 121 40.470 40.470 41.864 -1.394 25768 9692 1 11 . 1 1 121 121 PHE H H 121 7.830 7.830 8.400 -0.570 25768 9693 1 11 . 1 1 122 122 PHE C C 122 175.070 175.070 175.385 -0.315 25768 9694 1 11 . 1 1 122 122 PHE CA C 122 57.890 57.890 58.452 -0.562 25768 9695 1 11 . 1 1 122 122 PHE CB C 122 39.870 39.870 39.901 -0.032 25768 9696 1 11 . 1 1 123 123 ASP N N 123 122.170 122.170 120.985 1.185 25768 9697 1 11 . 1 1 123 123 ASP C C 123 176.150 176.150 176.453 -0.303 25768 9698 1 11 . 1 1 123 123 ASP CA C 123 54.530 54.530 54.679 -0.149 25768 9699 1 11 . 1 1 123 123 ASP CB C 123 41.830 41.830 41.411 0.419 25768 9700 1 11 . 1 1 123 123 ASP H H 123 7.950 7.950 8.354 -0.404 25768 9701 1 11 . 1 1 124 124 GLU N N 124 122.690 122.690 124.029 -1.339 25768 9702 1 11 . 1 1 124 124 GLU C C 124 176.630 176.630 177.029 -0.399 25768 9703 1 11 . 1 1 124 124 GLU CA C 124 57.620 57.620 56.758 0.862 25768 9704 1 11 . 1 1 124 124 GLU CB C 124 30.450 30.450 30.026 0.424 25768 9705 1 11 . 1 1 124 124 GLU H H 124 8.340 8.340 8.710 -0.370 25768 9706 1 11 . 1 1 125 125 ASP N N 125 121.280 121.280 119.293 1.987 25768 9707 1 11 . 1 1 125 125 ASP C C 125 176.940 176.940 177.126 -0.186 25768 9708 1 11 . 1 1 125 125 ASP CA C 125 55.180 55.180 56.631 -1.451 25768 9709 1 11 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.909 0.311 25768 9710 1 11 . 1 1 125 125 ASP H H 125 8.310 8.310 8.527 -0.217 25768 9711 1 11 . 1 1 126 126 LEU N N 126 122.830 122.830 119.399 3.431 25768 9712 1 11 . 1 1 126 126 LEU C C 126 178.020 178.020 177.716 0.304 25768 9713 1 11 . 1 1 126 126 LEU CA C 126 56.450 56.450 56.998 -0.548 25768 9714 1 11 . 1 1 126 126 LEU CB C 126 42.150 42.150 42.039 0.111 25768 9715 1 11 . 1 1 126 126 LEU H H 126 8.010 8.010 7.638 0.372 25768 9716 1 11 . 1 1 127 127 ALA N N 127 122.660 122.660 119.407 3.253 25768 9717 1 11 . 1 1 127 127 ALA C C 127 178.600 178.600 177.331 1.269 25768 9718 1 11 . 1 1 127 127 ALA CA C 127 53.780 53.780 53.412 0.368 25768 9719 1 11 . 1 1 127 127 ALA CB C 127 19.000 19.000 19.146 -0.146 25768 9720 1 11 . 1 1 127 127 ALA H H 127 8.100 8.100 7.920 0.180 25768 9721 1 11 . 1 1 128 128 SER N N 128 113.740 113.740 110.098 3.642 25768 9722 1 11 . 1 1 128 128 SER C C 128 175.010 175.010 173.273 1.737 25768 9723 1 11 . 1 1 128 128 SER CA C 128 59.580 59.580 57.046 2.534 25768 9724 1 11 . 1 1 128 128 SER CB C 128 63.800 63.800 64.680 -0.880 25768 9725 1 11 . 1 1 128 128 SER H H 128 7.920 7.920 7.585 0.335 25768 9726 1 11 . 1 1 129 129 ASN N N 129 120.300 120.300 124.382 -4.082 25768 9727 1 11 . 1 1 129 129 ASN C C 129 175.590 175.590 175.683 -0.093 25768 9728 1 11 . 1 1 129 129 ASN CA C 129 54.180 54.180 54.220 -0.040 25768 9729 1 11 . 1 1 129 129 ASN CB C 129 38.900 38.900 39.854 -0.954 25768 9730 1 11 . 1 1 129 129 ASN H H 129 8.120 8.120 8.969 -0.849 25768 9731 1 11 . 1 1 130 130 ARG N N 130 120.630 120.630 118.561 2.069 25768 9732 1 11 . 1 1 130 130 ARG C C 130 176.720 176.720 175.715 1.005 25768 9733 1 11 . 1 1 130 130 ARG CA C 130 57.240 57.240 56.714 0.526 25768 9734 1 11 . 1 1 130 130 ARG CB C 130 30.500 30.500 30.398 0.102 25768 9735 1 11 . 1 1 130 130 ARG H H 130 8.050 8.050 8.340 -0.290 25768 9736 1 11 . 1 1 131 131 LYS N N 131 121.150 121.150 122.321 -1.171 25768 9737 1 11 . 1 1 131 131 LYS C C 131 176.750 176.750 175.607 1.143 25768 9738 1 11 . 1 1 131 131 LYS CA C 131 57.050 57.050 55.386 1.664 25768 9739 1 11 . 1 1 131 131 LYS CB C 131 32.870 32.870 32.249 0.620 25768 9740 1 11 . 1 1 131 131 LYS H H 131 8.020 8.020 8.266 -0.246 25768 9741 1 11 . 1 1 132 132 ALA N N 132 124.110 124.110 120.284 3.826 25768 9742 1 11 . 1 1 132 132 ALA C C 132 177.680 177.680 176.553 1.127 25768 9743 1 11 . 1 1 132 132 ALA CA C 132 53.070 53.070 54.020 -0.951 25768 9744 1 11 . 1 1 132 132 ALA CB C 132 19.250 19.250 17.914 1.336 25768 9745 1 11 . 1 1 132 132 ALA H H 132 8.010 8.010 8.480 -0.470 25768 9746 1 11 . 1 1 133 133 GLN N N 133 118.830 118.830 119.096 -0.266 25768 9747 1 11 . 1 1 133 133 GLN C C 133 176.380 176.380 176.371 0.009 25768 9748 1 11 . 1 1 133 133 GLN CA C 133 56.400 56.400 54.625 1.775 25768 9749 1 11 . 1 1 133 133 GLN CB C 133 29.670 29.670 32.054 -2.384 25768 9750 1 11 . 1 1 133 133 GLN H H 133 8.070 8.070 8.211 -0.141 25768 9751 1 11 . 1 1 134 134 GLY N N 134 109.400 109.400 108.426 0.974 25768 9752 1 11 . 1 1 134 134 GLY C C 134 174.060 174.060 174.505 -0.445 25768 9753 1 11 . 1 1 134 134 GLY CA C 134 45.690 45.690 44.789 0.901 25768 9754 1 11 . 1 1 134 134 GLY H H 134 8.150 8.150 8.506 -0.356 25768 9755 1 11 . 1 1 135 135 PHE N N 135 120.480 120.480 120.855 -0.375 25768 9756 1 11 . 1 1 135 135 PHE C C 135 176.000 176.000 174.297 1.703 25768 9757 1 11 . 1 1 135 135 PHE CA C 135 58.370 58.370 58.124 0.245 25768 9758 1 11 . 1 1 135 135 PHE CB C 135 39.710 39.710 38.570 1.140 25768 9759 1 11 . 1 1 135 135 PHE H H 135 8.060 8.060 8.390 -0.330 25768 9760 1 11 . 1 1 136 136 SER N N 136 116.740 116.740 115.659 1.081 25768 9761 1 11 . 1 1 136 136 SER C C 136 174.620 174.620 174.442 0.178 25768 9762 1 11 . 1 1 136 136 SER CA C 136 58.870 58.870 58.228 0.642 25768 9763 1 11 . 1 1 136 136 SER CB C 136 64.200 64.200 64.175 0.025 25768 9764 1 11 . 1 1 136 136 SER H H 136 8.160 8.160 7.940 0.220 25768 9765 1 11 . 1 1 137 137 SER N N 137 117.650 117.650 120.869 -3.219 25768 9766 1 11 . 1 1 137 137 SER C C 137 174.410 174.410 173.634 0.776 25768 9767 1 11 . 1 1 137 137 SER CA C 137 58.880 58.880 58.033 0.847 25768 9768 1 11 . 1 1 137 137 SER CB C 137 64.140 64.140 63.844 0.296 25768 9769 1 11 . 1 1 137 137 SER H H 137 8.140 8.140 8.713 -0.573 25768 9770 1 11 . 1 1 138 138 MET N N 138 121.980 121.980 123.285 -1.305 25768 9771 1 11 . 1 1 138 138 MET C C 138 175.680 175.680 174.235 1.445 25768 9772 1 11 . 1 1 138 138 MET CA C 138 56.180 56.180 56.001 0.179 25768 9773 1 11 . 1 1 138 138 MET CB C 138 33.240 33.240 32.698 0.542 25768 9774 1 11 . 1 1 138 138 MET H H 138 8.110 8.110 8.434 -0.324 25768 9775 1 11 . 1 1 139 139 LYS N N 139 122.110 122.110 120.106 2.004 25768 9776 1 11 . 1 1 139 139 LYS C C 139 176.220 176.220 175.714 0.506 25768 9777 1 11 . 1 1 139 139 LYS CA C 139 56.370 56.370 56.212 0.158 25768 9778 1 11 . 1 1 139 139 LYS CB C 139 33.220 33.220 32.647 0.573 25768 9779 1 11 . 1 1 139 139 LYS H H 139 8.140 8.140 8.178 -0.038 25768 9780 1 11 . 1 1 140 140 LEU N N 140 123.860 123.860 121.189 2.671 25768 9781 1 11 . 1 1 140 140 LEU C C 140 177.100 177.100 176.850 0.250 25768 9782 1 11 . 1 1 140 140 LEU CA C 140 55.710 55.710 54.656 1.054 25768 9783 1 11 . 1 1 140 140 LEU CB C 140 42.460 42.460 41.377 1.083 25768 9784 1 11 . 1 1 140 140 LEU H H 140 8.140 8.140 8.314 -0.174 25768 9785 1 11 . 1 1 141 141 GLN N N 141 120.350 120.350 122.319 -1.969 25768 9786 1 11 . 1 1 141 141 GLN C C 141 175.170 175.170 174.669 0.501 25768 9787 1 11 . 1 1 141 141 GLN CA C 141 56.200 56.200 56.607 -0.407 25768 9788 1 11 . 1 1 141 141 GLN CB C 141 29.950 29.950 28.011 1.939 25768 9789 1 11 . 1 1 141 141 GLN H H 141 8.210 8.210 8.664 -0.454 25768 9790 1 11 . 1 1 142 142 ASP N N 142 120.950 120.950 121.515 -0.565 25768 9791 1 11 . 1 1 142 142 ASP C C 142 175.840 175.840 177.099 -1.259 25768 9792 1 11 . 1 1 142 142 ASP CA C 142 54.700 54.700 54.419 0.281 25768 9793 1 11 . 1 1 142 142 ASP CB C 142 41.760 41.760 41.188 0.572 25768 9794 1 11 . 1 1 142 142 ASP H H 142 8.120 8.120 8.432 -0.312 25768 9795 1 11 . 1 1 143 143 SER N N 143 114.880 114.880 114.496 0.384 25768 9796 1 11 . 1 1 143 143 SER C C 143 173.290 173.290 173.365 -0.075 25768 9797 1 11 . 1 1 143 143 SER CA C 143 58.450 58.450 58.048 0.402 25768 9798 1 11 . 1 1 143 143 SER CB C 143 64.760 64.760 63.580 1.180 25768 9799 1 11 . 1 1 143 143 SER H H 143 7.960 7.960 8.084 -0.124 25768 9800 1 11 . 1 1 144 144 TRP N N 144 123.110 123.110 122.564 0.546 25768 9801 1 11 . 1 1 144 144 TRP C C 144 175.880 175.880 176.054 -0.174 25768 9802 1 11 . 1 1 144 144 TRP CA C 144 56.420 56.420 55.892 0.528 25768 9803 1 11 . 1 1 144 144 TRP CB C 144 31.160 31.160 30.569 0.591 25768 9804 1 11 . 1 1 144 144 TRP H H 144 8.080 8.080 7.959 0.121 25768 9805 1 11 . 1 1 145 145 GLY N N 145 110.410 110.410 111.903 -1.493 25768 9806 1 11 . 1 1 145 145 GLY C C 145 172.870 172.870 173.676 -0.806 25768 9807 1 11 . 1 1 145 145 GLY CA C 145 45.130 45.130 44.706 0.424 25768 9808 1 11 . 1 1 145 145 GLY H H 145 8.660 8.660 8.643 0.017 25768 9809 1 11 . 1 1 148 148 GLY C C 148 171.800 171.800 173.921 -2.121 25768 9810 1 11 . 1 1 148 148 GLY CA C 148 44.140 44.140 45.597 -1.457 25768 9811 1 11 . 1 1 149 149 GLU N N 149 123.070 123.070 119.089 3.981 25768 9812 1 11 . 1 1 149 149 GLU C C 149 174.210 174.210 174.527 -0.317 25768 9813 1 11 . 1 1 149 149 GLU CA C 149 55.120 55.120 56.348 -1.228 25768 9814 1 11 . 1 1 149 149 GLU CB C 149 37.410 37.410 33.945 3.465 25768 9815 1 11 . 1 1 149 149 GLU H H 149 8.550 8.550 7.981 0.569 25768 9816 1 11 . 1 1 150 150 LEU N N 150 126.130 126.130 125.639 0.491 25768 9817 1 11 . 1 1 150 150 LEU C C 150 174.410 174.410 175.577 -1.167 25768 9818 1 11 . 1 1 150 150 LEU CA C 150 54.260 54.260 53.326 0.934 25768 9819 1 11 . 1 1 150 150 LEU CB C 150 47.510 47.510 45.909 1.601 25768 9820 1 11 . 1 1 150 150 LEU H H 150 8.550 8.550 8.251 0.299 25768 9821 1 11 . 1 1 151 151 GLY N N 151 109.500 109.500 111.175 -1.675 25768 9822 1 11 . 1 1 151 151 GLY C C 151 170.610 170.610 172.733 -2.123 25768 9823 1 11 . 1 1 151 151 GLY CA C 151 45.980 45.980 43.530 2.450 25768 9824 1 11 . 1 1 151 151 GLY H H 151 8.090 8.090 8.307 -0.217 25768 9825 1 11 . 1 1 152 152 PHE N N 152 110.960 110.960 122.506 -11.546 25768 9826 1 11 . 1 1 152 152 PHE C C 152 171.510 171.510 174.385 -2.875 25768 9827 1 11 . 1 1 152 152 PHE CA C 152 58.170 58.170 55.826 2.344 25768 9828 1 11 . 1 1 152 152 PHE CB C 152 41.690 41.690 41.046 0.644 25768 9829 1 11 . 1 1 152 152 PHE H H 152 8.380 8.380 8.292 0.088 25768 9830 1 11 . 1 1 153 153 ASP N N 153 118.880 118.880 128.631 -9.751 25768 9831 1 11 . 1 1 153 153 ASP C C 153 176.520 176.520 175.174 1.346 25768 9832 1 11 . 1 1 153 153 ASP CA C 153 52.940 52.940 53.821 -0.881 25768 9833 1 11 . 1 1 153 153 ASP CB C 153 44.540 44.540 42.982 1.558 25768 9834 1 11 . 1 1 153 153 ASP H H 153 7.970 7.970 8.434 -0.464 25768 9835 1 11 . 1 1 154 154 TYR N N 154 123.630 123.630 125.123 -1.493 25768 9836 1 11 . 1 1 154 154 TYR C C 154 175.610 175.610 174.327 1.283 25768 9837 1 11 . 1 1 154 154 TYR CA C 154 57.310 57.310 57.526 -0.216 25768 9838 1 11 . 1 1 154 154 TYR CB C 154 42.040 42.040 42.575 -0.535 25768 9839 1 11 . 1 1 154 154 TYR H H 154 9.730 9.730 9.322 0.408 25768 9840 1 11 . 1 1 155 155 MET N N 155 126.190 126.190 124.317 1.873 25768 9841 1 11 . 1 1 155 155 MET C C 155 174.970 174.970 175.266 -0.296 25768 9842 1 11 . 1 1 155 155 MET CA C 155 54.720 54.720 56.081 -1.361 25768 9843 1 11 . 1 1 155 155 MET CB C 155 28.300 28.300 32.512 -4.212 25768 9844 1 11 . 1 1 155 155 MET H H 155 8.600 8.600 8.911 -0.311 25768 9845 1 11 . 1 1 156 156 LEU N N 156 125.290 125.290 124.539 0.751 25768 9846 1 11 . 1 1 156 156 LEU C C 156 177.680 177.680 177.918 -0.238 25768 9847 1 11 . 1 1 156 156 LEU CA C 156 56.040 56.040 55.080 0.961 25768 9848 1 11 . 1 1 156 156 LEU CB C 156 43.040 43.040 43.256 -0.216 25768 9849 1 11 . 1 1 156 156 LEU H H 156 9.190 9.190 8.640 0.550 25768 9850 1 11 . 1 1 157 157 ASN N N 157 114.690 114.690 117.074 -2.384 25768 9851 1 11 . 1 1 157 157 ASN C C 157 173.640 173.640 177.715 -4.075 25768 9852 1 11 . 1 1 157 157 ASN CA C 157 52.650 52.650 56.324 -3.674 25768 9853 1 11 . 1 1 157 157 ASN CB C 157 37.270 37.270 36.685 0.584 25768 9854 1 11 . 1 1 157 157 ASN H H 157 8.060 8.060 8.261 -0.201 25768 9855 1 11 . 1 1 158 158 GLU N N 158 114.530 114.530 120.546 -6.016 25768 9856 1 11 . 1 1 158 158 GLU C C 158 176.090 176.090 177.478 -1.388 25768 9857 1 11 . 1 1 158 158 GLU CA C 158 60.010 60.010 58.404 1.607 25768 9858 1 11 . 1 1 158 158 GLU CB C 158 29.730 29.730 29.926 -0.196 25768 9859 1 11 . 1 1 158 158 GLU H H 158 8.560 8.560 8.349 0.211 25768 9860 1 11 . 1 1 159 159 HIS N N 159 110.480 110.480 116.447 -5.967 25768 9861 1 11 . 1 1 159 159 HIS C C 159 173.130 173.130 173.927 -0.797 25768 9862 1 11 . 1 1 159 159 HIS CA C 159 56.770 56.770 54.056 2.714 25768 9863 1 11 . 1 1 159 159 HIS CB C 159 32.630 32.630 29.475 3.155 25768 9864 1 11 . 1 1 159 159 HIS H H 159 8.190 8.190 7.862 0.328 25768 9865 1 11 . 1 1 160 160 ALA N N 160 122.890 122.890 120.533 2.357 25768 9866 1 11 . 1 1 160 160 ALA C C 160 176.200 176.200 175.100 1.100 25768 9867 1 11 . 1 1 160 160 ALA CA C 160 51.730 51.730 53.646 -1.916 25768 9868 1 11 . 1 1 160 160 ALA CB C 160 21.560 21.560 18.784 2.776 25768 9869 1 11 . 1 1 160 160 ALA H H 160 8.400 8.400 7.823 0.577 25768 9870 1 11 . 1 1 161 161 LEU N N 161 116.540 116.540 118.448 -1.908 25768 9871 1 11 . 1 1 161 161 LEU C C 161 174.930 174.930 176.420 -1.490 25768 9872 1 11 . 1 1 161 161 LEU CA C 161 54.280 54.280 54.248 0.032 25768 9873 1 11 . 1 1 161 161 LEU CB C 161 45.640 45.640 44.260 1.380 25768 9874 1 11 . 1 1 161 161 LEU H H 161 8.590 8.590 8.411 0.179 25768 9875 1 11 . 1 1 162 162 PHE N N 162 121.780 121.780 124.960 -3.180 25768 9876 1 11 . 1 1 162 162 PHE C C 162 171.960 171.960 174.664 -2.704 25768 9877 1 11 . 1 1 162 162 PHE CA C 162 56.420 56.420 57.556 -1.136 25768 9878 1 11 . 1 1 162 162 PHE CB C 162 43.340 43.340 42.084 1.256 25768 9879 1 11 . 1 1 162 162 PHE H H 162 9.180 9.180 9.181 -0.001 25768 9880 1 11 . 1 1 163 163 ASN N N 163 127.850 127.850 122.979 4.871 25768 9881 1 11 . 1 1 163 163 ASN C C 163 171.320 171.320 174.043 -2.723 25768 9882 1 11 . 1 1 163 163 ASN CA C 163 52.340 52.340 52.205 0.135 25768 9883 1 11 . 1 1 163 163 ASN CB C 163 46.410 46.410 41.688 4.722 25768 9884 1 11 . 1 1 163 163 ASN H H 163 7.700 7.700 9.076 -1.376 25768 9885 1 11 . 1 1 164 164 MET N N 164 119.950 119.950 122.540 -2.590 25768 9886 1 11 . 1 1 164 164 MET C C 164 172.830 172.830 174.631 -1.801 25768 9887 1 11 . 1 1 164 164 MET CA C 164 55.180 55.180 54.363 0.817 25768 9888 1 11 . 1 1 164 164 MET CB C 164 37.770 37.770 37.324 0.446 25768 9889 1 11 . 1 1 164 164 MET H H 164 7.070 7.070 8.298 -1.228 25768 9890 1 11 . 1 1 165 165 ALA N N 165 120.600 120.600 122.775 -2.175 25768 9891 1 11 . 1 1 165 165 ALA C C 165 174.240 174.240 175.298 -1.058 25768 9892 1 11 . 1 1 165 165 ALA CA C 165 51.630 51.630 51.655 -0.025 25768 9893 1 11 . 1 1 165 165 ALA CB C 165 22.330 22.330 20.729 1.601 25768 9894 1 11 . 1 1 165 165 ALA H H 165 8.290 8.290 8.688 -0.398 25768 9895 1 11 . 1 1 166 166 VAL N N 166 117.900 117.900 117.149 0.751 25768 9896 1 11 . 1 1 166 166 VAL C C 166 172.950 172.950 174.832 -1.882 25768 9897 1 11 . 1 1 166 166 VAL CA C 166 59.710 59.710 60.204 -0.494 25768 9898 1 11 . 1 1 166 166 VAL CB C 166 35.290 35.290 35.477 -0.187 25768 9899 1 11 . 1 1 166 166 VAL H H 166 8.720 8.720 8.402 0.318 25768 9900 1 11 . 1 1 171 171 ILE C C 171 175.750 175.750 175.221 0.529 25768 9901 1 11 . 1 1 171 171 ILE CA C 171 61.720 61.720 60.677 1.043 25768 9902 1 11 . 1 1 171 171 ILE CB C 171 39.300 39.300 37.811 1.489 25768 9903 1 11 . 1 1 172 172 ASP N N 172 124.070 124.070 121.640 2.430 25768 9904 1 11 . 1 1 172 172 ASP C C 172 176.590 176.590 176.431 0.159 25768 9905 1 11 . 1 1 172 172 ASP CA C 172 54.460 54.460 54.289 0.171 25768 9906 1 11 . 1 1 172 172 ASP CB C 172 41.410 41.410 41.726 -0.316 25768 9907 1 11 . 1 1 172 172 ASP H H 172 8.460 8.460 7.798 0.662 25768 9908 1 11 . 1 1 173 173 THR N N 173 115.570 115.570 116.275 -0.705 25768 9909 1 11 . 1 1 173 173 THR C C 173 175.030 175.030 174.295 0.735 25768 9910 1 11 . 1 1 173 173 THR CA C 173 62.680 62.680 63.036 -0.356 25768 9911 1 11 . 1 1 173 173 THR CB C 173 69.840 69.840 69.611 0.230 25768 9912 1 11 . 1 1 173 173 THR H H 173 8.080 8.080 8.334 -0.254 25768 9913 1 11 . 1 1 174 174 LYS N N 174 122.680 122.680 123.937 -1.257 25768 9914 1 11 . 1 1 174 174 LYS C C 174 176.340 176.340 175.010 1.330 25768 9915 1 11 . 1 1 174 174 LYS CA C 174 56.820 56.820 55.823 0.997 25768 9916 1 11 . 1 1 174 174 LYS CB C 174 32.790 32.790 32.016 0.774 25768 9917 1 11 . 1 1 174 174 LYS H H 174 8.180 8.180 8.662 -0.482 25768 9918 1 11 . 1 1 175 175 ALA N N 175 124.050 124.050 124.484 -0.434 25768 9919 1 11 . 1 1 175 175 ALA C C 175 177.550 177.550 176.807 0.743 25768 9920 1 11 . 1 1 175 175 ALA CA C 175 52.840 52.840 52.519 0.321 25768 9921 1 11 . 1 1 175 175 ALA CB C 175 19.580 19.580 19.901 -0.321 25768 9922 1 11 . 1 1 175 175 ALA H H 175 8.050 8.050 8.222 -0.172 25768 9923 1 11 . 1 1 176 176 SER N N 176 114.920 114.920 116.486 -1.566 25768 9924 1 11 . 1 1 176 176 SER C C 176 174.240 174.240 173.289 0.951 25768 9925 1 11 . 1 1 176 176 SER CA C 176 58.390 58.390 58.440 -0.050 25768 9926 1 11 . 1 1 176 176 SER CB C 176 64.370 64.370 61.824 2.546 25768 9927 1 11 . 1 1 176 176 SER H H 176 8.070 8.070 8.338 -0.268 25768 9928 1 11 . 1 1 177 177 ILE N N 177 121.650 121.650 122.596 -0.946 25768 9929 1 11 . 1 1 177 177 ILE C C 177 174.990 174.990 175.279 -0.289 25768 9930 1 11 . 1 1 177 177 ILE CA C 177 61.570 61.570 61.288 0.282 25768 9931 1 11 . 1 1 177 177 ILE CB C 177 39.100 39.100 39.844 -0.744 25768 9932 1 11 . 1 1 177 177 ILE H H 177 7.960 7.960 7.865 0.095 25768 9933 1 11 . 1 1 178 178 ASN N N 178 127.040 127.040 125.553 1.487 25768 9934 1 11 . 1 1 178 178 ASN C C 178 179.160 179.160 175.164 3.996 25768 9935 1 11 . 1 1 178 178 ASN CA C 178 55.100 55.100 54.000 1.100 25768 9936 1 11 . 1 1 178 178 ASN CB C 178 41.300 41.300 39.034 2.266 25768 9937 1 11 . 1 1 178 178 ASN H H 178 7.850 7.850 8.584 -0.734 25768 9938 1 11 . 1 1 180 180 PRO C C 180 177.520 177.520 176.288 1.232 25768 9939 1 11 . 1 1 180 180 PRO CA C 180 63.980 63.980 63.212 0.768 25768 9940 1 11 . 1 1 180 180 PRO CB C 180 32.190 32.190 30.546 1.644 25768 9941 1 11 . 1 1 181 181 SER N N 181 115.600 115.600 119.166 -3.566 25768 9942 1 11 . 1 1 181 181 SER C C 181 174.710 174.710 174.972 -0.262 25768 9943 1 11 . 1 1 181 181 SER CA C 181 58.900 58.900 58.421 0.479 25768 9944 1 11 . 1 1 181 181 SER CB C 181 64.070 64.070 63.644 0.426 25768 9945 1 11 . 1 1 181 181 SER H H 181 8.260 8.260 8.762 -0.502 25768 9946 1 11 . 1 1 182 182 ALA N N 182 125.880 125.880 124.822 1.058 25768 9947 1 11 . 1 1 182 182 ALA C C 182 177.560 177.560 176.625 0.935 25768 9948 1 11 . 1 1 182 182 ALA CA C 182 53.090 53.090 51.698 1.392 25768 9949 1 11 . 1 1 182 182 ALA CB C 182 19.310 19.310 19.480 -0.170 25768 9950 1 11 . 1 1 182 182 ALA H H 182 8.130 8.130 8.156 -0.026 25768 9951 1 11 . 1 1 183 183 LEU N N 183 119.980 119.980 120.578 -0.598 25768 9952 1 11 . 1 1 183 183 LEU C C 183 177.850 177.850 176.957 0.893 25768 9953 1 11 . 1 1 183 183 LEU CA C 183 55.650 55.650 55.253 0.397 25768 9954 1 11 . 1 1 183 183 LEU CB C 183 42.530 42.530 42.505 0.025 25768 9955 1 11 . 1 1 183 183 LEU H H 183 7.940 7.940 8.260 -0.320 25768 9956 1 11 . 1 1 184 184 GLY N N 184 109.250 109.250 112.332 -3.082 25768 9957 1 11 . 1 1 184 184 GLY C C 184 174.250 174.250 173.836 0.414 25768 9958 1 11 . 1 1 184 184 GLY CA C 184 45.830 45.830 45.075 0.756 25768 9959 1 11 . 1 1 184 184 GLY H H 184 8.150 8.150 8.759 -0.609 25768 9960 1 11 . 1 1 185 185 VAL N N 185 118.830 118.830 121.570 -2.740 25768 9961 1 11 . 1 1 185 185 VAL C C 185 175.890 175.890 174.528 1.362 25768 9962 1 11 . 1 1 185 185 VAL CA C 185 62.740 62.740 62.432 0.308 25768 9963 1 11 . 1 1 185 185 VAL CB C 185 32.770 32.770 31.379 1.391 25768 9964 1 11 . 1 1 185 185 VAL H H 185 7.760 7.760 8.227 -0.467 25768 9965 1 11 . 1 1 186 186 ASN N N 186 121.850 121.850 123.208 -1.358 25768 9966 1 11 . 1 1 186 186 ASN C C 186 174.970 174.970 175.067 -0.097 25768 9967 1 11 . 1 1 186 186 ASN CA C 186 53.590 53.590 52.729 0.861 25768 9968 1 11 . 1 1 186 186 ASN CB C 186 39.160 39.160 39.127 0.033 25768 9969 1 11 . 1 1 186 186 ASN H H 186 8.380 8.380 8.309 0.071 25768 9970 1 11 . 1 1 187 187 LYS N N 187 122.120 122.120 122.209 -0.089 25768 9971 1 11 . 1 1 187 187 LYS C C 187 176.490 176.490 176.080 0.410 25768 9972 1 11 . 1 1 187 187 LYS CA C 187 56.750 56.750 56.746 0.004 25768 9973 1 11 . 1 1 187 187 LYS CB C 187 33.250 33.250 33.033 0.217 25768 9974 1 11 . 1 1 187 187 LYS H H 187 8.140 8.140 8.336 -0.196 25768 9975 1 11 . 1 1 188 188 THR N N 188 115.250 115.250 110.523 4.727 25768 9976 1 11 . 1 1 188 188 THR C C 188 174.250 174.250 174.888 -0.638 25768 9977 1 11 . 1 1 188 188 THR CA C 188 62.360 62.360 62.107 0.253 25768 9978 1 11 . 1 1 188 188 THR CB C 188 70.280 70.280 69.371 0.909 25768 9979 1 11 . 1 1 188 188 THR H H 188 8.100 8.100 8.140 -0.040 25768 9980 1 11 . 1 1 189 189 LYS N N 189 123.780 123.780 123.137 0.643 25768 9981 1 11 . 1 1 189 189 LYS C C 189 176.090 176.090 176.588 -0.498 25768 9982 1 11 . 1 1 189 189 LYS CA C 189 56.590 56.590 56.829 -0.239 25768 9983 1 11 . 1 1 189 189 LYS CB C 189 33.350 33.350 33.031 0.319 25768 9984 1 11 . 1 1 189 189 LYS H H 189 8.110 8.110 8.251 -0.141 25768 9985 1 11 . 1 1 190 190 VAL N N 190 120.920 120.920 118.656 2.264 25768 9986 1 11 . 1 1 190 190 VAL C C 190 175.590 175.590 175.068 0.522 25768 9987 1 11 . 1 1 190 190 VAL CA C 190 62.400 62.400 62.985 -0.585 25768 9988 1 11 . 1 1 190 190 VAL CB C 190 32.990 32.990 31.433 1.557 25768 9989 1 11 . 1 1 190 190 VAL H H 190 8.040 8.040 8.579 -0.539 25768 9990 1 11 . 1 1 191 191 ASP N N 191 123.790 123.790 125.368 -1.578 25768 9991 1 11 . 1 1 191 191 ASP C C 191 175.750 175.750 177.149 -1.399 25768 9992 1 11 . 1 1 191 191 ASP CA C 191 54.650 54.650 55.429 -0.779 25768 9993 1 11 . 1 1 191 191 ASP CB C 191 41.450 41.450 41.294 0.156 25768 9994 1 11 . 1 1 191 191 ASP H H 191 8.240 8.240 8.424 -0.184 25768 9995 1 11 . 1 1 192 192 VAL N N 192 118.850 118.850 115.291 3.559 25768 9996 1 11 . 1 1 192 192 VAL C C 192 175.380 175.380 174.400 0.980 25768 9997 1 11 . 1 1 192 192 VAL CA C 192 62.110 62.110 62.839 -0.729 25768 9998 1 11 . 1 1 192 192 VAL CB C 192 33.290 33.290 32.499 0.791 25768 9999 1 11 . 1 1 192 192 VAL H H 192 7.860 7.860 7.680 0.180 25768 10000 1 11 . 1 1 193 193 ASP N N 193 124.190 124.190 121.157 3.033 25768 10001 1 11 . 1 1 193 193 ASP C C 193 175.630 175.630 176.075 -0.445 25768 10002 1 11 . 1 1 193 193 ASP CA C 193 54.540 54.540 53.733 0.807 25768 10003 1 11 . 1 1 193 193 ASP CB C 193 41.410 41.410 41.648 -0.238 25768 10004 1 11 . 1 1 193 193 ASP H H 193 8.310 8.310 8.317 -0.007 25768 10005 1 11 . 1 1 194 194 VAL N N 194 119.580 119.580 119.943 -0.363 25768 10006 1 11 . 1 1 194 194 VAL C C 194 174.950 174.950 176.487 -1.537 25768 10007 1 11 . 1 1 194 194 VAL CA C 194 61.770 61.770 63.940 -2.170 25768 10008 1 11 . 1 1 194 194 VAL CB C 194 33.680 33.680 32.632 1.048 25768 10009 1 11 . 1 1 194 194 VAL H H 194 7.890 7.890 8.056 -0.166 25768 10010 1 11 . 1 1 195 195 ASP N N 195 125.660 125.660 119.443 6.217 25768 10011 1 11 . 1 1 195 195 ASP C C 195 174.290 174.290 174.062 0.228 25768 10012 1 11 . 1 1 195 195 ASP CA C 195 51.940 51.940 52.228 -0.288 25768 10013 1 11 . 1 1 195 195 ASP CB C 195 40.950 40.950 41.208 -0.258 25768 10014 1 11 . 1 1 195 195 ASP H H 195 8.410 8.410 7.964 0.446 25768 10015 1 11 . 1 1 198 198 VAL C C 198 173.940 173.940 174.323 -0.383 25768 10016 1 11 . 1 1 198 198 VAL CA C 198 61.270 61.270 61.233 0.038 25768 10017 1 11 . 1 1 198 198 VAL CB C 198 35.910 35.910 32.288 3.622 25768 10018 1 11 . 1 1 199 199 TYR N N 199 123.780 123.780 125.881 -2.101 25768 10019 1 11 . 1 1 199 199 TYR C C 199 174.150 174.150 174.127 0.023 25768 10020 1 11 . 1 1 199 199 TYR CA C 199 56.220 56.220 57.582 -1.362 25768 10021 1 11 . 1 1 199 199 TYR CB C 199 41.660 41.660 43.030 -1.370 25768 10022 1 11 . 1 1 199 199 TYR H H 199 8.540 8.540 8.374 0.166 25768 10023 1 11 . 1 1 200 200 MET N N 200 123.920 123.920 124.471 -0.551 25768 10024 1 11 . 1 1 200 200 MET C C 200 173.810 173.810 173.949 -0.139 25768 10025 1 11 . 1 1 200 200 MET CA C 200 54.710 54.710 54.799 -0.089 25768 10026 1 11 . 1 1 200 200 MET CB C 200 37.110 37.110 36.349 0.761 25768 10027 1 11 . 1 1 200 200 MET H H 200 9.130 9.130 8.486 0.644 25768 10028 1 11 . 1 1 201 201 ILE N N 201 123.670 123.670 124.104 -0.434 25768 10029 1 11 . 1 1 201 201 ILE C C 201 174.030 174.030 173.394 0.636 25768 10030 1 11 . 1 1 201 201 ILE CA C 201 59.820 59.820 59.069 0.751 25768 10031 1 11 . 1 1 201 201 ILE CB C 201 41.720 41.720 42.434 -0.714 25768 10032 1 11 . 1 1 201 201 ILE H H 201 8.030 8.030 8.609 -0.579 25768 10033 1 11 . 1 1 202 202 GLY N N 202 112.910 112.910 112.741 0.169 25768 10034 1 11 . 1 1 202 202 GLY C C 202 170.280 170.280 171.623 -1.343 25768 10035 1 11 . 1 1 202 202 GLY CA C 202 46.800 46.800 45.216 1.584 25768 10036 1 11 . 1 1 202 202 GLY H H 202 8.580 8.580 8.201 0.379 25768 10037 1 11 . 1 1 203 203 PHE N N 203 116.240 116.240 115.914 0.326 25768 10038 1 11 . 1 1 203 203 PHE C C 203 173.940 173.940 173.848 0.092 25768 10039 1 11 . 1 1 203 203 PHE CA C 203 55.890 55.890 54.210 1.680 25768 10040 1 11 . 1 1 203 203 PHE CB C 203 45.060 45.060 42.158 2.902 25768 10041 1 11 . 1 1 203 203 PHE H H 203 8.620 8.620 9.151 -0.531 25768 10042 1 11 . 1 1 204 204 GLY N N 204 105.610 105.610 107.443 -1.833 25768 10043 1 11 . 1 1 204 204 GLY C C 204 171.190 171.190 171.479 -0.289 25768 10044 1 11 . 1 1 204 204 GLY CA C 204 46.720 46.720 45.194 1.526 25768 10045 1 11 . 1 1 204 204 GLY H H 204 8.960 8.960 9.140 -0.180 25768 10046 1 11 . 1 1 205 205 TYR N N 205 121.160 121.160 114.161 6.999 25768 10047 1 11 . 1 1 205 205 TYR C C 205 173.030 173.030 173.572 -0.542 25768 10048 1 11 . 1 1 205 205 TYR CA C 205 57.190 57.190 56.435 0.755 25768 10049 1 11 . 1 1 205 205 TYR CB C 205 44.400 44.400 41.068 3.332 25768 10050 1 11 . 1 1 205 205 TYR H H 205 9.380 9.380 7.891 1.489 25768 10051 1 11 . 1 1 206 206 LYS N N 206 126.970 126.970 123.492 3.478 25768 10052 1 11 . 1 1 206 206 LYS C C 206 174.210 174.210 176.034 -1.824 25768 10053 1 11 . 1 1 206 206 LYS CA C 206 54.770 54.770 55.390 -0.620 25768 10054 1 11 . 1 1 206 206 LYS CB C 206 34.440 34.440 33.397 1.043 25768 10055 1 11 . 1 1 206 206 LYS H H 206 8.380 8.380 8.449 -0.069 25768 10056 1 11 . 1 1 207 207 PHE N N 207 126.330 126.330 125.234 1.096 25768 10057 1 11 . 1 1 207 207 PHE C C 207 175.020 175.020 174.688 0.332 25768 10058 1 11 . 1 1 207 207 PHE CA C 207 58.170 58.170 59.018 -0.848 25768 10059 1 11 . 1 1 207 207 PHE CB C 207 40.920 40.920 39.365 1.555 25768 10060 1 11 . 1 1 207 207 PHE H H 207 9.290 9.290 8.242 1.048 25768 10061 1 11 . 1 1 208 208 LEU N N 208 122.740 122.740 127.666 -4.926 25768 10062 1 11 . 1 1 208 208 LEU C C 208 176.510 176.510 176.521 -0.011 25768 10063 1 11 . 1 1 208 208 LEU CA C 208 54.910 54.910 53.837 1.073 25768 10064 1 11 . 1 1 208 208 LEU CB C 208 43.830 43.830 44.661 -0.831 25768 10065 1 11 . 1 1 208 208 LEU H H 208 8.310 8.310 8.027 0.283 25768 10066 1 12 . 1 1 2 2 HIS C C 2 175.310 175.310 174.547 0.763 25768 10067 1 12 . 1 1 3 3 LYS N N 3 122.080 122.080 120.630 1.450 25768 10068 1 12 . 1 1 3 3 LYS C C 3 173.490 173.490 174.868 -1.378 25768 10069 1 12 . 1 1 3 3 LYS CA C 3 55.050 55.050 55.448 -0.398 25768 10070 1 12 . 1 1 3 3 LYS CB C 3 35.380 35.380 35.871 -0.491 25768 10071 1 12 . 1 1 3 3 LYS H H 3 8.620 8.620 8.457 0.163 25768 10072 1 12 . 1 1 4 4 ALA N N 4 120.860 120.860 122.642 -1.782 25768 10073 1 12 . 1 1 4 4 ALA C C 4 178.190 178.190 178.247 -0.057 25768 10074 1 12 . 1 1 4 4 ALA CA C 4 53.480 53.480 53.137 0.343 25768 10075 1 12 . 1 1 4 4 ALA CB C 4 18.140 18.140 18.713 -0.573 25768 10076 1 12 . 1 1 4 4 ALA H H 4 8.580 8.580 8.352 0.228 25768 10077 1 12 . 1 1 5 5 GLY N N 5 112.890 112.890 111.262 1.628 25768 10078 1 12 . 1 1 5 5 GLY C C 5 173.830 173.830 173.423 0.407 25768 10079 1 12 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.585 0.295 25768 10080 1 12 . 1 1 5 5 GLY H H 5 9.210 9.210 8.291 0.919 25768 10081 1 12 . 1 1 6 6 ASP N N 6 121.590 121.590 120.721 0.869 25768 10082 1 12 . 1 1 6 6 ASP C C 6 174.380 174.380 174.346 0.034 25768 10083 1 12 . 1 1 6 6 ASP CA C 6 55.790 55.790 53.453 2.337 25768 10084 1 12 . 1 1 6 6 ASP CB C 6 41.760 41.760 42.768 -1.008 25768 10085 1 12 . 1 1 6 6 ASP H H 6 7.620 7.620 7.508 0.112 25768 10086 1 12 . 1 1 7 7 PHE N N 7 120.860 120.860 125.659 -4.799 25768 10087 1 12 . 1 1 7 7 PHE C C 7 174.050 174.050 173.873 0.177 25768 10088 1 12 . 1 1 7 7 PHE CA C 7 56.110 56.110 56.455 -0.345 25768 10089 1 12 . 1 1 7 7 PHE CB C 7 42.550 42.550 41.311 1.239 25768 10090 1 12 . 1 1 7 7 PHE H H 7 8.250 8.250 8.550 -0.300 25768 10091 1 12 . 1 1 8 8 ILE N N 8 127.950 127.950 121.125 6.825 25768 10092 1 12 . 1 1 8 8 ILE C C 8 174.000 174.000 173.447 0.553 25768 10093 1 12 . 1 1 8 8 ILE CA C 8 61.160 61.160 59.472 1.688 25768 10094 1 12 . 1 1 8 8 ILE CB C 8 42.660 42.660 42.001 0.659 25768 10095 1 12 . 1 1 8 8 ILE H H 8 9.230 9.230 7.929 1.301 25768 10096 1 12 . 1 1 9 9 ILE N N 9 125.380 125.380 121.391 3.989 25768 10097 1 12 . 1 1 9 9 ILE C C 9 173.630 173.630 175.126 -1.496 25768 10098 1 12 . 1 1 9 9 ILE CA C 9 59.600 59.600 59.927 -0.327 25768 10099 1 12 . 1 1 9 9 ILE CB C 9 41.180 41.180 40.464 0.716 25768 10100 1 12 . 1 1 9 9 ILE H H 9 8.580 8.580 8.858 -0.278 25768 10101 1 12 . 1 1 10 10 ARG N N 10 124.950 124.950 122.193 2.757 25768 10102 1 12 . 1 1 10 10 ARG C C 10 175.030 175.030 173.655 1.375 25768 10103 1 12 . 1 1 10 10 ARG CA C 10 53.920 53.920 55.299 -1.379 25768 10104 1 12 . 1 1 10 10 ARG CB C 10 31.880 31.880 34.698 -2.818 25768 10105 1 12 . 1 1 10 10 ARG H H 10 9.230 9.230 8.515 0.715 25768 10106 1 12 . 1 1 11 11 GLY N N 11 105.650 105.650 110.059 -4.409 25768 10107 1 12 . 1 1 11 11 GLY C C 11 172.090 172.090 172.093 -0.003 25768 10108 1 12 . 1 1 11 11 GLY CA C 11 44.460 44.460 43.978 0.482 25768 10109 1 12 . 1 1 11 11 GLY H H 11 8.780 8.780 8.752 0.028 25768 10110 1 12 . 1 1 12 12 GLY N N 12 107.800 107.800 107.685 0.115 25768 10111 1 12 . 1 1 12 12 GLY C C 12 171.460 171.460 171.976 -0.516 25768 10112 1 12 . 1 1 12 12 GLY CA C 12 46.630 46.630 43.157 3.473 25768 10113 1 12 . 1 1 12 12 GLY H H 12 8.510 8.510 7.400 1.110 25768 10114 1 12 . 1 1 13 13 PHE N N 13 119.900 119.900 120.568 -0.668 25768 10115 1 12 . 1 1 13 13 PHE C C 13 174.190 174.190 173.611 0.579 25768 10116 1 12 . 1 1 13 13 PHE CA C 13 56.340 56.340 57.351 -1.011 25768 10117 1 12 . 1 1 13 13 PHE CB C 13 41.090 41.090 41.706 -0.616 25768 10118 1 12 . 1 1 13 13 PHE H H 13 8.610 8.610 7.957 0.653 25768 10119 1 12 . 1 1 14 14 ALA N N 14 128.030 128.030 130.657 -2.627 25768 10120 1 12 . 1 1 14 14 ALA C C 14 176.560 176.560 176.893 -0.333 25768 10121 1 12 . 1 1 14 14 ALA CA C 14 49.940 49.940 50.871 -0.931 25768 10122 1 12 . 1 1 14 14 ALA CB C 14 20.360 20.360 20.230 0.130 25768 10123 1 12 . 1 1 14 14 ALA H H 14 9.220 9.220 8.470 0.750 25768 10124 1 12 . 1 1 15 15 THR N N 15 118.620 118.620 116.325 2.295 25768 10125 1 12 . 1 1 15 15 THR CA C 15 61.440 61.440 61.728 -0.288 25768 10126 1 12 . 1 1 15 15 THR CB C 15 71.370 71.370 69.734 1.636 25768 10127 1 12 . 1 1 15 15 THR H H 15 9.220 9.220 8.326 0.894 25768 10128 1 12 . 1 1 18 18 PRO C C 18 176.690 176.690 176.074 0.616 25768 10129 1 12 . 1 1 18 18 PRO CA C 18 63.610 63.610 62.971 0.639 25768 10130 1 12 . 1 1 18 18 PRO CB C 18 32.440 32.440 32.414 0.026 25768 10131 1 12 . 1 1 19 19 ASP N N 19 120.320 120.320 123.140 -2.820 25768 10132 1 12 . 1 1 19 19 ASP C C 19 175.950 175.950 175.965 -0.015 25768 10133 1 12 . 1 1 19 19 ASP CA C 19 54.710 54.710 53.524 1.186 25768 10134 1 12 . 1 1 19 19 ASP CB C 19 41.450 41.450 41.548 -0.098 25768 10135 1 12 . 1 1 19 19 ASP H H 19 8.330 8.330 8.524 -0.194 25768 10136 1 12 . 1 1 20 20 ASP N N 20 121.990 121.990 118.843 3.147 25768 10137 1 12 . 1 1 20 20 ASP C C 20 176.760 176.760 177.142 -0.382 25768 10138 1 12 . 1 1 20 20 ASP CA C 20 54.470 54.470 55.869 -1.399 25768 10139 1 12 . 1 1 20 20 ASP CB C 20 41.310 41.310 40.565 0.745 25768 10140 1 12 . 1 1 20 20 ASP H H 20 8.240 8.240 8.369 -0.129 25768 10141 1 12 . 1 1 21 21 SER N N 21 117.050 117.050 113.579 3.471 25768 10142 1 12 . 1 1 21 21 SER C C 21 175.170 175.170 173.772 1.398 25768 10143 1 12 . 1 1 21 21 SER CA C 21 59.490 59.490 58.589 0.902 25768 10144 1 12 . 1 1 21 21 SER CB C 21 64.080 64.080 61.926 2.154 25768 10145 1 12 . 1 1 21 21 SER H H 21 8.360 8.360 8.509 -0.149 25768 10146 1 12 . 1 1 22 22 SER N N 22 117.820 117.820 117.766 0.054 25768 10147 1 12 . 1 1 22 22 SER C C 22 174.940 174.940 173.889 1.051 25768 10148 1 12 . 1 1 22 22 SER CA C 22 59.160 59.160 58.047 1.113 25768 10149 1 12 . 1 1 22 22 SER CB C 22 64.110 64.110 64.947 -0.837 25768 10150 1 12 . 1 1 22 22 SER H H 22 8.310 8.310 7.467 0.843 25768 10151 1 12 . 1 1 23 23 SER N N 23 117.660 117.660 116.055 1.605 25768 10152 1 12 . 1 1 23 23 SER C C 23 174.340 174.340 172.996 1.344 25768 10153 1 12 . 1 1 23 23 SER CA C 23 59.050 59.050 59.430 -0.380 25768 10154 1 12 . 1 1 23 23 SER CB C 23 64.210 64.210 63.298 0.912 25768 10155 1 12 . 1 1 23 23 SER H H 23 8.120 8.120 8.214 -0.094 25768 10156 1 12 . 1 1 24 24 ASP N N 24 122.590 122.590 121.342 1.248 25768 10157 1 12 . 1 1 24 24 ASP C C 24 176.250 176.250 175.392 0.858 25768 10158 1 12 . 1 1 24 24 ASP CA C 24 54.910 54.910 54.922 -0.012 25768 10159 1 12 . 1 1 24 24 ASP CB C 24 41.270 41.270 41.465 -0.195 25768 10160 1 12 . 1 1 24 24 ASP H H 24 8.230 8.230 8.394 -0.164 25768 10161 1 12 . 1 1 25 25 ILE N N 25 120.650 120.650 121.041 -0.391 25768 10162 1 12 . 1 1 25 25 ILE C C 25 176.190 176.190 175.852 0.338 25768 10163 1 12 . 1 1 25 25 ILE CA C 25 61.880 61.880 60.549 1.331 25768 10164 1 12 . 1 1 25 25 ILE CB C 25 38.730 38.730 37.736 0.994 25768 10165 1 12 . 1 1 25 25 ILE H H 25 7.860 7.860 7.895 -0.035 25768 10166 1 12 . 1 1 26 26 LYS N N 26 124.420 124.420 127.999 -3.579 25768 10167 1 12 . 1 1 26 26 LYS C C 26 176.640 176.640 175.963 0.677 25768 10168 1 12 . 1 1 26 26 LYS CA C 26 56.520 56.520 56.061 0.459 25768 10169 1 12 . 1 1 26 26 LYS CB C 26 32.890 32.890 32.867 0.023 25768 10170 1 12 . 1 1 26 26 LYS H H 26 8.140 8.140 8.339 -0.199 25768 10171 1 12 . 1 1 27 27 LEU N N 27 123.120 123.120 116.520 6.600 25768 10172 1 12 . 1 1 27 27 LEU C C 27 177.110 177.110 176.761 0.349 25768 10173 1 12 . 1 1 27 27 LEU CA C 27 55.590 55.590 54.576 1.014 25768 10174 1 12 . 1 1 27 27 LEU CB C 27 42.500 42.500 42.939 -0.439 25768 10175 1 12 . 1 1 27 27 LEU H H 27 8.080 8.080 8.033 0.047 25768 10176 1 12 . 1 1 28 28 ASP N N 28 120.850 120.850 121.195 -0.345 25768 10177 1 12 . 1 1 28 28 ASP C C 28 176.960 176.960 176.022 0.938 25768 10178 1 12 . 1 1 28 28 ASP CA C 28 54.800 54.800 54.087 0.713 25768 10179 1 12 . 1 1 28 28 ASP CB C 28 41.380 41.380 41.665 -0.285 25768 10180 1 12 . 1 1 28 28 ASP H H 28 8.180 8.180 8.560 -0.380 25768 10181 1 12 . 1 1 29 29 GLY N N 29 109.800 109.800 109.724 0.076 25768 10182 1 12 . 1 1 29 29 GLY C C 29 174.370 174.370 173.223 1.147 25768 10183 1 12 . 1 1 29 29 GLY CA C 29 46.150 46.150 44.981 1.169 25768 10184 1 12 . 1 1 29 29 GLY H H 29 8.230 8.230 7.876 0.354 25768 10185 1 12 . 1 1 30 30 ALA N N 30 123.880 123.880 121.787 2.093 25768 10186 1 12 . 1 1 30 30 ALA C C 30 178.040 178.040 177.576 0.464 25768 10187 1 12 . 1 1 30 30 ALA CA C 30 53.140 53.140 52.303 0.837 25768 10188 1 12 . 1 1 30 30 ALA CB C 30 19.350 19.350 20.202 -0.852 25768 10189 1 12 . 1 1 30 30 ALA H H 30 8.040 8.040 8.086 -0.046 25768 10190 1 12 . 1 1 31 31 LYS N N 31 119.800 119.800 121.717 -1.917 25768 10191 1 12 . 1 1 31 31 LYS C C 31 176.770 176.770 174.927 1.843 25768 10192 1 12 . 1 1 31 31 LYS CA C 31 56.870 56.870 56.552 0.318 25768 10193 1 12 . 1 1 31 31 LYS CB C 31 32.980 32.980 32.796 0.184 25768 10194 1 12 . 1 1 31 31 LYS H H 31 8.060 8.060 8.200 -0.140 25768 10195 1 12 . 1 1 32 32 GLN N N 32 120.930 120.930 121.883 -0.953 25768 10196 1 12 . 1 1 32 32 GLN C C 32 176.000 176.000 175.978 0.022 25768 10197 1 12 . 1 1 32 32 GLN CA C 32 56.280 56.280 56.028 0.252 25768 10198 1 12 . 1 1 32 32 GLN CB C 32 29.580 29.580 29.535 0.045 25768 10199 1 12 . 1 1 32 32 GLN H H 32 8.170 8.170 8.493 -0.323 25768 10200 1 12 . 1 1 33 33 ARG N N 33 122.370 122.370 123.607 -1.237 25768 10201 1 12 . 1 1 33 33 ARG C C 33 176.820 176.820 175.587 1.233 25768 10202 1 12 . 1 1 33 33 ARG CA C 33 56.680 56.680 56.341 0.339 25768 10203 1 12 . 1 1 33 33 ARG CB C 33 31.040 31.040 30.879 0.161 25768 10204 1 12 . 1 1 33 33 ARG H H 33 8.270 8.270 8.885 -0.615 25768 10205 1 12 . 1 1 34 34 GLY N N 34 110.210 110.210 108.182 2.028 25768 10206 1 12 . 1 1 34 34 GLY C C 34 174.280 174.280 173.024 1.256 25768 10207 1 12 . 1 1 34 34 GLY CA C 34 45.770 45.770 45.333 0.437 25768 10208 1 12 . 1 1 34 34 GLY H H 34 8.360 8.360 8.147 0.213 25768 10209 1 12 . 1 1 35 35 THR N N 35 114.100 114.100 113.458 0.642 25768 10210 1 12 . 1 1 35 35 THR C C 35 174.550 174.550 173.350 1.200 25768 10211 1 12 . 1 1 35 35 THR CA C 35 62.140 62.140 62.217 -0.077 25768 10212 1 12 . 1 1 35 35 THR CB C 35 70.330 70.330 69.301 1.029 25768 10213 1 12 . 1 1 35 35 THR H H 35 7.970 7.970 8.006 -0.036 25768 10214 1 12 . 1 1 36 36 LYS N N 36 123.850 123.850 123.617 0.233 25768 10215 1 12 . 1 1 36 36 LYS C C 36 176.040 176.040 175.678 0.362 25768 10216 1 12 . 1 1 36 36 LYS CA C 36 56.600 56.600 55.899 0.701 25768 10217 1 12 . 1 1 36 36 LYS CB C 36 33.280 33.280 32.679 0.601 25768 10218 1 12 . 1 1 36 36 LYS H H 36 8.230 8.230 8.389 -0.159 25768 10219 1 12 . 1 1 37 37 ALA N N 37 125.650 125.650 127.239 -1.589 25768 10220 1 12 . 1 1 37 37 ALA C C 37 177.570 177.570 176.986 0.584 25768 10221 1 12 . 1 1 37 37 ALA CA C 37 52.860 52.860 52.049 0.811 25768 10222 1 12 . 1 1 37 37 ALA CB C 37 19.610 19.610 19.281 0.329 25768 10223 1 12 . 1 1 37 37 ALA H H 37 8.290 8.290 8.474 -0.184 25768 10224 1 12 . 1 1 38 38 THR N N 38 113.350 113.350 113.796 -0.446 25768 10225 1 12 . 1 1 38 38 THR C C 38 174.540 174.540 173.877 0.663 25768 10226 1 12 . 1 1 38 38 THR CA C 38 62.010 62.010 63.105 -1.095 25768 10227 1 12 . 1 1 38 38 THR CB C 38 70.350 70.350 68.671 1.679 25768 10228 1 12 . 1 1 38 38 THR H H 38 7.970 7.970 8.038 -0.068 25768 10229 1 12 . 1 1 39 39 VAL N N 39 120.790 120.790 120.604 0.186 25768 10230 1 12 . 1 1 39 39 VAL C C 39 175.620 175.620 176.101 -0.481 25768 10231 1 12 . 1 1 39 39 VAL CA C 39 62.470 62.470 62.477 -0.007 25768 10232 1 12 . 1 1 39 39 VAL CB C 39 32.940 32.940 32.601 0.339 25768 10233 1 12 . 1 1 39 39 VAL H H 39 8.020 8.020 8.193 -0.173 25768 10234 1 12 . 1 1 40 40 ASP N N 40 123.690 123.690 119.514 4.176 25768 10235 1 12 . 1 1 40 40 ASP C C 40 176.190 176.190 176.273 -0.083 25768 10236 1 12 . 1 1 40 40 ASP CA C 40 54.780 54.780 53.378 1.402 25768 10237 1 12 . 1 1 40 40 ASP CB C 40 41.590 41.590 40.767 0.823 25768 10238 1 12 . 1 1 40 40 ASP H H 40 8.310 8.310 8.205 0.105 25768 10239 1 12 . 1 1 41 41 SER N N 41 115.470 115.470 116.193 -0.723 25768 10240 1 12 . 1 1 41 41 SER C C 41 174.170 174.170 174.563 -0.393 25768 10241 1 12 . 1 1 41 41 SER CA C 41 59.000 59.000 59.666 -0.666 25768 10242 1 12 . 1 1 41 41 SER CB C 41 64.420 64.420 63.619 0.801 25768 10243 1 12 . 1 1 41 41 SER H H 41 8.130 8.130 8.018 0.112 25768 10244 1 12 . 1 1 42 42 ASP N N 42 122.430 122.430 119.435 2.995 25768 10245 1 12 . 1 1 42 42 ASP C C 42 175.740 175.740 174.642 1.098 25768 10246 1 12 . 1 1 42 42 ASP CA C 42 54.780 54.780 55.210 -0.430 25768 10247 1 12 . 1 1 42 42 ASP CB C 42 41.620 41.620 40.288 1.332 25768 10248 1 12 . 1 1 42 42 ASP H H 42 8.410 8.410 8.425 -0.015 25768 10249 1 12 . 1 1 43 43 THR N N 43 117.580 117.580 112.470 5.110 25768 10250 1 12 . 1 1 43 43 THR C C 43 173.630 173.630 173.630 0.000 25768 10251 1 12 . 1 1 43 43 THR CA C 43 63.120 63.120 61.188 1.932 25768 10252 1 12 . 1 1 43 43 THR CB C 43 70.650 70.650 69.612 1.038 25768 10253 1 12 . 1 1 43 43 THR H H 43 8.010 8.010 7.594 0.416 25768 10254 1 12 . 1 1 44 44 GLN N N 44 125.420 125.420 123.924 1.496 25768 10255 1 12 . 1 1 44 44 GLN C C 44 174.080 174.080 174.827 -0.747 25768 10256 1 12 . 1 1 44 44 GLN CA C 44 55.110 55.110 55.056 0.054 25768 10257 1 12 . 1 1 44 44 GLN CB C 44 31.570 31.570 31.551 0.019 25768 10258 1 12 . 1 1 44 44 GLN H H 44 9.260 9.260 8.340 0.920 25768 10259 1 12 . 1 1 45 45 LEU N N 45 124.190 124.190 123.550 0.640 25768 10260 1 12 . 1 1 45 45 LEU C C 45 175.970 175.970 176.477 -0.507 25768 10261 1 12 . 1 1 45 45 LEU CA C 45 54.690 54.690 54.718 -0.028 25768 10262 1 12 . 1 1 45 45 LEU CB C 45 42.270 42.270 42.265 0.005 25768 10263 1 12 . 1 1 45 45 LEU H H 45 8.550 8.550 8.377 0.173 25768 10264 1 12 . 1 1 46 46 GLY N N 46 113.310 113.310 111.519 1.791 25768 10265 1 12 . 1 1 46 46 GLY C C 46 171.180 171.180 173.036 -1.856 25768 10266 1 12 . 1 1 46 46 GLY CA C 46 44.400 44.400 44.326 0.074 25768 10267 1 12 . 1 1 46 46 GLY H H 46 8.810 8.810 8.060 0.750 25768 10268 1 12 . 1 1 47 47 LEU N N 47 123.890 123.890 127.302 -3.412 25768 10269 1 12 . 1 1 47 47 LEU C C 47 175.400 175.400 174.865 0.535 25768 10270 1 12 . 1 1 47 47 LEU CA C 47 53.750 53.750 54.114 -0.364 25768 10271 1 12 . 1 1 47 47 LEU CB C 47 46.800 46.800 45.781 1.019 25768 10272 1 12 . 1 1 47 47 LEU H H 47 8.590 8.590 8.466 0.124 25768 10273 1 12 . 1 1 48 48 THR N N 48 111.210 111.210 117.069 -5.859 25768 10274 1 12 . 1 1 48 48 THR C C 48 172.520 172.520 172.197 0.323 25768 10275 1 12 . 1 1 48 48 THR CA C 48 58.950 58.950 60.212 -1.262 25768 10276 1 12 . 1 1 48 48 THR CB C 48 72.360 72.360 71.695 0.665 25768 10277 1 12 . 1 1 48 48 THR H H 48 8.620 8.620 8.861 -0.241 25768 10278 1 12 . 1 1 49 49 PHE N N 49 118.810 118.810 123.456 -4.646 25768 10279 1 12 . 1 1 49 49 PHE C C 49 174.700 174.700 175.460 -0.760 25768 10280 1 12 . 1 1 49 49 PHE CA C 49 55.080 55.080 55.983 -0.903 25768 10281 1 12 . 1 1 49 49 PHE CB C 49 42.360 42.360 41.397 0.963 25768 10282 1 12 . 1 1 49 49 PHE H H 49 8.410 8.410 8.456 -0.046 25768 10283 1 12 . 1 1 50 50 THR N N 50 121.230 121.230 119.810 1.420 25768 10284 1 12 . 1 1 50 50 THR C C 50 173.250 173.250 173.064 0.186 25768 10285 1 12 . 1 1 50 50 THR CA C 50 62.740 62.740 61.933 0.807 25768 10286 1 12 . 1 1 50 50 THR CB C 50 73.740 73.740 69.742 3.998 25768 10287 1 12 . 1 1 50 50 THR H H 50 9.330 9.330 8.620 0.710 25768 10288 1 12 . 1 1 51 51 TYR N N 51 126.010 126.010 127.603 -1.593 25768 10289 1 12 . 1 1 51 51 TYR C C 51 174.850 174.850 174.764 0.086 25768 10290 1 12 . 1 1 51 51 TYR CA C 51 56.240 56.240 57.314 -1.074 25768 10291 1 12 . 1 1 51 51 TYR CB C 51 41.630 41.630 40.138 1.492 25768 10292 1 12 . 1 1 51 51 TYR H H 51 9.150 9.150 9.427 -0.277 25768 10293 1 12 . 1 1 52 52 MET N N 52 127.390 127.390 125.608 1.782 25768 10294 1 12 . 1 1 52 52 MET C C 52 174.490 174.490 174.569 -0.079 25768 10295 1 12 . 1 1 52 52 MET CA C 52 52.450 52.450 55.972 -3.522 25768 10296 1 12 . 1 1 52 52 MET CB C 52 28.590 28.590 33.185 -4.595 25768 10297 1 12 . 1 1 52 52 MET H H 52 7.950 7.950 8.433 -0.483 25768 10298 1 12 . 1 1 53 53 PHE N N 53 123.830 123.830 126.887 -3.057 25768 10299 1 12 . 1 1 53 53 PHE C C 53 173.720 173.720 173.817 -0.097 25768 10300 1 12 . 1 1 53 53 PHE CA C 53 57.110 57.110 56.450 0.660 25768 10301 1 12 . 1 1 53 53 PHE CB C 53 39.420 39.420 41.387 -1.967 25768 10302 1 12 . 1 1 53 53 PHE H H 53 7.720 7.720 8.562 -0.842 25768 10303 1 12 . 1 1 54 54 ALA N N 54 125.650 125.650 128.496 -2.846 25768 10304 1 12 . 1 1 54 54 ALA C C 54 175.020 175.020 176.062 -1.042 25768 10305 1 12 . 1 1 54 54 ALA CA C 54 50.740 50.740 53.344 -2.604 25768 10306 1 12 . 1 1 54 54 ALA CB C 54 22.700 22.700 18.651 4.049 25768 10307 1 12 . 1 1 54 54 ALA H H 54 8.360 8.360 8.473 -0.113 25768 10308 1 12 . 1 1 55 55 ASP N N 55 118.790 118.790 121.639 -2.849 25768 10309 1 12 . 1 1 55 55 ASP C C 55 174.780 174.780 176.114 -1.334 25768 10310 1 12 . 1 1 55 55 ASP CA C 55 58.590 58.590 55.287 3.303 25768 10311 1 12 . 1 1 55 55 ASP CB C 55 40.430 40.430 39.990 0.440 25768 10312 1 12 . 1 1 55 55 ASP H H 55 8.590 8.590 8.703 -0.113 25768 10313 1 12 . 1 1 56 56 LYS N N 56 106.200 106.200 117.870 -11.670 25768 10314 1 12 . 1 1 56 56 LYS C C 56 174.940 174.940 175.595 -0.655 25768 10315 1 12 . 1 1 56 56 LYS CA C 56 55.260 55.260 56.817 -1.557 25768 10316 1 12 . 1 1 56 56 LYS CB C 56 34.510 34.510 35.387 -0.877 25768 10317 1 12 . 1 1 56 56 LYS H H 56 7.260 7.260 7.515 -0.255 25768 10318 1 12 . 1 1 57 57 TRP N N 57 115.680 115.680 122.262 -6.582 25768 10319 1 12 . 1 1 57 57 TRP C C 57 173.940 173.940 175.478 -1.538 25768 10320 1 12 . 1 1 57 57 TRP CA C 57 55.410 55.410 57.257 -1.847 25768 10321 1 12 . 1 1 57 57 TRP CB C 57 34.470 34.470 31.177 3.293 25768 10322 1 12 . 1 1 57 57 TRP H H 57 6.570 6.570 8.449 -1.879 25768 10323 1 12 . 1 1 58 58 GLY N N 58 107.610 107.610 109.725 -2.115 25768 10324 1 12 . 1 1 58 58 GLY C C 58 172.730 172.730 171.988 0.742 25768 10325 1 12 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.636 -0.586 25768 10326 1 12 . 1 1 58 58 GLY H H 58 9.260 9.260 8.536 0.724 25768 10327 1 12 . 1 1 59 59 VAL N N 59 118.130 118.130 125.695 -7.565 25768 10328 1 12 . 1 1 59 59 VAL C C 59 173.000 173.000 174.279 -1.279 25768 10329 1 12 . 1 1 59 59 VAL CA C 59 59.950 59.950 60.731 -0.781 25768 10330 1 12 . 1 1 59 59 VAL CB C 59 35.170 35.170 34.352 0.818 25768 10331 1 12 . 1 1 59 59 VAL H H 59 9.030 9.030 8.206 0.824 25768 10332 1 12 . 1 1 60 60 GLU N N 60 127.900 127.900 125.056 2.844 25768 10333 1 12 . 1 1 60 60 GLU C C 60 174.470 174.470 174.286 0.184 25768 10334 1 12 . 1 1 60 60 GLU CA C 60 52.940 52.940 54.124 -1.185 25768 10335 1 12 . 1 1 60 60 GLU CB C 60 35.100 35.100 34.026 1.074 25768 10336 1 12 . 1 1 60 60 GLU H H 60 9.440 9.440 8.749 0.691 25768 10337 1 12 . 1 1 61 61 LEU N N 61 127.410 127.410 124.917 2.493 25768 10338 1 12 . 1 1 61 61 LEU C C 61 174.950 174.950 175.261 -0.311 25768 10339 1 12 . 1 1 61 61 LEU CA C 61 53.390 53.390 53.777 -0.387 25768 10340 1 12 . 1 1 61 61 LEU CB C 61 45.980 45.980 45.045 0.935 25768 10341 1 12 . 1 1 61 61 LEU H H 61 8.740 8.740 8.406 0.334 25768 10342 1 12 . 1 1 62 62 VAL N N 62 125.750 125.750 120.197 5.553 25768 10343 1 12 . 1 1 62 62 VAL C C 62 173.960 173.960 174.145 -0.185 25768 10344 1 12 . 1 1 62 62 VAL CA C 62 61.350 61.350 59.776 1.574 25768 10345 1 12 . 1 1 62 62 VAL CB C 62 34.740 34.740 34.084 0.656 25768 10346 1 12 . 1 1 62 62 VAL H H 62 8.790 8.790 8.205 0.585 25768 10347 1 12 . 1 1 63 63 ALA N N 63 127.230 127.230 124.206 3.024 25768 10348 1 12 . 1 1 63 63 ALA C C 63 173.930 173.930 175.289 -1.359 25768 10349 1 12 . 1 1 63 63 ALA CA C 63 51.140 51.140 51.792 -0.652 25768 10350 1 12 . 1 1 63 63 ALA CB C 63 22.500 22.500 21.932 0.568 25768 10351 1 12 . 1 1 63 63 ALA H H 63 8.740 8.740 7.945 0.795 25768 10352 1 12 . 1 1 64 64 ALA N N 64 120.410 120.410 122.390 -1.980 25768 10353 1 12 . 1 1 64 64 ALA C C 64 176.770 176.770 177.095 -0.325 25768 10354 1 12 . 1 1 64 64 ALA CA C 64 51.420 51.420 50.406 1.014 25768 10355 1 12 . 1 1 64 64 ALA CB C 64 22.590 22.590 21.997 0.593 25768 10356 1 12 . 1 1 64 64 ALA H H 64 8.290 8.290 8.370 -0.080 25768 10357 1 12 . 1 1 65 65 THR N N 65 116.130 116.130 112.098 4.032 25768 10358 1 12 . 1 1 65 65 THR C C 65 171.220 171.220 173.622 -2.402 25768 10359 1 12 . 1 1 65 65 THR CA C 65 58.860 58.860 58.848 0.012 25768 10360 1 12 . 1 1 65 65 THR CB C 65 72.020 72.020 68.164 3.856 25768 10361 1 12 . 1 1 65 65 THR H H 65 8.760 8.760 8.041 0.719 25768 10362 1 12 . 1 1 66 66 PRO C C 66 176.720 176.720 176.441 0.279 25768 10363 1 12 . 1 1 66 66 PRO CA C 66 63.610 63.610 61.911 1.699 25768 10364 1 12 . 1 1 66 66 PRO CB C 66 32.550 32.550 29.968 2.582 25768 10365 1 12 . 1 1 67 67 PHE N N 67 120.360 120.360 118.725 1.635 25768 10366 1 12 . 1 1 67 67 PHE C C 67 175.480 175.480 173.883 1.597 25768 10367 1 12 . 1 1 67 67 PHE CA C 67 58.840 58.840 59.028 -0.188 25768 10368 1 12 . 1 1 67 67 PHE CB C 67 40.170 40.170 37.821 2.349 25768 10369 1 12 . 1 1 67 67 PHE H H 67 8.590 8.590 7.965 0.625 25768 10370 1 12 . 1 1 68 68 ASN N N 68 119.030 119.030 116.235 2.795 25768 10371 1 12 . 1 1 68 68 ASN C C 68 174.740 174.740 173.605 1.135 25768 10372 1 12 . 1 1 68 68 ASN CA C 68 53.430 53.430 52.900 0.530 25768 10373 1 12 . 1 1 68 68 ASN CB C 68 39.420 39.420 39.996 -0.577 25768 10374 1 12 . 1 1 68 68 ASN H H 68 8.340 8.340 7.617 0.723 25768 10375 1 12 . 1 1 69 69 HIS N N 69 119.590 119.590 123.074 -3.484 25768 10376 1 12 . 1 1 69 69 HIS C C 69 174.370 174.370 175.949 -1.579 25768 10377 1 12 . 1 1 69 69 HIS CA C 69 55.950 55.950 55.950 -0.000 25768 10378 1 12 . 1 1 69 69 HIS CB C 69 29.960 29.960 30.881 -0.921 25768 10379 1 12 . 1 1 69 69 HIS H H 69 8.350 8.350 8.720 -0.370 25768 10380 1 12 . 1 1 70 70 GLN N N 70 121.980 121.980 119.151 2.829 25768 10381 1 12 . 1 1 70 70 GLN C C 70 175.740 175.740 176.120 -0.380 25768 10382 1 12 . 1 1 70 70 GLN CA C 70 56.340 56.340 57.558 -1.218 25768 10383 1 12 . 1 1 70 70 GLN CB C 70 29.660 29.660 29.504 0.156 25768 10384 1 12 . 1 1 70 70 GLN H H 70 8.350 8.350 8.709 -0.359 25768 10385 1 12 . 1 1 71 71 VAL N N 71 120.530 120.530 116.107 4.423 25768 10386 1 12 . 1 1 71 71 VAL C C 71 175.500 175.500 175.174 0.326 25768 10387 1 12 . 1 1 71 71 VAL CA C 71 62.540 62.540 61.676 0.864 25768 10388 1 12 . 1 1 71 71 VAL CB C 71 33.090 33.090 32.365 0.725 25768 10389 1 12 . 1 1 71 71 VAL H H 71 8.020 8.020 7.704 0.316 25768 10390 1 12 . 1 1 72 72 ASP N N 72 123.910 123.910 126.122 -2.212 25768 10391 1 12 . 1 1 72 72 ASP C C 72 176.300 176.300 176.077 0.223 25768 10392 1 12 . 1 1 72 72 ASP CA C 72 54.340 54.340 53.426 0.914 25768 10393 1 12 . 1 1 72 72 ASP CB C 72 41.480 41.480 43.460 -1.980 25768 10394 1 12 . 1 1 72 72 ASP H H 72 8.280 8.280 8.638 -0.358 25768 10395 1 12 . 1 1 73 73 VAL N N 73 120.580 120.580 117.354 3.226 25768 10396 1 12 . 1 1 73 73 VAL C C 73 176.350 176.350 175.121 1.229 25768 10397 1 12 . 1 1 73 73 VAL CA C 73 62.970 62.970 63.574 -0.604 25768 10398 1 12 . 1 1 73 73 VAL CB C 73 32.550 32.550 32.116 0.434 25768 10399 1 12 . 1 1 73 73 VAL H H 73 7.960 7.960 8.540 -0.580 25768 10400 1 12 . 1 1 74 74 LYS N N 74 123.620 123.620 120.621 2.999 25768 10401 1 12 . 1 1 74 74 LYS C C 74 177.130 177.130 174.948 2.182 25768 10402 1 12 . 1 1 74 74 LYS CA C 74 57.060 57.060 55.844 1.216 25768 10403 1 12 . 1 1 74 74 LYS CB C 74 32.860 32.860 34.307 -1.448 25768 10404 1 12 . 1 1 74 74 LYS H H 74 8.230 8.230 7.927 0.303 25768 10405 1 12 . 1 1 75 75 GLY N N 75 109.370 109.370 110.229 -0.859 25768 10406 1 12 . 1 1 75 75 GLY C C 75 174.030 174.030 173.670 0.360 25768 10407 1 12 . 1 1 75 75 GLY CA C 75 45.800 45.800 45.036 0.764 25768 10408 1 12 . 1 1 75 75 GLY H H 75 8.160 8.160 8.683 -0.523 25768 10409 1 12 . 1 1 76 76 LEU N N 76 121.660 121.660 121.104 0.556 25768 10410 1 12 . 1 1 76 76 LEU C C 76 177.410 177.410 178.031 -0.621 25768 10411 1 12 . 1 1 76 76 LEU CA C 76 55.410 55.410 55.843 -0.433 25768 10412 1 12 . 1 1 76 76 LEU CB C 76 42.790 42.790 43.415 -0.625 25768 10413 1 12 . 1 1 76 76 LEU H H 76 8.030 8.030 8.843 -0.813 25768 10414 1 12 . 1 1 77 77 GLY N N 77 109.330 109.330 108.892 0.438 25768 10415 1 12 . 1 1 77 77 GLY C C 77 171.800 171.800 172.474 -0.674 25768 10416 1 12 . 1 1 77 77 GLY CA C 77 44.990 44.990 44.134 0.856 25768 10417 1 12 . 1 1 77 77 GLY H H 77 8.100 8.100 8.013 0.087 25768 10418 1 12 . 1 1 78 78 PRO C C 78 177.740 177.740 176.504 1.236 25768 10419 1 12 . 1 1 78 78 PRO CA C 78 63.890 63.890 62.980 0.910 25768 10420 1 12 . 1 1 78 78 PRO CB C 78 32.170 32.170 31.776 0.394 25768 10421 1 12 . 1 1 79 79 GLY N N 79 109.530 109.530 112.481 -2.951 25768 10422 1 12 . 1 1 79 79 GLY C C 79 174.460 174.460 173.292 1.168 25768 10423 1 12 . 1 1 79 79 GLY CA C 79 45.780 45.780 44.652 1.128 25768 10424 1 12 . 1 1 79 79 GLY H H 79 8.410 8.410 8.412 -0.002 25768 10425 1 12 . 1 1 80 80 LEU N N 80 121.880 121.880 119.072 2.808 25768 10426 1 12 . 1 1 80 80 LEU C C 80 177.100 177.100 176.702 0.398 25768 10427 1 12 . 1 1 80 80 LEU CA C 80 55.720 55.720 54.239 1.481 25768 10428 1 12 . 1 1 80 80 LEU CB C 80 42.580 42.580 43.545 -0.965 25768 10429 1 12 . 1 1 80 80 LEU H H 80 8.010 8.010 8.225 -0.215 25768 10430 1 12 . 1 1 81 81 ASP N N 81 119.990 119.990 119.083 0.907 25768 10431 1 12 . 1 1 81 81 ASP C C 81 176.880 176.880 175.186 1.694 25768 10432 1 12 . 1 1 81 81 ASP CA C 81 54.770 54.770 54.514 0.256 25768 10433 1 12 . 1 1 81 81 ASP CB C 81 41.390 41.390 41.352 0.038 25768 10434 1 12 . 1 1 81 81 ASP H H 81 8.220 8.220 8.706 -0.486 25768 10435 1 12 . 1 1 82 82 GLY N N 82 109.270 109.270 108.053 1.217 25768 10436 1 12 . 1 1 82 82 GLY C C 82 174.190 174.190 172.899 1.291 25768 10437 1 12 . 1 1 82 82 GLY CA C 82 45.990 45.990 44.877 1.113 25768 10438 1 12 . 1 1 82 82 GLY H H 82 8.170 8.170 8.604 -0.434 25768 10439 1 12 . 1 1 83 83 LYS N N 83 121.000 121.000 119.218 1.782 25768 10440 1 12 . 1 1 83 83 LYS C C 83 176.610 176.610 174.779 1.831 25768 10441 1 12 . 1 1 83 83 LYS CA C 83 56.620 56.620 55.945 0.675 25768 10442 1 12 . 1 1 83 83 LYS CB C 83 33.020 33.020 34.051 -1.031 25768 10443 1 12 . 1 1 83 83 LYS H H 83 7.970 7.970 8.041 -0.071 25768 10444 1 12 . 1 1 84 84 LEU N N 84 123.120 123.120 122.910 0.210 25768 10445 1 12 . 1 1 84 84 LEU C C 84 176.920 176.920 174.872 2.048 25768 10446 1 12 . 1 1 84 84 LEU CA C 84 55.550 55.550 54.895 0.655 25768 10447 1 12 . 1 1 84 84 LEU CB C 84 42.430 42.430 42.458 -0.028 25768 10448 1 12 . 1 1 84 84 LEU H H 84 8.130 8.130 8.380 -0.250 25768 10449 1 12 . 1 1 85 85 ALA N N 85 123.930 123.930 125.230 -1.300 25768 10450 1 12 . 1 1 85 85 ALA C C 85 177.060 177.060 177.220 -0.160 25768 10451 1 12 . 1 1 85 85 ALA CA C 85 52.790 52.790 51.870 0.920 25768 10452 1 12 . 1 1 85 85 ALA CB C 85 19.670 19.670 19.231 0.439 25768 10453 1 12 . 1 1 85 85 ALA H H 85 8.040 8.040 8.332 -0.292 25768 10454 1 12 . 1 1 86 86 ASP N N 86 119.760 119.760 123.442 -3.682 25768 10455 1 12 . 1 1 86 86 ASP C C 86 175.820 175.820 176.130 -0.310 25768 10456 1 12 . 1 1 86 86 ASP CA C 86 54.520 54.520 55.203 -0.683 25768 10457 1 12 . 1 1 86 86 ASP CB C 86 41.390 41.390 41.027 0.363 25768 10458 1 12 . 1 1 86 86 ASP H H 86 8.110 8.110 8.971 -0.861 25768 10459 1 12 . 1 1 87 87 ILE N N 87 120.620 120.620 115.490 5.130 25768 10460 1 12 . 1 1 87 87 ILE C C 87 175.740 175.740 176.105 -0.365 25768 10461 1 12 . 1 1 87 87 ILE CA C 87 61.160 61.160 62.360 -1.200 25768 10462 1 12 . 1 1 87 87 ILE CB C 87 39.260 39.260 38.371 0.889 25768 10463 1 12 . 1 1 87 87 ILE H H 87 7.800 7.800 7.972 -0.172 25768 10464 1 12 . 1 1 88 88 LYS N N 88 125.820 125.820 126.644 -0.824 25768 10465 1 12 . 1 1 88 88 LYS C C 88 175.340 175.340 176.245 -0.905 25768 10466 1 12 . 1 1 88 88 LYS CA C 88 56.300 56.300 56.520 -0.220 25768 10467 1 12 . 1 1 88 88 LYS CB C 88 32.900 32.900 33.140 -0.240 25768 10468 1 12 . 1 1 88 88 LYS H H 88 8.250 8.250 8.343 -0.093 25768 10469 1 12 . 1 1 89 89 GLN N N 89 121.750 121.750 121.817 -0.067 25768 10470 1 12 . 1 1 89 89 GLN C C 89 175.000 175.000 175.993 -0.993 25768 10471 1 12 . 1 1 89 89 GLN CA C 89 55.210 55.210 56.090 -0.880 25768 10472 1 12 . 1 1 89 89 GLN CB C 89 30.570 30.570 28.369 2.200 25768 10473 1 12 . 1 1 89 89 GLN H H 89 8.000 8.000 8.314 -0.314 25768 10474 1 12 . 1 1 90 90 LEU N N 90 126.660 126.660 127.223 -0.563 25768 10475 1 12 . 1 1 90 90 LEU C C 90 174.240 174.240 175.560 -1.320 25768 10476 1 12 . 1 1 90 90 LEU CA C 90 52.720 52.720 52.638 0.082 25768 10477 1 12 . 1 1 90 90 LEU CB C 90 42.350 42.350 42.935 -0.585 25768 10478 1 12 . 1 1 90 90 LEU H H 90 8.630 8.630 8.152 0.478 25768 10479 1 12 . 1 1 92 92 PRO C C 92 173.900 173.900 176.087 -2.187 25768 10480 1 12 . 1 1 92 92 PRO CA C 92 63.320 63.320 62.313 1.007 25768 10481 1 12 . 1 1 92 92 PRO CB C 92 31.920 31.920 33.396 -1.476 25768 10482 1 12 . 1 1 93 93 THR N N 93 119.770 119.770 116.567 3.203 25768 10483 1 12 . 1 1 93 93 THR C C 93 171.360 171.360 173.464 -2.104 25768 10484 1 12 . 1 1 93 93 THR CA C 93 62.610 62.610 62.639 -0.029 25768 10485 1 12 . 1 1 93 93 THR CB C 93 72.680 72.680 69.121 3.559 25768 10486 1 12 . 1 1 93 93 THR H H 93 8.290 8.290 8.354 -0.064 25768 10487 1 12 . 1 1 94 94 LEU N N 94 128.880 128.880 128.447 0.433 25768 10488 1 12 . 1 1 94 94 LEU C C 94 175.130 175.130 174.816 0.314 25768 10489 1 12 . 1 1 94 94 LEU CA C 94 53.520 53.520 54.531 -1.011 25768 10490 1 12 . 1 1 94 94 LEU CB C 94 46.140 46.140 43.507 2.633 25768 10491 1 12 . 1 1 94 94 LEU H H 94 8.680 8.680 8.850 -0.170 25768 10492 1 12 . 1 1 95 95 LEU N N 95 123.630 123.630 125.232 -1.602 25768 10493 1 12 . 1 1 95 95 LEU C C 95 175.540 175.540 174.501 1.039 25768 10494 1 12 . 1 1 95 95 LEU CA C 95 55.190 55.190 53.685 1.505 25768 10495 1 12 . 1 1 95 95 LEU CB C 95 45.300 45.300 45.932 -0.632 25768 10496 1 12 . 1 1 95 95 LEU H H 95 9.580 9.580 8.728 0.852 25768 10497 1 12 . 1 1 96 96 LEU N N 96 123.150 123.150 127.252 -4.102 25768 10498 1 12 . 1 1 96 96 LEU C C 96 174.960 174.960 174.896 0.064 25768 10499 1 12 . 1 1 96 96 LEU CA C 96 54.420 54.420 54.861 -0.441 25768 10500 1 12 . 1 1 96 96 LEU CB C 96 44.560 44.560 43.670 0.890 25768 10501 1 12 . 1 1 96 96 LEU H H 96 8.770 8.770 9.058 -0.288 25768 10502 1 12 . 1 1 97 97 GLN N N 97 121.290 121.290 124.902 -3.612 25768 10503 1 12 . 1 1 97 97 GLN C C 97 174.380 174.380 173.940 0.440 25768 10504 1 12 . 1 1 97 97 GLN CA C 97 54.740 54.740 53.903 0.837 25768 10505 1 12 . 1 1 97 97 GLN CB C 97 36.600 36.600 32.610 3.990 25768 10506 1 12 . 1 1 97 97 GLN H H 97 9.480 9.480 8.955 0.525 25768 10507 1 12 . 1 1 98 98 TYR N N 98 122.250 122.250 124.415 -2.165 25768 10508 1 12 . 1 1 98 98 TYR C C 98 173.460 173.460 174.199 -0.739 25768 10509 1 12 . 1 1 98 98 TYR CA C 98 55.160 55.160 56.002 -0.842 25768 10510 1 12 . 1 1 98 98 TYR CB C 98 42.420 42.420 42.919 -0.499 25768 10511 1 12 . 1 1 98 98 TYR H H 98 9.010 9.010 8.493 0.517 25768 10512 1 12 . 1 1 99 99 TYR N N 99 126.860 126.860 126.165 0.695 25768 10513 1 12 . 1 1 99 99 TYR C C 99 175.380 175.380 175.079 0.301 25768 10514 1 12 . 1 1 99 99 TYR CA C 99 54.220 54.220 54.421 -0.201 25768 10515 1 12 . 1 1 99 99 TYR CB C 99 38.890 38.890 38.186 0.704 25768 10516 1 12 . 1 1 99 99 TYR H H 99 8.300 8.300 7.619 0.681 25768 10517 1 12 . 1 1 100 100 PRO C C 100 178.330 178.330 176.767 1.563 25768 10518 1 12 . 1 1 100 100 PRO CA C 100 64.750 64.750 64.892 -0.142 25768 10519 1 12 . 1 1 100 100 PRO CB C 100 32.130 32.130 31.918 0.212 25768 10520 1 12 . 1 1 101 101 MET N N 101 114.520 114.520 118.572 -4.052 25768 10521 1 12 . 1 1 101 101 MET C C 101 178.240 178.240 175.976 2.264 25768 10522 1 12 . 1 1 101 101 MET CA C 101 53.500 53.500 54.394 -0.894 25768 10523 1 12 . 1 1 101 101 MET CB C 101 30.160 30.160 32.890 -2.730 25768 10524 1 12 . 1 1 101 101 MET H H 101 9.390 9.390 7.903 1.487 25768 10525 1 12 . 1 1 102 102 GLY N N 102 117.500 117.500 108.354 9.146 25768 10526 1 12 . 1 1 102 102 GLY C C 102 175.690 175.690 174.039 1.651 25768 10527 1 12 . 1 1 102 102 GLY CA C 102 46.760 46.760 44.963 1.797 25768 10528 1 12 . 1 1 102 102 GLY H H 102 8.640 8.640 7.433 1.207 25768 10529 1 12 . 1 1 103 103 GLY N N 103 111.030 111.030 112.213 -1.183 25768 10530 1 12 . 1 1 103 103 GLY C C 103 174.070 174.070 173.234 0.836 25768 10531 1 12 . 1 1 103 103 GLY CA C 103 46.140 46.140 45.367 0.773 25768 10532 1 12 . 1 1 103 103 GLY H H 103 9.390 9.390 7.567 1.823 25768 10533 1 12 . 1 1 104 104 THR N N 104 109.290 109.290 113.255 -3.965 25768 10534 1 12 . 1 1 104 104 THR C C 104 174.290 174.290 173.699 0.591 25768 10535 1 12 . 1 1 104 104 THR CA C 104 60.900 60.900 61.092 -0.192 25768 10536 1 12 . 1 1 104 104 THR CB C 104 72.070 72.070 69.353 2.717 25768 10537 1 12 . 1 1 104 104 THR H H 104 7.290 7.290 7.613 -0.323 25768 10538 1 12 . 1 1 105 105 ASN C C 105 175.050 175.050 175.020 0.030 25768 10539 1 12 . 1 1 105 105 ASN CA C 105 52.880 52.880 52.971 -0.091 25768 10540 1 12 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.762 -0.502 25768 10541 1 12 . 1 1 106 106 SER N N 106 113.000 113.000 116.650 -3.650 25768 10542 1 12 . 1 1 106 106 SER C C 106 176.000 176.000 175.121 0.879 25768 10543 1 12 . 1 1 106 106 SER CA C 106 58.700 58.700 58.725 -0.025 25768 10544 1 12 . 1 1 106 106 SER CB C 106 64.540 64.540 64.442 0.099 25768 10545 1 12 . 1 1 106 106 SER H H 106 7.450 7.450 7.844 -0.394 25768 10546 1 12 . 1 1 107 107 ALA N N 107 132.220 132.220 124.403 7.817 25768 10547 1 12 . 1 1 107 107 ALA C C 107 176.610 176.610 176.841 -0.231 25768 10548 1 12 . 1 1 107 107 ALA CA C 107 54.380 54.380 53.203 1.177 25768 10549 1 12 . 1 1 107 107 ALA CB C 107 18.690 18.690 19.216 -0.526 25768 10550 1 12 . 1 1 107 107 ALA H H 107 8.870 8.870 8.374 0.496 25768 10551 1 12 . 1 1 108 108 PHE N N 108 116.050 116.050 118.676 -2.626 25768 10552 1 12 . 1 1 108 108 PHE C C 108 174.270 174.270 175.629 -1.359 25768 10553 1 12 . 1 1 108 108 PHE CA C 108 56.140 56.140 58.627 -2.487 25768 10554 1 12 . 1 1 108 108 PHE CB C 108 40.520 40.520 38.570 1.950 25768 10555 1 12 . 1 1 108 108 PHE H H 108 7.550 7.550 7.467 0.083 25768 10556 1 12 . 1 1 109 109 GLN N N 109 128.260 128.260 124.298 3.962 25768 10557 1 12 . 1 1 109 109 GLN C C 109 172.300 172.300 173.659 -1.359 25768 10558 1 12 . 1 1 109 109 GLN CA C 109 52.310 52.310 52.964 -0.654 25768 10559 1 12 . 1 1 109 109 GLN CB C 109 29.050 29.050 29.802 -0.752 25768 10560 1 12 . 1 1 109 109 GLN H H 109 9.060 9.060 8.175 0.885 25768 10561 1 12 . 1 1 110 110 PRO C C 110 175.020 175.020 175.533 -0.513 25768 10562 1 12 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.301 -0.751 25768 10563 1 12 . 1 1 110 110 PRO CB C 110 33.280 33.280 32.427 0.853 25768 10564 1 12 . 1 1 111 111 TYR N N 111 115.730 115.730 115.514 0.216 25768 10565 1 12 . 1 1 111 111 TYR C C 111 173.850 173.850 175.007 -1.157 25768 10566 1 12 . 1 1 111 111 TYR CA C 111 56.470 56.470 57.379 -0.909 25768 10567 1 12 . 1 1 111 111 TYR CB C 111 38.650 38.650 42.800 -4.150 25768 10568 1 12 . 1 1 111 111 TYR H H 111 8.500 8.500 8.552 -0.052 25768 10569 1 12 . 1 1 112 112 GLY N N 112 103.570 103.570 110.578 -7.008 25768 10570 1 12 . 1 1 112 112 GLY C C 112 172.020 172.020 173.542 -1.522 25768 10571 1 12 . 1 1 112 112 GLY CA C 112 43.950 43.950 44.080 -0.130 25768 10572 1 12 . 1 1 112 112 GLY H H 112 8.110 8.110 8.891 -0.781 25768 10573 1 12 . 1 1 113 113 GLY N N 113 108.510 108.510 112.860 -4.350 25768 10574 1 12 . 1 1 113 113 GLY C C 113 171.540 171.540 172.652 -1.112 25768 10575 1 12 . 1 1 113 113 GLY CA C 113 46.120 46.120 43.818 2.302 25768 10576 1 12 . 1 1 113 113 GLY H H 113 9.080 9.080 9.106 -0.026 25768 10577 1 12 . 1 1 114 114 LEU N N 114 120.270 120.270 123.757 -3.487 25768 10578 1 12 . 1 1 114 114 LEU C C 114 175.810 175.810 175.995 -0.185 25768 10579 1 12 . 1 1 114 114 LEU CA C 114 53.920 53.920 53.555 0.365 25768 10580 1 12 . 1 1 114 114 LEU CB C 114 47.940 47.940 46.188 1.752 25768 10581 1 12 . 1 1 114 114 LEU H H 114 8.620 8.620 8.774 -0.154 25768 10582 1 12 . 1 1 115 115 GLY N N 115 110.620 110.620 110.231 0.389 25768 10583 1 12 . 1 1 115 115 GLY C C 115 171.560 171.560 172.807 -1.247 25768 10584 1 12 . 1 1 115 115 GLY CA C 115 46.940 46.940 45.145 1.795 25768 10585 1 12 . 1 1 115 115 GLY H H 115 9.000 9.000 8.456 0.544 25768 10586 1 12 . 1 1 116 116 VAL N N 116 113.600 113.600 120.350 -6.750 25768 10587 1 12 . 1 1 116 116 VAL C C 116 174.120 174.120 174.080 0.040 25768 10588 1 12 . 1 1 116 116 VAL CA C 116 58.970 58.970 61.051 -2.081 25768 10589 1 12 . 1 1 116 116 VAL CB C 116 36.600 36.600 34.447 2.152 25768 10590 1 12 . 1 1 116 116 VAL H H 116 8.680 8.680 7.876 0.804 25768 10591 1 12 . 1 1 117 117 ASN N N 117 120.020 120.020 123.150 -3.130 25768 10592 1 12 . 1 1 117 117 ASN CA C 117 52.190 52.190 52.919 -0.730 25768 10593 1 12 . 1 1 117 117 ASN CB C 117 42.450 42.450 41.078 1.372 25768 10594 1 12 . 1 1 117 117 ASN H H 117 8.840 8.840 8.539 0.301 25768 10595 1 12 . 1 1 119 119 THR C C 119 174.350 174.350 174.057 0.293 25768 10596 1 12 . 1 1 119 119 THR CA C 119 63.140 63.140 61.817 1.323 25768 10597 1 12 . 1 1 119 119 THR CB C 119 70.170 70.170 69.713 0.457 25768 10598 1 12 . 1 1 120 120 THR N N 120 114.120 114.120 114.339 -0.219 25768 10599 1 12 . 1 1 120 120 THR C C 120 174.220 174.220 173.975 0.245 25768 10600 1 12 . 1 1 120 120 THR CA C 120 61.900 61.900 62.914 -1.014 25768 10601 1 12 . 1 1 120 120 THR CB C 120 70.140 70.140 68.561 1.579 25768 10602 1 12 . 1 1 120 120 THR H H 120 7.570 7.570 7.734 -0.164 25768 10603 1 12 . 1 1 121 121 PHE N N 121 121.230 121.230 120.042 1.188 25768 10604 1 12 . 1 1 121 121 PHE C C 121 174.910 174.910 176.185 -1.275 25768 10605 1 12 . 1 1 121 121 PHE CA C 121 58.720 58.720 57.069 1.651 25768 10606 1 12 . 1 1 121 121 PHE CB C 121 40.470 40.470 40.051 0.419 25768 10607 1 12 . 1 1 121 121 PHE H H 121 7.830 7.830 8.546 -0.716 25768 10608 1 12 . 1 1 122 122 PHE C C 122 175.070 175.070 174.545 0.525 25768 10609 1 12 . 1 1 122 122 PHE CA C 122 57.890 57.890 57.011 0.879 25768 10610 1 12 . 1 1 122 122 PHE CB C 122 39.870 39.870 38.789 1.081 25768 10611 1 12 . 1 1 123 123 ASP N N 123 122.170 122.170 119.759 2.411 25768 10612 1 12 . 1 1 123 123 ASP C C 123 176.150 176.150 175.628 0.522 25768 10613 1 12 . 1 1 123 123 ASP CA C 123 54.530 54.530 53.604 0.926 25768 10614 1 12 . 1 1 123 123 ASP CB C 123 41.830 41.830 42.395 -0.565 25768 10615 1 12 . 1 1 123 123 ASP H H 123 7.950 7.950 8.032 -0.082 25768 10616 1 12 . 1 1 124 124 GLU N N 124 122.690 122.690 120.536 2.154 25768 10617 1 12 . 1 1 124 124 GLU C C 124 176.630 176.630 177.259 -0.629 25768 10618 1 12 . 1 1 124 124 GLU CA C 124 57.620 57.620 57.976 -0.356 25768 10619 1 12 . 1 1 124 124 GLU CB C 124 30.450 30.450 30.250 0.200 25768 10620 1 12 . 1 1 124 124 GLU H H 124 8.340 8.340 8.629 -0.289 25768 10621 1 12 . 1 1 125 125 ASP N N 125 121.280 121.280 120.108 1.172 25768 10622 1 12 . 1 1 125 125 ASP C C 125 176.940 176.940 178.054 -1.114 25768 10623 1 12 . 1 1 125 125 ASP CA C 125 55.180 55.180 56.212 -1.032 25768 10624 1 12 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.245 0.975 25768 10625 1 12 . 1 1 125 125 ASP H H 125 8.310 8.310 8.458 -0.148 25768 10626 1 12 . 1 1 126 126 LEU N N 126 122.830 122.830 120.544 2.286 25768 10627 1 12 . 1 1 126 126 LEU C C 126 178.020 178.020 178.508 -0.488 25768 10628 1 12 . 1 1 126 126 LEU CA C 126 56.450 56.450 56.365 0.085 25768 10629 1 12 . 1 1 126 126 LEU CB C 126 42.150 42.150 41.905 0.245 25768 10630 1 12 . 1 1 126 126 LEU H H 126 8.010 8.010 7.812 0.198 25768 10631 1 12 . 1 1 127 127 ALA N N 127 122.660 122.660 120.489 2.171 25768 10632 1 12 . 1 1 127 127 ALA C C 127 178.600 178.600 177.675 0.925 25768 10633 1 12 . 1 1 127 127 ALA CA C 127 53.780 53.780 53.817 -0.037 25768 10634 1 12 . 1 1 127 127 ALA CB C 127 19.000 19.000 18.982 0.018 25768 10635 1 12 . 1 1 127 127 ALA H H 127 8.100 8.100 7.632 0.468 25768 10636 1 12 . 1 1 128 128 SER N N 128 113.740 113.740 111.262 2.478 25768 10637 1 12 . 1 1 128 128 SER C C 128 175.010 175.010 173.151 1.859 25768 10638 1 12 . 1 1 128 128 SER CA C 128 59.580 59.580 58.462 1.118 25768 10639 1 12 . 1 1 128 128 SER CB C 128 63.800 63.800 63.681 0.119 25768 10640 1 12 . 1 1 128 128 SER H H 128 7.920 7.920 8.102 -0.182 25768 10641 1 12 . 1 1 129 129 ASN N N 129 120.300 120.300 122.751 -2.451 25768 10642 1 12 . 1 1 129 129 ASN C C 129 175.590 175.590 175.322 0.268 25768 10643 1 12 . 1 1 129 129 ASN CA C 129 54.180 54.180 53.276 0.904 25768 10644 1 12 . 1 1 129 129 ASN CB C 129 38.900 38.900 38.081 0.819 25768 10645 1 12 . 1 1 129 129 ASN H H 129 8.120 8.120 8.721 -0.601 25768 10646 1 12 . 1 1 130 130 ARG N N 130 120.630 120.630 120.551 0.079 25768 10647 1 12 . 1 1 130 130 ARG C C 130 176.720 176.720 175.808 0.912 25768 10648 1 12 . 1 1 130 130 ARG CA C 130 57.240 57.240 55.992 1.248 25768 10649 1 12 . 1 1 130 130 ARG CB C 130 30.500 30.500 30.904 -0.404 25768 10650 1 12 . 1 1 130 130 ARG H H 130 8.050 8.050 7.879 0.171 25768 10651 1 12 . 1 1 131 131 LYS N N 131 121.150 121.150 117.259 3.891 25768 10652 1 12 . 1 1 131 131 LYS C C 131 176.750 176.750 174.883 1.867 25768 10653 1 12 . 1 1 131 131 LYS CA C 131 57.050 57.050 56.626 0.424 25768 10654 1 12 . 1 1 131 131 LYS CB C 131 32.870 32.870 30.573 2.296 25768 10655 1 12 . 1 1 131 131 LYS H H 131 8.020 8.020 8.372 -0.352 25768 10656 1 12 . 1 1 132 132 ALA N N 132 124.110 124.110 121.966 2.144 25768 10657 1 12 . 1 1 132 132 ALA C C 132 177.680 177.680 176.916 0.764 25768 10658 1 12 . 1 1 132 132 ALA CA C 132 53.070 53.070 51.770 1.300 25768 10659 1 12 . 1 1 132 132 ALA CB C 132 19.250 19.250 19.242 0.008 25768 10660 1 12 . 1 1 132 132 ALA H H 132 8.010 8.010 7.818 0.192 25768 10661 1 12 . 1 1 133 133 GLN N N 133 118.830 118.830 122.231 -3.401 25768 10662 1 12 . 1 1 133 133 GLN C C 133 176.380 176.380 175.761 0.619 25768 10663 1 12 . 1 1 133 133 GLN CA C 133 56.400 56.400 55.744 0.656 25768 10664 1 12 . 1 1 133 133 GLN CB C 133 29.670 29.670 30.201 -0.531 25768 10665 1 12 . 1 1 133 133 GLN H H 133 8.070 8.070 8.444 -0.374 25768 10666 1 12 . 1 1 134 134 GLY N N 134 109.400 109.400 109.816 -0.416 25768 10667 1 12 . 1 1 134 134 GLY C C 134 174.060 174.060 174.137 -0.077 25768 10668 1 12 . 1 1 134 134 GLY CA C 134 45.690 45.690 45.070 0.620 25768 10669 1 12 . 1 1 134 134 GLY H H 134 8.150 8.150 8.746 -0.596 25768 10670 1 12 . 1 1 135 135 PHE N N 135 120.480 120.480 121.047 -0.567 25768 10671 1 12 . 1 1 135 135 PHE C C 135 176.000 176.000 176.771 -0.771 25768 10672 1 12 . 1 1 135 135 PHE CA C 135 58.370 58.370 58.323 0.047 25768 10673 1 12 . 1 1 135 135 PHE CB C 135 39.710 39.710 39.526 0.184 25768 10674 1 12 . 1 1 135 135 PHE H H 135 8.060 8.060 7.564 0.496 25768 10675 1 12 . 1 1 136 136 SER N N 136 116.740 116.740 115.740 1.000 25768 10676 1 12 . 1 1 136 136 SER C C 136 174.620 174.620 173.313 1.307 25768 10677 1 12 . 1 1 136 136 SER CA C 136 58.870 58.870 58.297 0.572 25768 10678 1 12 . 1 1 136 136 SER CB C 136 64.200 64.200 63.054 1.146 25768 10679 1 12 . 1 1 136 136 SER H H 136 8.160 8.160 8.481 -0.321 25768 10680 1 12 . 1 1 137 137 SER N N 137 117.650 117.650 116.673 0.977 25768 10681 1 12 . 1 1 137 137 SER C C 137 174.410 174.410 173.252 1.158 25768 10682 1 12 . 1 1 137 137 SER CA C 137 58.880 58.880 58.239 0.641 25768 10683 1 12 . 1 1 137 137 SER CB C 137 64.140 64.140 63.976 0.164 25768 10684 1 12 . 1 1 137 137 SER H H 137 8.140 8.140 7.858 0.282 25768 10685 1 12 . 1 1 138 138 MET N N 138 121.980 121.980 125.378 -3.398 25768 10686 1 12 . 1 1 138 138 MET C C 138 175.680 175.680 175.890 -0.210 25768 10687 1 12 . 1 1 138 138 MET CA C 138 56.180 56.180 55.806 0.374 25768 10688 1 12 . 1 1 138 138 MET CB C 138 33.240 33.240 34.210 -0.970 25768 10689 1 12 . 1 1 138 138 MET H H 138 8.110 8.110 8.506 -0.396 25768 10690 1 12 . 1 1 139 139 LYS N N 139 122.110 122.110 124.664 -2.554 25768 10691 1 12 . 1 1 139 139 LYS C C 139 176.220 176.220 175.922 0.298 25768 10692 1 12 . 1 1 139 139 LYS CA C 139 56.370 56.370 57.143 -0.773 25768 10693 1 12 . 1 1 139 139 LYS CB C 139 33.220 33.220 32.776 0.444 25768 10694 1 12 . 1 1 139 139 LYS H H 139 8.140 8.140 8.551 -0.411 25768 10695 1 12 . 1 1 140 140 LEU N N 140 123.860 123.860 116.496 7.364 25768 10696 1 12 . 1 1 140 140 LEU C C 140 177.100 177.100 175.169 1.931 25768 10697 1 12 . 1 1 140 140 LEU CA C 140 55.710 55.710 52.791 2.920 25768 10698 1 12 . 1 1 140 140 LEU CB C 140 42.460 42.460 44.092 -1.632 25768 10699 1 12 . 1 1 140 140 LEU H H 140 8.140 8.140 7.415 0.725 25768 10700 1 12 . 1 1 141 141 GLN N N 141 120.350 120.350 117.719 2.631 25768 10701 1 12 . 1 1 141 141 GLN C C 141 175.170 175.170 175.065 0.105 25768 10702 1 12 . 1 1 141 141 GLN CA C 141 56.200 56.200 55.239 0.961 25768 10703 1 12 . 1 1 141 141 GLN CB C 141 29.950 29.950 30.468 -0.518 25768 10704 1 12 . 1 1 141 141 GLN H H 141 8.210 8.210 8.282 -0.072 25768 10705 1 12 . 1 1 142 142 ASP N N 142 120.950 120.950 124.283 -3.333 25768 10706 1 12 . 1 1 142 142 ASP C C 142 175.840 175.840 175.666 0.174 25768 10707 1 12 . 1 1 142 142 ASP CA C 142 54.700 54.700 54.972 -0.272 25768 10708 1 12 . 1 1 142 142 ASP CB C 142 41.760 41.760 41.681 0.079 25768 10709 1 12 . 1 1 142 142 ASP H H 142 8.120 8.120 8.857 -0.737 25768 10710 1 12 . 1 1 143 143 SER N N 143 114.880 114.880 113.624 1.256 25768 10711 1 12 . 1 1 143 143 SER C C 143 173.290 173.290 173.154 0.136 25768 10712 1 12 . 1 1 143 143 SER CA C 143 58.450 58.450 57.765 0.685 25768 10713 1 12 . 1 1 143 143 SER CB C 143 64.760 64.760 64.214 0.546 25768 10714 1 12 . 1 1 143 143 SER H H 143 7.960 7.960 8.172 -0.212 25768 10715 1 12 . 1 1 144 144 TRP N N 144 123.110 123.110 128.215 -5.105 25768 10716 1 12 . 1 1 144 144 TRP C C 144 175.880 175.880 174.765 1.115 25768 10717 1 12 . 1 1 144 144 TRP CA C 144 56.420 56.420 57.406 -0.986 25768 10718 1 12 . 1 1 144 144 TRP CB C 144 31.160 31.160 31.410 -0.250 25768 10719 1 12 . 1 1 144 144 TRP H H 144 8.080 8.080 8.571 -0.491 25768 10720 1 12 . 1 1 145 145 GLY N N 145 110.410 110.410 112.610 -2.200 25768 10721 1 12 . 1 1 145 145 GLY C C 145 172.870 172.870 173.203 -0.333 25768 10722 1 12 . 1 1 145 145 GLY CA C 145 45.130 45.130 44.451 0.679 25768 10723 1 12 . 1 1 145 145 GLY H H 145 8.660 8.660 7.902 0.758 25768 10724 1 12 . 1 1 148 148 GLY C C 148 171.800 171.800 172.602 -0.802 25768 10725 1 12 . 1 1 148 148 GLY CA C 148 44.140 44.140 44.256 -0.116 25768 10726 1 12 . 1 1 149 149 GLU N N 149 123.070 123.070 118.534 4.536 25768 10727 1 12 . 1 1 149 149 GLU C C 149 174.210 174.210 174.894 -0.684 25768 10728 1 12 . 1 1 149 149 GLU CA C 149 55.120 55.120 55.465 -0.345 25768 10729 1 12 . 1 1 149 149 GLU CB C 149 37.410 37.410 35.046 2.364 25768 10730 1 12 . 1 1 149 149 GLU H H 149 8.550 8.550 8.825 -0.275 25768 10731 1 12 . 1 1 150 150 LEU N N 150 126.130 126.130 121.959 4.171 25768 10732 1 12 . 1 1 150 150 LEU C C 150 174.410 174.410 176.230 -1.820 25768 10733 1 12 . 1 1 150 150 LEU CA C 150 54.260 54.260 53.819 0.440 25768 10734 1 12 . 1 1 150 150 LEU CB C 150 47.510 47.510 43.347 4.163 25768 10735 1 12 . 1 1 150 150 LEU H H 150 8.550 8.550 8.193 0.357 25768 10736 1 12 . 1 1 151 151 GLY N N 151 109.500 109.500 110.290 -0.790 25768 10737 1 12 . 1 1 151 151 GLY C C 151 170.610 170.610 172.098 -1.488 25768 10738 1 12 . 1 1 151 151 GLY CA C 151 45.980 45.980 43.625 2.355 25768 10739 1 12 . 1 1 151 151 GLY H H 151 8.090 8.090 9.202 -1.112 25768 10740 1 12 . 1 1 152 152 PHE N N 152 110.960 110.960 123.869 -12.909 25768 10741 1 12 . 1 1 152 152 PHE C C 152 171.510 171.510 174.143 -2.633 25768 10742 1 12 . 1 1 152 152 PHE CA C 152 58.170 58.170 56.659 1.511 25768 10743 1 12 . 1 1 152 152 PHE CB C 152 41.690 41.690 41.299 0.391 25768 10744 1 12 . 1 1 152 152 PHE H H 152 8.380 8.380 8.370 0.010 25768 10745 1 12 . 1 1 153 153 ASP N N 153 118.880 118.880 126.053 -7.173 25768 10746 1 12 . 1 1 153 153 ASP C C 153 176.520 176.520 174.706 1.814 25768 10747 1 12 . 1 1 153 153 ASP CA C 153 52.940 52.940 53.296 -0.356 25768 10748 1 12 . 1 1 153 153 ASP CB C 153 44.540 44.540 43.668 0.872 25768 10749 1 12 . 1 1 153 153 ASP H H 153 7.970 7.970 8.862 -0.892 25768 10750 1 12 . 1 1 154 154 TYR N N 154 123.630 123.630 121.755 1.875 25768 10751 1 12 . 1 1 154 154 TYR C C 154 175.610 175.610 175.298 0.312 25768 10752 1 12 . 1 1 154 154 TYR CA C 154 57.310 57.310 57.184 0.126 25768 10753 1 12 . 1 1 154 154 TYR CB C 154 42.040 42.040 43.317 -1.277 25768 10754 1 12 . 1 1 154 154 TYR H H 154 9.730 9.730 9.374 0.356 25768 10755 1 12 . 1 1 155 155 MET N N 155 126.190 126.190 122.254 3.936 25768 10756 1 12 . 1 1 155 155 MET C C 155 174.970 174.970 175.657 -0.687 25768 10757 1 12 . 1 1 155 155 MET CA C 155 54.720 54.720 57.307 -2.587 25768 10758 1 12 . 1 1 155 155 MET CB C 155 28.300 28.300 33.131 -4.831 25768 10759 1 12 . 1 1 155 155 MET H H 155 8.600 8.600 9.127 -0.527 25768 10760 1 12 . 1 1 156 156 LEU N N 156 125.290 125.290 124.972 0.318 25768 10761 1 12 . 1 1 156 156 LEU C C 156 177.680 177.680 177.879 -0.199 25768 10762 1 12 . 1 1 156 156 LEU CA C 156 56.040 56.040 54.900 1.140 25768 10763 1 12 . 1 1 156 156 LEU CB C 156 43.040 43.040 42.927 0.113 25768 10764 1 12 . 1 1 156 156 LEU H H 156 9.190 9.190 8.551 0.639 25768 10765 1 12 . 1 1 157 157 ASN N N 157 114.690 114.690 117.474 -2.784 25768 10766 1 12 . 1 1 157 157 ASN C C 157 173.640 173.640 177.433 -3.793 25768 10767 1 12 . 1 1 157 157 ASN CA C 157 52.650 52.650 56.400 -3.750 25768 10768 1 12 . 1 1 157 157 ASN CB C 157 37.270 37.270 36.797 0.473 25768 10769 1 12 . 1 1 157 157 ASN H H 157 8.060 8.060 8.168 -0.108 25768 10770 1 12 . 1 1 158 158 GLU N N 158 114.530 114.530 120.981 -6.451 25768 10771 1 12 . 1 1 158 158 GLU C C 158 176.090 176.090 176.969 -0.879 25768 10772 1 12 . 1 1 158 158 GLU CA C 158 60.010 60.010 58.340 1.670 25768 10773 1 12 . 1 1 158 158 GLU CB C 158 29.730 29.730 29.769 -0.039 25768 10774 1 12 . 1 1 158 158 GLU H H 158 8.560 8.560 8.395 0.165 25768 10775 1 12 . 1 1 159 159 HIS N N 159 110.480 110.480 116.372 -5.892 25768 10776 1 12 . 1 1 159 159 HIS C C 159 173.130 173.130 174.079 -0.949 25768 10777 1 12 . 1 1 159 159 HIS CA C 159 56.770 56.770 54.751 2.019 25768 10778 1 12 . 1 1 159 159 HIS CB C 159 32.630 32.630 28.994 3.636 25768 10779 1 12 . 1 1 159 159 HIS H H 159 8.190 8.190 7.803 0.387 25768 10780 1 12 . 1 1 160 160 ALA N N 160 122.890 122.890 121.443 1.447 25768 10781 1 12 . 1 1 160 160 ALA C C 160 176.200 176.200 175.412 0.788 25768 10782 1 12 . 1 1 160 160 ALA CA C 160 51.730 51.730 54.290 -2.560 25768 10783 1 12 . 1 1 160 160 ALA CB C 160 21.560 21.560 17.365 4.195 25768 10784 1 12 . 1 1 160 160 ALA H H 160 8.400 8.400 7.468 0.932 25768 10785 1 12 . 1 1 161 161 LEU N N 161 116.540 116.540 113.488 3.052 25768 10786 1 12 . 1 1 161 161 LEU C C 161 174.930 174.930 174.996 -0.066 25768 10787 1 12 . 1 1 161 161 LEU CA C 161 54.280 54.280 54.107 0.173 25768 10788 1 12 . 1 1 161 161 LEU CB C 161 45.640 45.640 45.483 0.156 25768 10789 1 12 . 1 1 161 161 LEU H H 161 8.590 8.590 7.652 0.938 25768 10790 1 12 . 1 1 162 162 PHE N N 162 121.780 121.780 120.599 1.181 25768 10791 1 12 . 1 1 162 162 PHE C C 162 171.960 171.960 173.600 -1.640 25768 10792 1 12 . 1 1 162 162 PHE CA C 162 56.420 56.420 56.819 -0.399 25768 10793 1 12 . 1 1 162 162 PHE CB C 162 43.340 43.340 43.856 -0.516 25768 10794 1 12 . 1 1 162 162 PHE H H 162 9.180 9.180 9.439 -0.259 25768 10795 1 12 . 1 1 163 163 ASN N N 163 127.850 127.850 121.430 6.420 25768 10796 1 12 . 1 1 163 163 ASN C C 163 171.320 171.320 173.593 -2.273 25768 10797 1 12 . 1 1 163 163 ASN CA C 163 52.340 52.340 51.989 0.351 25768 10798 1 12 . 1 1 163 163 ASN CB C 163 46.410 46.410 42.533 3.877 25768 10799 1 12 . 1 1 163 163 ASN H H 163 7.700 7.700 7.943 -0.243 25768 10800 1 12 . 1 1 164 164 MET N N 164 119.950 119.950 117.729 2.221 25768 10801 1 12 . 1 1 164 164 MET C C 164 172.830 172.830 173.969 -1.139 25768 10802 1 12 . 1 1 164 164 MET CA C 164 55.180 55.180 53.747 1.433 25768 10803 1 12 . 1 1 164 164 MET CB C 164 37.770 37.770 37.798 -0.028 25768 10804 1 12 . 1 1 164 164 MET H H 164 7.070 7.070 8.285 -1.215 25768 10805 1 12 . 1 1 165 165 ALA N N 165 120.600 120.600 120.768 -0.168 25768 10806 1 12 . 1 1 165 165 ALA C C 165 174.240 174.240 175.623 -1.383 25768 10807 1 12 . 1 1 165 165 ALA CA C 165 51.630 51.630 51.084 0.546 25768 10808 1 12 . 1 1 165 165 ALA CB C 165 22.330 22.330 22.531 -0.201 25768 10809 1 12 . 1 1 165 165 ALA H H 165 8.290 8.290 8.958 -0.668 25768 10810 1 12 . 1 1 166 166 VAL N N 166 117.900 117.900 116.688 1.212 25768 10811 1 12 . 1 1 166 166 VAL C C 166 172.950 172.950 175.508 -2.558 25768 10812 1 12 . 1 1 166 166 VAL CA C 166 59.710 59.710 60.761 -1.051 25768 10813 1 12 . 1 1 166 166 VAL CB C 166 35.290 35.290 34.576 0.714 25768 10814 1 12 . 1 1 166 166 VAL H H 166 8.720 8.720 7.866 0.854 25768 10815 1 12 . 1 1 171 171 ILE C C 171 175.750 175.750 176.073 -0.323 25768 10816 1 12 . 1 1 171 171 ILE CA C 171 61.720 61.720 61.218 0.502 25768 10817 1 12 . 1 1 171 171 ILE CB C 171 39.300 39.300 39.577 -0.277 25768 10818 1 12 . 1 1 172 172 ASP N N 172 124.070 124.070 118.712 5.358 25768 10819 1 12 . 1 1 172 172 ASP C C 172 176.590 176.590 175.123 1.467 25768 10820 1 12 . 1 1 172 172 ASP CA C 172 54.460 54.460 53.687 0.773 25768 10821 1 12 . 1 1 172 172 ASP CB C 172 41.410 41.410 42.826 -1.416 25768 10822 1 12 . 1 1 172 172 ASP H H 172 8.460 8.460 7.774 0.686 25768 10823 1 12 . 1 1 173 173 THR N N 173 115.570 115.570 115.730 -0.160 25768 10824 1 12 . 1 1 173 173 THR C C 173 175.030 175.030 174.062 0.968 25768 10825 1 12 . 1 1 173 173 THR CA C 173 62.680 62.680 62.287 0.393 25768 10826 1 12 . 1 1 173 173 THR CB C 173 69.840 69.840 69.136 0.704 25768 10827 1 12 . 1 1 173 173 THR H H 173 8.080 8.080 8.099 -0.019 25768 10828 1 12 . 1 1 174 174 LYS N N 174 122.680 122.680 127.491 -4.811 25768 10829 1 12 . 1 1 174 174 LYS C C 174 176.340 176.340 175.453 0.887 25768 10830 1 12 . 1 1 174 174 LYS CA C 174 56.820 56.820 56.108 0.712 25768 10831 1 12 . 1 1 174 174 LYS CB C 174 32.790 32.790 33.465 -0.675 25768 10832 1 12 . 1 1 174 174 LYS H H 174 8.180 8.180 8.771 -0.591 25768 10833 1 12 . 1 1 175 175 ALA N N 175 124.050 124.050 125.607 -1.557 25768 10834 1 12 . 1 1 175 175 ALA C C 175 177.550 177.550 177.068 0.482 25768 10835 1 12 . 1 1 175 175 ALA CA C 175 52.840 52.840 52.397 0.443 25768 10836 1 12 . 1 1 175 175 ALA CB C 175 19.580 19.580 18.401 1.179 25768 10837 1 12 . 1 1 175 175 ALA H H 175 8.050 8.050 8.166 -0.116 25768 10838 1 12 . 1 1 176 176 SER N N 176 114.920 114.920 116.079 -1.159 25768 10839 1 12 . 1 1 176 176 SER C C 176 174.240 174.240 174.176 0.064 25768 10840 1 12 . 1 1 176 176 SER CA C 176 58.390 58.390 58.117 0.273 25768 10841 1 12 . 1 1 176 176 SER CB C 176 64.370 64.370 64.019 0.351 25768 10842 1 12 . 1 1 176 176 SER H H 176 8.070 8.070 8.243 -0.173 25768 10843 1 12 . 1 1 177 177 ILE N N 177 121.650 121.650 125.706 -4.056 25768 10844 1 12 . 1 1 177 177 ILE C C 177 174.990 174.990 175.017 -0.027 25768 10845 1 12 . 1 1 177 177 ILE CA C 177 61.570 61.570 61.040 0.530 25768 10846 1 12 . 1 1 177 177 ILE CB C 177 39.100 39.100 39.587 -0.487 25768 10847 1 12 . 1 1 177 177 ILE H H 177 7.960 7.960 8.353 -0.393 25768 10848 1 12 . 1 1 178 178 ASN N N 178 127.040 127.040 126.741 0.299 25768 10849 1 12 . 1 1 178 178 ASN C C 178 179.160 179.160 174.995 4.165 25768 10850 1 12 . 1 1 178 178 ASN CA C 178 55.100 55.100 53.197 1.903 25768 10851 1 12 . 1 1 178 178 ASN CB C 178 41.300 41.300 38.904 2.396 25768 10852 1 12 . 1 1 178 178 ASN H H 178 7.850 7.850 8.748 -0.898 25768 10853 1 12 . 1 1 180 180 PRO C C 180 177.520 177.520 176.086 1.434 25768 10854 1 12 . 1 1 180 180 PRO CA C 180 63.980 63.980 63.348 0.632 25768 10855 1 12 . 1 1 180 180 PRO CB C 180 32.190 32.190 31.361 0.829 25768 10856 1 12 . 1 1 181 181 SER N N 181 115.600 115.600 119.115 -3.515 25768 10857 1 12 . 1 1 181 181 SER C C 181 174.710 174.710 173.741 0.969 25768 10858 1 12 . 1 1 181 181 SER CA C 181 58.900 58.900 58.694 0.206 25768 10859 1 12 . 1 1 181 181 SER CB C 181 64.070 64.070 64.210 -0.140 25768 10860 1 12 . 1 1 181 181 SER H H 181 8.260 8.260 8.835 -0.575 25768 10861 1 12 . 1 1 182 182 ALA N N 182 125.880 125.880 122.427 3.453 25768 10862 1 12 . 1 1 182 182 ALA C C 182 177.560 177.560 175.735 1.825 25768 10863 1 12 . 1 1 182 182 ALA CA C 182 53.090 53.090 51.894 1.196 25768 10864 1 12 . 1 1 182 182 ALA CB C 182 19.310 19.310 19.947 -0.637 25768 10865 1 12 . 1 1 182 182 ALA H H 182 8.130 8.130 7.948 0.182 25768 10866 1 12 . 1 1 183 183 LEU N N 183 119.980 119.980 122.795 -2.815 25768 10867 1 12 . 1 1 183 183 LEU C C 183 177.850 177.850 177.301 0.549 25768 10868 1 12 . 1 1 183 183 LEU CA C 183 55.650 55.650 54.532 1.118 25768 10869 1 12 . 1 1 183 183 LEU CB C 183 42.530 42.530 42.168 0.362 25768 10870 1 12 . 1 1 183 183 LEU H H 183 7.940 7.940 8.465 -0.525 25768 10871 1 12 . 1 1 184 184 GLY N N 184 109.250 109.250 112.370 -3.120 25768 10872 1 12 . 1 1 184 184 GLY C C 184 174.250 174.250 173.952 0.298 25768 10873 1 12 . 1 1 184 184 GLY CA C 184 45.830 45.830 44.146 1.684 25768 10874 1 12 . 1 1 184 184 GLY H H 184 8.150 8.150 8.366 -0.216 25768 10875 1 12 . 1 1 185 185 VAL N N 185 118.830 118.830 118.657 0.173 25768 10876 1 12 . 1 1 185 185 VAL C C 185 175.890 175.890 174.890 1.000 25768 10877 1 12 . 1 1 185 185 VAL CA C 185 62.740 62.740 61.335 1.405 25768 10878 1 12 . 1 1 185 185 VAL CB C 185 32.770 32.770 32.534 0.236 25768 10879 1 12 . 1 1 185 185 VAL H H 185 7.760 7.760 8.170 -0.410 25768 10880 1 12 . 1 1 186 186 ASN N N 186 121.850 121.850 122.121 -0.271 25768 10881 1 12 . 1 1 186 186 ASN C C 186 174.970 174.970 174.700 0.270 25768 10882 1 12 . 1 1 186 186 ASN CA C 186 53.590 53.590 52.864 0.726 25768 10883 1 12 . 1 1 186 186 ASN CB C 186 39.160 39.160 39.772 -0.612 25768 10884 1 12 . 1 1 186 186 ASN H H 186 8.380 8.380 8.478 -0.098 25768 10885 1 12 . 1 1 187 187 LYS N N 187 122.120 122.120 120.299 1.821 25768 10886 1 12 . 1 1 187 187 LYS C C 187 176.490 176.490 175.333 1.157 25768 10887 1 12 . 1 1 187 187 LYS CA C 187 56.750 56.750 56.870 -0.120 25768 10888 1 12 . 1 1 187 187 LYS CB C 187 33.250 33.250 32.445 0.805 25768 10889 1 12 . 1 1 187 187 LYS H H 187 8.140 8.140 8.454 -0.314 25768 10890 1 12 . 1 1 188 188 THR N N 188 115.250 115.250 116.269 -1.019 25768 10891 1 12 . 1 1 188 188 THR C C 188 174.250 174.250 174.453 -0.203 25768 10892 1 12 . 1 1 188 188 THR CA C 188 62.360 62.360 62.193 0.167 25768 10893 1 12 . 1 1 188 188 THR CB C 188 70.280 70.280 69.320 0.960 25768 10894 1 12 . 1 1 188 188 THR H H 188 8.100 8.100 8.254 -0.154 25768 10895 1 12 . 1 1 189 189 LYS N N 189 123.780 123.780 126.601 -2.821 25768 10896 1 12 . 1 1 189 189 LYS C C 189 176.090 176.090 176.024 0.066 25768 10897 1 12 . 1 1 189 189 LYS CA C 189 56.590 56.590 55.684 0.906 25768 10898 1 12 . 1 1 189 189 LYS CB C 189 33.350 33.350 33.175 0.175 25768 10899 1 12 . 1 1 189 189 LYS H H 189 8.110 8.110 8.422 -0.312 25768 10900 1 12 . 1 1 190 190 VAL N N 190 120.920 120.920 118.743 2.177 25768 10901 1 12 . 1 1 190 190 VAL C C 190 175.590 175.590 176.755 -1.165 25768 10902 1 12 . 1 1 190 190 VAL CA C 190 62.400 62.400 62.249 0.151 25768 10903 1 12 . 1 1 190 190 VAL CB C 190 32.990 32.990 32.776 0.214 25768 10904 1 12 . 1 1 190 190 VAL H H 190 8.040 8.040 8.550 -0.510 25768 10905 1 12 . 1 1 191 191 ASP N N 191 123.790 123.790 122.465 1.325 25768 10906 1 12 . 1 1 191 191 ASP C C 191 175.750 175.750 177.598 -1.848 25768 10907 1 12 . 1 1 191 191 ASP CA C 191 54.650 54.650 56.636 -1.986 25768 10908 1 12 . 1 1 191 191 ASP CB C 191 41.450 41.450 41.406 0.044 25768 10909 1 12 . 1 1 191 191 ASP H H 191 8.240 8.240 8.417 -0.177 25768 10910 1 12 . 1 1 192 192 VAL N N 192 118.850 118.850 120.397 -1.547 25768 10911 1 12 . 1 1 192 192 VAL C C 192 175.380 175.380 175.188 0.192 25768 10912 1 12 . 1 1 192 192 VAL CA C 192 62.110 62.110 61.179 0.931 25768 10913 1 12 . 1 1 192 192 VAL CB C 192 33.290 33.290 31.114 2.176 25768 10914 1 12 . 1 1 192 192 VAL H H 192 7.860 7.860 7.922 -0.062 25768 10915 1 12 . 1 1 193 193 ASP N N 193 124.190 124.190 123.720 0.470 25768 10916 1 12 . 1 1 193 193 ASP C C 193 175.630 175.630 175.704 -0.074 25768 10917 1 12 . 1 1 193 193 ASP CA C 193 54.540 54.540 55.978 -1.438 25768 10918 1 12 . 1 1 193 193 ASP CB C 193 41.410 41.410 41.439 -0.029 25768 10919 1 12 . 1 1 193 193 ASP H H 193 8.310 8.310 8.299 0.011 25768 10920 1 12 . 1 1 194 194 VAL N N 194 119.580 119.580 111.814 7.766 25768 10921 1 12 . 1 1 194 194 VAL C C 194 174.950 174.950 173.761 1.189 25768 10922 1 12 . 1 1 194 194 VAL CA C 194 61.770 61.770 60.393 1.377 25768 10923 1 12 . 1 1 194 194 VAL CB C 194 33.680 33.680 34.760 -1.080 25768 10924 1 12 . 1 1 194 194 VAL H H 194 7.890 7.890 7.207 0.683 25768 10925 1 12 . 1 1 195 195 ASP N N 195 125.660 125.660 123.474 2.186 25768 10926 1 12 . 1 1 195 195 ASP C C 195 174.290 174.290 175.494 -1.204 25768 10927 1 12 . 1 1 195 195 ASP CA C 195 51.940 51.940 52.389 -0.449 25768 10928 1 12 . 1 1 195 195 ASP CB C 195 40.950 40.950 41.917 -0.967 25768 10929 1 12 . 1 1 195 195 ASP H H 195 8.410 8.410 8.425 -0.015 25768 10930 1 12 . 1 1 198 198 VAL C C 198 173.940 173.940 174.743 -0.803 25768 10931 1 12 . 1 1 198 198 VAL CA C 198 61.270 61.270 61.515 -0.245 25768 10932 1 12 . 1 1 198 198 VAL CB C 198 35.910 35.910 33.290 2.620 25768 10933 1 12 . 1 1 199 199 TYR N N 199 123.780 123.780 127.207 -3.427 25768 10934 1 12 . 1 1 199 199 TYR C C 199 174.150 174.150 174.630 -0.480 25768 10935 1 12 . 1 1 199 199 TYR CA C 199 56.220 56.220 56.960 -0.740 25768 10936 1 12 . 1 1 199 199 TYR CB C 199 41.660 41.660 40.672 0.988 25768 10937 1 12 . 1 1 199 199 TYR H H 199 8.540 8.540 8.586 -0.046 25768 10938 1 12 . 1 1 200 200 MET N N 200 123.920 123.920 125.134 -1.214 25768 10939 1 12 . 1 1 200 200 MET C C 200 173.810 173.810 174.358 -0.548 25768 10940 1 12 . 1 1 200 200 MET CA C 200 54.710 54.710 53.857 0.853 25768 10941 1 12 . 1 1 200 200 MET CB C 200 37.110 37.110 33.676 3.434 25768 10942 1 12 . 1 1 200 200 MET H H 200 9.130 9.130 8.404 0.726 25768 10943 1 12 . 1 1 201 201 ILE N N 201 123.670 123.670 122.377 1.293 25768 10944 1 12 . 1 1 201 201 ILE C C 201 174.030 174.030 174.822 -0.792 25768 10945 1 12 . 1 1 201 201 ILE CA C 201 59.820 59.820 59.903 -0.083 25768 10946 1 12 . 1 1 201 201 ILE CB C 201 41.720 41.720 42.275 -0.555 25768 10947 1 12 . 1 1 201 201 ILE H H 201 8.030 8.030 8.130 -0.100 25768 10948 1 12 . 1 1 202 202 GLY N N 202 112.910 112.910 110.855 2.055 25768 10949 1 12 . 1 1 202 202 GLY C C 202 170.280 170.280 171.594 -1.314 25768 10950 1 12 . 1 1 202 202 GLY CA C 202 46.800 46.800 45.520 1.280 25768 10951 1 12 . 1 1 202 202 GLY H H 202 8.580 8.580 8.086 0.494 25768 10952 1 12 . 1 1 203 203 PHE N N 203 116.240 116.240 115.183 1.057 25768 10953 1 12 . 1 1 203 203 PHE C C 203 173.940 173.940 173.267 0.673 25768 10954 1 12 . 1 1 203 203 PHE CA C 203 55.890 55.890 55.215 0.675 25768 10955 1 12 . 1 1 203 203 PHE CB C 203 45.060 45.060 40.955 4.105 25768 10956 1 12 . 1 1 203 203 PHE H H 203 8.620 8.620 7.483 1.137 25768 10957 1 12 . 1 1 204 204 GLY N N 204 105.610 105.610 105.678 -0.068 25768 10958 1 12 . 1 1 204 204 GLY C C 204 171.190 171.190 171.493 -0.303 25768 10959 1 12 . 1 1 204 204 GLY CA C 204 46.720 46.720 44.973 1.747 25768 10960 1 12 . 1 1 204 204 GLY H H 204 8.960 8.960 8.757 0.203 25768 10961 1 12 . 1 1 205 205 TYR N N 205 121.160 121.160 120.503 0.657 25768 10962 1 12 . 1 1 205 205 TYR C C 205 173.030 173.030 173.480 -0.450 25768 10963 1 12 . 1 1 205 205 TYR CA C 205 57.190 57.190 56.983 0.207 25768 10964 1 12 . 1 1 205 205 TYR CB C 205 44.400 44.400 43.086 1.314 25768 10965 1 12 . 1 1 205 205 TYR H H 205 9.380 9.380 8.716 0.664 25768 10966 1 12 . 1 1 206 206 LYS N N 206 126.970 126.970 125.159 1.811 25768 10967 1 12 . 1 1 206 206 LYS C C 206 174.210 174.210 174.964 -0.754 25768 10968 1 12 . 1 1 206 206 LYS CA C 206 54.770 54.770 56.242 -1.472 25768 10969 1 12 . 1 1 206 206 LYS CB C 206 34.440 34.440 33.376 1.064 25768 10970 1 12 . 1 1 206 206 LYS H H 206 8.380 8.380 8.417 -0.037 25768 10971 1 12 . 1 1 207 207 PHE N N 207 126.330 126.330 124.579 1.751 25768 10972 1 12 . 1 1 207 207 PHE C C 207 175.020 175.020 174.574 0.446 25768 10973 1 12 . 1 1 207 207 PHE CA C 207 58.170 58.170 57.800 0.370 25768 10974 1 12 . 1 1 207 207 PHE CB C 207 40.920 40.920 40.818 0.102 25768 10975 1 12 . 1 1 207 207 PHE H H 207 9.290 9.290 8.242 1.048 25768 10976 1 12 . 1 1 208 208 LEU N N 208 122.740 122.740 122.611 0.129 25768 10977 1 12 . 1 1 208 208 LEU C C 208 176.510 176.510 175.817 0.693 25768 10978 1 12 . 1 1 208 208 LEU CA C 208 54.910 54.910 53.638 1.272 25768 10979 1 12 . 1 1 208 208 LEU CB C 208 43.830 43.830 45.383 -1.553 25768 10980 1 12 . 1 1 208 208 LEU H H 208 8.310 8.310 8.434 -0.124 25768 10981 1 13 . 1 1 2 2 HIS C C 2 175.310 175.310 175.028 0.282 25768 10982 1 13 . 1 1 3 3 LYS N N 3 122.080 122.080 121.810 0.270 25768 10983 1 13 . 1 1 3 3 LYS C C 3 173.490 173.490 175.094 -1.604 25768 10984 1 13 . 1 1 3 3 LYS CA C 3 55.050 55.050 55.574 -0.524 25768 10985 1 13 . 1 1 3 3 LYS CB C 3 35.380 35.380 35.670 -0.290 25768 10986 1 13 . 1 1 3 3 LYS H H 3 8.620 8.620 8.580 0.040 25768 10987 1 13 . 1 1 4 4 ALA N N 4 120.860 120.860 124.699 -3.839 25768 10988 1 13 . 1 1 4 4 ALA C C 4 178.190 178.190 178.114 0.076 25768 10989 1 13 . 1 1 4 4 ALA CA C 4 53.480 53.480 52.572 0.908 25768 10990 1 13 . 1 1 4 4 ALA CB C 4 18.140 18.140 18.542 -0.402 25768 10991 1 13 . 1 1 4 4 ALA H H 4 8.580 8.580 8.447 0.133 25768 10992 1 13 . 1 1 5 5 GLY N N 5 112.890 112.890 112.282 0.608 25768 10993 1 13 . 1 1 5 5 GLY C C 5 173.830 173.830 173.997 -0.167 25768 10994 1 13 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.723 0.157 25768 10995 1 13 . 1 1 5 5 GLY H H 5 9.210 9.210 8.971 0.239 25768 10996 1 13 . 1 1 6 6 ASP N N 6 121.590 121.590 120.565 1.025 25768 10997 1 13 . 1 1 6 6 ASP C C 6 174.380 174.380 174.519 -0.139 25768 10998 1 13 . 1 1 6 6 ASP CA C 6 55.790 55.790 54.726 1.064 25768 10999 1 13 . 1 1 6 6 ASP CB C 6 41.760 41.760 41.888 -0.128 25768 11000 1 13 . 1 1 6 6 ASP H H 6 7.620 7.620 7.522 0.098 25768 11001 1 13 . 1 1 7 7 PHE N N 7 120.860 120.860 120.245 0.615 25768 11002 1 13 . 1 1 7 7 PHE C C 7 174.050 174.050 174.611 -0.561 25768 11003 1 13 . 1 1 7 7 PHE CA C 7 56.110 56.110 57.305 -1.195 25768 11004 1 13 . 1 1 7 7 PHE CB C 7 42.550 42.550 42.894 -0.344 25768 11005 1 13 . 1 1 7 7 PHE H H 7 8.250 8.250 8.669 -0.419 25768 11006 1 13 . 1 1 8 8 ILE N N 8 127.950 127.950 122.071 5.879 25768 11007 1 13 . 1 1 8 8 ILE C C 8 174.000 174.000 174.352 -0.352 25768 11008 1 13 . 1 1 8 8 ILE CA C 8 61.160 61.160 60.445 0.715 25768 11009 1 13 . 1 1 8 8 ILE CB C 8 42.660 42.660 42.541 0.119 25768 11010 1 13 . 1 1 8 8 ILE H H 8 9.230 9.230 8.341 0.889 25768 11011 1 13 . 1 1 9 9 ILE N N 9 125.380 125.380 120.935 4.445 25768 11012 1 13 . 1 1 9 9 ILE C C 9 173.630 173.630 174.074 -0.444 25768 11013 1 13 . 1 1 9 9 ILE CA C 9 59.600 59.600 59.043 0.557 25768 11014 1 13 . 1 1 9 9 ILE CB C 9 41.180 41.180 38.525 2.655 25768 11015 1 13 . 1 1 9 9 ILE H H 9 8.580 8.580 8.945 -0.365 25768 11016 1 13 . 1 1 10 10 ARG N N 10 124.950 124.950 125.439 -0.489 25768 11017 1 13 . 1 1 10 10 ARG C C 10 175.030 175.030 174.486 0.544 25768 11018 1 13 . 1 1 10 10 ARG CA C 10 53.920 53.920 54.819 -0.899 25768 11019 1 13 . 1 1 10 10 ARG CB C 10 31.880 31.880 35.195 -3.315 25768 11020 1 13 . 1 1 10 10 ARG H H 10 9.230 9.230 8.922 0.308 25768 11021 1 13 . 1 1 11 11 GLY N N 11 105.650 105.650 106.450 -0.800 25768 11022 1 13 . 1 1 11 11 GLY C C 11 172.090 172.090 171.619 0.471 25768 11023 1 13 . 1 1 11 11 GLY CA C 11 44.460 44.460 45.277 -0.817 25768 11024 1 13 . 1 1 11 11 GLY H H 11 8.780 8.780 7.760 1.020 25768 11025 1 13 . 1 1 12 12 GLY N N 12 107.800 107.800 108.024 -0.224 25768 11026 1 13 . 1 1 12 12 GLY C C 12 171.460 171.460 172.006 -0.546 25768 11027 1 13 . 1 1 12 12 GLY CA C 12 46.630 46.630 44.346 2.284 25768 11028 1 13 . 1 1 12 12 GLY H H 12 8.510 8.510 7.470 1.040 25768 11029 1 13 . 1 1 13 13 PHE N N 13 119.900 119.900 119.076 0.824 25768 11030 1 13 . 1 1 13 13 PHE C C 13 174.190 174.190 173.409 0.781 25768 11031 1 13 . 1 1 13 13 PHE CA C 13 56.340 56.340 56.475 -0.135 25768 11032 1 13 . 1 1 13 13 PHE CB C 13 41.090 41.090 43.828 -2.738 25768 11033 1 13 . 1 1 13 13 PHE H H 13 8.610 8.610 8.879 -0.269 25768 11034 1 13 . 1 1 14 14 ALA N N 14 128.030 128.030 124.189 3.841 25768 11035 1 13 . 1 1 14 14 ALA C C 14 176.560 176.560 176.726 -0.166 25768 11036 1 13 . 1 1 14 14 ALA CA C 14 49.940 49.940 50.286 -0.346 25768 11037 1 13 . 1 1 14 14 ALA CB C 14 20.360 20.360 20.752 -0.392 25768 11038 1 13 . 1 1 14 14 ALA H H 14 9.220 9.220 7.890 1.330 25768 11039 1 13 . 1 1 15 15 THR N N 15 118.620 118.620 119.692 -1.072 25768 11040 1 13 . 1 1 15 15 THR CA C 15 61.440 61.440 62.146 -0.706 25768 11041 1 13 . 1 1 15 15 THR CB C 15 71.370 71.370 69.071 2.299 25768 11042 1 13 . 1 1 15 15 THR H H 15 9.220 9.220 7.888 1.332 25768 11043 1 13 . 1 1 18 18 PRO C C 18 176.690 176.690 175.921 0.769 25768 11044 1 13 . 1 1 18 18 PRO CA C 18 63.610 63.610 63.387 0.223 25768 11045 1 13 . 1 1 18 18 PRO CB C 18 32.440 32.440 30.685 1.755 25768 11046 1 13 . 1 1 19 19 ASP N N 19 120.320 120.320 122.559 -2.239 25768 11047 1 13 . 1 1 19 19 ASP C C 19 175.950 175.950 175.889 0.061 25768 11048 1 13 . 1 1 19 19 ASP CA C 19 54.710 54.710 54.026 0.684 25768 11049 1 13 . 1 1 19 19 ASP CB C 19 41.450 41.450 42.015 -0.565 25768 11050 1 13 . 1 1 19 19 ASP H H 19 8.330 8.330 8.214 0.116 25768 11051 1 13 . 1 1 20 20 ASP N N 20 121.990 121.990 119.613 2.377 25768 11052 1 13 . 1 1 20 20 ASP C C 20 176.760 176.760 176.360 0.400 25768 11053 1 13 . 1 1 20 20 ASP CA C 20 54.470 54.470 54.915 -0.445 25768 11054 1 13 . 1 1 20 20 ASP CB C 20 41.310 41.310 41.289 0.021 25768 11055 1 13 . 1 1 20 20 ASP H H 20 8.240 8.240 8.252 -0.012 25768 11056 1 13 . 1 1 21 21 SER N N 21 117.050 117.050 113.997 3.053 25768 11057 1 13 . 1 1 21 21 SER C C 21 175.170 175.170 173.462 1.708 25768 11058 1 13 . 1 1 21 21 SER CA C 21 59.490 59.490 58.006 1.484 25768 11059 1 13 . 1 1 21 21 SER CB C 21 64.080 64.080 63.468 0.612 25768 11060 1 13 . 1 1 21 21 SER H H 21 8.360 8.360 8.245 0.115 25768 11061 1 13 . 1 1 22 22 SER N N 22 117.820 117.820 119.517 -1.697 25768 11062 1 13 . 1 1 22 22 SER C C 22 174.940 174.940 173.121 1.819 25768 11063 1 13 . 1 1 22 22 SER CA C 22 59.160 59.160 58.161 0.999 25768 11064 1 13 . 1 1 22 22 SER CB C 22 64.110 64.110 63.621 0.489 25768 11065 1 13 . 1 1 22 22 SER H H 22 8.310 8.310 8.299 0.011 25768 11066 1 13 . 1 1 23 23 SER N N 23 117.660 117.660 115.705 1.955 25768 11067 1 13 . 1 1 23 23 SER C C 23 174.340 174.340 172.457 1.883 25768 11068 1 13 . 1 1 23 23 SER CA C 23 59.050 59.050 58.633 0.417 25768 11069 1 13 . 1 1 23 23 SER CB C 23 64.210 64.210 63.515 0.695 25768 11070 1 13 . 1 1 23 23 SER H H 23 8.120 8.120 8.164 -0.044 25768 11071 1 13 . 1 1 24 24 ASP N N 24 122.590 122.590 121.762 0.828 25768 11072 1 13 . 1 1 24 24 ASP C C 24 176.250 176.250 174.443 1.807 25768 11073 1 13 . 1 1 24 24 ASP CA C 24 54.910 54.910 54.654 0.256 25768 11074 1 13 . 1 1 24 24 ASP CB C 24 41.270 41.270 42.206 -0.936 25768 11075 1 13 . 1 1 24 24 ASP H H 24 8.230 8.230 8.374 -0.144 25768 11076 1 13 . 1 1 25 25 ILE N N 25 120.650 120.650 121.045 -0.395 25768 11077 1 13 . 1 1 25 25 ILE C C 25 176.190 176.190 174.792 1.398 25768 11078 1 13 . 1 1 25 25 ILE CA C 25 61.880 61.880 61.254 0.626 25768 11079 1 13 . 1 1 25 25 ILE CB C 25 38.730 38.730 38.372 0.358 25768 11080 1 13 . 1 1 25 25 ILE H H 25 7.860 7.860 8.312 -0.452 25768 11081 1 13 . 1 1 26 26 LYS N N 26 124.420 124.420 120.868 3.552 25768 11082 1 13 . 1 1 26 26 LYS C C 26 176.640 176.640 175.452 1.188 25768 11083 1 13 . 1 1 26 26 LYS CA C 26 56.520 56.520 55.473 1.047 25768 11084 1 13 . 1 1 26 26 LYS CB C 26 32.890 32.890 36.026 -3.136 25768 11085 1 13 . 1 1 26 26 LYS H H 26 8.140 8.140 7.790 0.350 25768 11086 1 13 . 1 1 27 27 LEU N N 27 123.120 123.120 123.625 -0.505 25768 11087 1 13 . 1 1 27 27 LEU C C 27 177.110 177.110 176.100 1.010 25768 11088 1 13 . 1 1 27 27 LEU CA C 27 55.590 55.590 55.952 -0.362 25768 11089 1 13 . 1 1 27 27 LEU CB C 27 42.500 42.500 41.580 0.920 25768 11090 1 13 . 1 1 27 27 LEU H H 27 8.080 8.080 8.498 -0.418 25768 11091 1 13 . 1 1 28 28 ASP N N 28 120.850 120.850 123.208 -2.358 25768 11092 1 13 . 1 1 28 28 ASP C C 28 176.960 176.960 176.440 0.520 25768 11093 1 13 . 1 1 28 28 ASP CA C 28 54.800 54.800 54.208 0.592 25768 11094 1 13 . 1 1 28 28 ASP CB C 28 41.380 41.380 42.173 -0.793 25768 11095 1 13 . 1 1 28 28 ASP H H 28 8.180 8.180 8.420 -0.240 25768 11096 1 13 . 1 1 29 29 GLY N N 29 109.800 109.800 109.086 0.714 25768 11097 1 13 . 1 1 29 29 GLY C C 29 174.370 174.370 173.576 0.794 25768 11098 1 13 . 1 1 29 29 GLY CA C 29 46.150 46.150 45.412 0.738 25768 11099 1 13 . 1 1 29 29 GLY H H 29 8.230 8.230 8.206 0.024 25768 11100 1 13 . 1 1 30 30 ALA N N 30 123.880 123.880 124.100 -0.220 25768 11101 1 13 . 1 1 30 30 ALA C C 30 178.040 178.040 176.441 1.599 25768 11102 1 13 . 1 1 30 30 ALA CA C 30 53.140 53.140 52.148 0.992 25768 11103 1 13 . 1 1 30 30 ALA CB C 30 19.350 19.350 19.492 -0.142 25768 11104 1 13 . 1 1 30 30 ALA H H 30 8.040 8.040 7.829 0.211 25768 11105 1 13 . 1 1 31 31 LYS N N 31 119.800 119.800 122.351 -2.551 25768 11106 1 13 . 1 1 31 31 LYS C C 31 176.770 176.770 175.921 0.849 25768 11107 1 13 . 1 1 31 31 LYS CA C 31 56.870 56.870 56.303 0.567 25768 11108 1 13 . 1 1 31 31 LYS CB C 31 32.980 32.980 31.662 1.318 25768 11109 1 13 . 1 1 31 31 LYS H H 31 8.060 8.060 8.355 -0.295 25768 11110 1 13 . 1 1 32 32 GLN N N 32 120.930 120.930 120.611 0.319 25768 11111 1 13 . 1 1 32 32 GLN C C 32 176.000 176.000 174.761 1.239 25768 11112 1 13 . 1 1 32 32 GLN CA C 32 56.280 56.280 55.875 0.405 25768 11113 1 13 . 1 1 32 32 GLN CB C 32 29.580 29.580 29.600 -0.020 25768 11114 1 13 . 1 1 32 32 GLN H H 32 8.170 8.170 8.340 -0.170 25768 11115 1 13 . 1 1 33 33 ARG N N 33 122.370 122.370 122.817 -0.447 25768 11116 1 13 . 1 1 33 33 ARG C C 33 176.820 176.820 175.358 1.462 25768 11117 1 13 . 1 1 33 33 ARG CA C 33 56.680 56.680 55.930 0.750 25768 11118 1 13 . 1 1 33 33 ARG CB C 33 31.040 31.040 31.332 -0.292 25768 11119 1 13 . 1 1 33 33 ARG H H 33 8.270 8.270 8.567 -0.297 25768 11120 1 13 . 1 1 34 34 GLY N N 34 110.210 110.210 111.127 -0.917 25768 11121 1 13 . 1 1 34 34 GLY C C 34 174.280 174.280 173.173 1.107 25768 11122 1 13 . 1 1 34 34 GLY CA C 34 45.770 45.770 45.278 0.492 25768 11123 1 13 . 1 1 34 34 GLY H H 34 8.360 8.360 8.297 0.063 25768 11124 1 13 . 1 1 35 35 THR N N 35 114.100 114.100 115.479 -1.379 25768 11125 1 13 . 1 1 35 35 THR C C 35 174.550 174.550 173.867 0.683 25768 11126 1 13 . 1 1 35 35 THR CA C 35 62.140 62.140 62.599 -0.459 25768 11127 1 13 . 1 1 35 35 THR CB C 35 70.330 70.330 68.704 1.626 25768 11128 1 13 . 1 1 35 35 THR H H 35 7.970 7.970 7.954 0.016 25768 11129 1 13 . 1 1 36 36 LYS N N 36 123.850 123.850 121.745 2.105 25768 11130 1 13 . 1 1 36 36 LYS C C 36 176.040 176.040 175.381 0.659 25768 11131 1 13 . 1 1 36 36 LYS CA C 36 56.600 56.600 56.876 -0.276 25768 11132 1 13 . 1 1 36 36 LYS CB C 36 33.280 33.280 31.917 1.363 25768 11133 1 13 . 1 1 36 36 LYS H H 36 8.230 8.230 8.449 -0.219 25768 11134 1 13 . 1 1 37 37 ALA N N 37 125.650 125.650 125.305 0.345 25768 11135 1 13 . 1 1 37 37 ALA C C 37 177.570 177.570 177.654 -0.084 25768 11136 1 13 . 1 1 37 37 ALA CA C 37 52.860 52.860 53.316 -0.456 25768 11137 1 13 . 1 1 37 37 ALA CB C 37 19.610 19.610 19.630 -0.020 25768 11138 1 13 . 1 1 37 37 ALA H H 37 8.290 8.290 8.344 -0.054 25768 11139 1 13 . 1 1 38 38 THR N N 38 113.350 113.350 112.403 0.947 25768 11140 1 13 . 1 1 38 38 THR C C 38 174.540 174.540 174.519 0.021 25768 11141 1 13 . 1 1 38 38 THR CA C 38 62.010 62.010 62.657 -0.647 25768 11142 1 13 . 1 1 38 38 THR CB C 38 70.350 70.350 69.413 0.937 25768 11143 1 13 . 1 1 38 38 THR H H 38 7.970 7.970 7.727 0.243 25768 11144 1 13 . 1 1 39 39 VAL N N 39 120.790 120.790 119.670 1.120 25768 11145 1 13 . 1 1 39 39 VAL C C 39 175.620 175.620 175.410 0.210 25768 11146 1 13 . 1 1 39 39 VAL CA C 39 62.470 62.470 61.417 1.053 25768 11147 1 13 . 1 1 39 39 VAL CB C 39 32.940 32.940 32.153 0.787 25768 11148 1 13 . 1 1 39 39 VAL H H 39 8.020 8.020 8.345 -0.325 25768 11149 1 13 . 1 1 40 40 ASP N N 40 123.690 123.690 122.176 1.514 25768 11150 1 13 . 1 1 40 40 ASP C C 40 176.190 176.190 176.163 0.027 25768 11151 1 13 . 1 1 40 40 ASP CA C 40 54.780 54.780 54.126 0.654 25768 11152 1 13 . 1 1 40 40 ASP CB C 40 41.590 41.590 40.310 1.280 25768 11153 1 13 . 1 1 40 40 ASP H H 40 8.310 8.310 8.332 -0.022 25768 11154 1 13 . 1 1 41 41 SER N N 41 115.470 115.470 117.838 -2.368 25768 11155 1 13 . 1 1 41 41 SER C C 41 174.170 174.170 174.518 -0.348 25768 11156 1 13 . 1 1 41 41 SER CA C 41 59.000 59.000 59.437 -0.437 25768 11157 1 13 . 1 1 41 41 SER CB C 41 64.420 64.420 64.130 0.290 25768 11158 1 13 . 1 1 41 41 SER H H 41 8.130 8.130 8.145 -0.015 25768 11159 1 13 . 1 1 42 42 ASP N N 42 122.430 122.430 122.645 -0.215 25768 11160 1 13 . 1 1 42 42 ASP C C 42 175.740 175.740 175.367 0.373 25768 11161 1 13 . 1 1 42 42 ASP CA C 42 54.780 54.780 53.783 0.997 25768 11162 1 13 . 1 1 42 42 ASP CB C 42 41.620 41.620 40.758 0.862 25768 11163 1 13 . 1 1 42 42 ASP H H 42 8.410 8.410 8.270 0.140 25768 11164 1 13 . 1 1 43 43 THR N N 43 117.580 117.580 117.105 0.475 25768 11165 1 13 . 1 1 43 43 THR C C 43 173.630 173.630 174.773 -1.143 25768 11166 1 13 . 1 1 43 43 THR CA C 43 63.120 63.120 61.505 1.615 25768 11167 1 13 . 1 1 43 43 THR CB C 43 70.650 70.650 70.043 0.607 25768 11168 1 13 . 1 1 43 43 THR H H 43 8.010 8.010 7.801 0.209 25768 11169 1 13 . 1 1 44 44 GLN N N 44 125.420 125.420 124.439 0.981 25768 11170 1 13 . 1 1 44 44 GLN C C 44 174.080 174.080 175.434 -1.354 25768 11171 1 13 . 1 1 44 44 GLN CA C 44 55.110 55.110 54.772 0.339 25768 11172 1 13 . 1 1 44 44 GLN CB C 44 31.570 31.570 29.196 2.374 25768 11173 1 13 . 1 1 44 44 GLN H H 44 9.260 9.260 8.541 0.719 25768 11174 1 13 . 1 1 45 45 LEU N N 45 124.190 124.190 126.230 -2.040 25768 11175 1 13 . 1 1 45 45 LEU C C 45 175.970 175.970 176.684 -0.714 25768 11176 1 13 . 1 1 45 45 LEU CA C 45 54.690 54.690 55.791 -1.101 25768 11177 1 13 . 1 1 45 45 LEU CB C 45 42.270 42.270 42.889 -0.619 25768 11178 1 13 . 1 1 45 45 LEU H H 45 8.550 8.550 7.867 0.683 25768 11179 1 13 . 1 1 46 46 GLY N N 46 113.310 113.310 111.890 1.420 25768 11180 1 13 . 1 1 46 46 GLY C C 46 171.180 171.180 173.246 -2.066 25768 11181 1 13 . 1 1 46 46 GLY CA C 46 44.400 44.400 44.193 0.207 25768 11182 1 13 . 1 1 46 46 GLY H H 46 8.810 8.810 8.038 0.772 25768 11183 1 13 . 1 1 47 47 LEU N N 47 123.890 123.890 128.451 -4.561 25768 11184 1 13 . 1 1 47 47 LEU C C 47 175.400 175.400 175.648 -0.248 25768 11185 1 13 . 1 1 47 47 LEU CA C 47 53.750 53.750 54.111 -0.361 25768 11186 1 13 . 1 1 47 47 LEU CB C 47 46.800 46.800 43.896 2.904 25768 11187 1 13 . 1 1 47 47 LEU H H 47 8.590 8.590 8.569 0.021 25768 11188 1 13 . 1 1 48 48 THR N N 48 111.210 111.210 118.665 -7.455 25768 11189 1 13 . 1 1 48 48 THR C C 48 172.520 172.520 173.209 -0.689 25768 11190 1 13 . 1 1 48 48 THR CA C 48 58.950 58.950 60.705 -1.755 25768 11191 1 13 . 1 1 48 48 THR CB C 48 72.360 72.360 71.661 0.699 25768 11192 1 13 . 1 1 48 48 THR H H 48 8.620 8.620 8.634 -0.014 25768 11193 1 13 . 1 1 49 49 PHE N N 49 118.810 118.810 124.893 -6.083 25768 11194 1 13 . 1 1 49 49 PHE C C 49 174.700 174.700 175.597 -0.897 25768 11195 1 13 . 1 1 49 49 PHE CA C 49 55.080 55.080 56.200 -1.120 25768 11196 1 13 . 1 1 49 49 PHE CB C 49 42.360 42.360 40.941 1.419 25768 11197 1 13 . 1 1 49 49 PHE H H 49 8.410 8.410 8.898 -0.488 25768 11198 1 13 . 1 1 50 50 THR N N 50 121.230 121.230 120.520 0.710 25768 11199 1 13 . 1 1 50 50 THR C C 50 173.250 173.250 173.226 0.024 25768 11200 1 13 . 1 1 50 50 THR CA C 50 62.740 62.740 62.404 0.337 25768 11201 1 13 . 1 1 50 50 THR CB C 50 73.740 73.740 69.986 3.754 25768 11202 1 13 . 1 1 50 50 THR H H 50 9.330 9.330 8.646 0.684 25768 11203 1 13 . 1 1 51 51 TYR N N 51 126.010 126.010 128.303 -2.293 25768 11204 1 13 . 1 1 51 51 TYR C C 51 174.850 174.850 174.605 0.245 25768 11205 1 13 . 1 1 51 51 TYR CA C 51 56.240 56.240 56.730 -0.489 25768 11206 1 13 . 1 1 51 51 TYR CB C 51 41.630 41.630 39.969 1.661 25768 11207 1 13 . 1 1 51 51 TYR H H 51 9.150 9.150 9.387 -0.237 25768 11208 1 13 . 1 1 52 52 MET N N 52 127.390 127.390 125.681 1.709 25768 11209 1 13 . 1 1 52 52 MET C C 52 174.490 174.490 174.942 -0.452 25768 11210 1 13 . 1 1 52 52 MET CA C 52 52.450 52.450 56.297 -3.848 25768 11211 1 13 . 1 1 52 52 MET CB C 52 28.590 28.590 32.617 -4.027 25768 11212 1 13 . 1 1 52 52 MET H H 52 7.950 7.950 8.268 -0.318 25768 11213 1 13 . 1 1 53 53 PHE N N 53 123.830 123.830 126.641 -2.811 25768 11214 1 13 . 1 1 53 53 PHE C C 53 173.720 173.720 173.797 -0.077 25768 11215 1 13 . 1 1 53 53 PHE CA C 53 57.110 57.110 57.024 0.086 25768 11216 1 13 . 1 1 53 53 PHE CB C 53 39.420 39.420 41.197 -1.777 25768 11217 1 13 . 1 1 53 53 PHE H H 53 7.720 7.720 8.400 -0.680 25768 11218 1 13 . 1 1 54 54 ALA N N 54 125.650 125.650 128.573 -2.923 25768 11219 1 13 . 1 1 54 54 ALA C C 54 175.020 175.020 175.889 -0.869 25768 11220 1 13 . 1 1 54 54 ALA CA C 54 50.740 50.740 52.929 -2.189 25768 11221 1 13 . 1 1 54 54 ALA CB C 54 22.700 22.700 18.512 4.188 25768 11222 1 13 . 1 1 54 54 ALA H H 54 8.360 8.360 8.204 0.156 25768 11223 1 13 . 1 1 55 55 ASP N N 55 118.790 118.790 121.722 -2.932 25768 11224 1 13 . 1 1 55 55 ASP C C 55 174.780 174.780 175.903 -1.123 25768 11225 1 13 . 1 1 55 55 ASP CA C 55 58.590 58.590 54.808 3.782 25768 11226 1 13 . 1 1 55 55 ASP CB C 55 40.430 40.430 40.774 -0.344 25768 11227 1 13 . 1 1 55 55 ASP H H 55 8.590 8.590 8.489 0.101 25768 11228 1 13 . 1 1 56 56 LYS N N 56 106.200 106.200 117.664 -11.464 25768 11229 1 13 . 1 1 56 56 LYS C C 56 174.940 174.940 175.723 -0.783 25768 11230 1 13 . 1 1 56 56 LYS CA C 56 55.260 55.260 56.684 -1.423 25768 11231 1 13 . 1 1 56 56 LYS CB C 56 34.510 34.510 34.956 -0.446 25768 11232 1 13 . 1 1 56 56 LYS H H 56 7.260 7.260 7.212 0.048 25768 11233 1 13 . 1 1 57 57 TRP N N 57 115.680 115.680 120.855 -5.175 25768 11234 1 13 . 1 1 57 57 TRP C C 57 173.940 173.940 175.465 -1.525 25768 11235 1 13 . 1 1 57 57 TRP CA C 57 55.410 55.410 56.816 -1.406 25768 11236 1 13 . 1 1 57 57 TRP CB C 57 34.470 34.470 32.266 2.204 25768 11237 1 13 . 1 1 57 57 TRP H H 57 6.570 6.570 8.011 -1.441 25768 11238 1 13 . 1 1 58 58 GLY N N 58 107.610 107.610 109.614 -2.004 25768 11239 1 13 . 1 1 58 58 GLY C C 58 172.730 172.730 172.172 0.558 25768 11240 1 13 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.830 -0.780 25768 11241 1 13 . 1 1 58 58 GLY H H 58 9.260 9.260 8.697 0.563 25768 11242 1 13 . 1 1 59 59 VAL N N 59 118.130 118.130 123.923 -5.793 25768 11243 1 13 . 1 1 59 59 VAL C C 59 173.000 173.000 173.741 -0.741 25768 11244 1 13 . 1 1 59 59 VAL CA C 59 59.950 59.950 60.017 -0.067 25768 11245 1 13 . 1 1 59 59 VAL CB C 59 35.170 35.170 35.239 -0.070 25768 11246 1 13 . 1 1 59 59 VAL H H 59 9.030 9.030 8.015 1.015 25768 11247 1 13 . 1 1 60 60 GLU N N 60 127.900 127.900 125.846 2.054 25768 11248 1 13 . 1 1 60 60 GLU C C 60 174.470 174.470 174.429 0.041 25768 11249 1 13 . 1 1 60 60 GLU CA C 60 52.940 52.940 54.262 -1.322 25768 11250 1 13 . 1 1 60 60 GLU CB C 60 35.100 35.100 34.749 0.350 25768 11251 1 13 . 1 1 60 60 GLU H H 60 9.440 9.440 8.674 0.766 25768 11252 1 13 . 1 1 61 61 LEU N N 61 127.410 127.410 124.039 3.371 25768 11253 1 13 . 1 1 61 61 LEU C C 61 174.950 174.950 174.828 0.122 25768 11254 1 13 . 1 1 61 61 LEU CA C 61 53.390 53.390 53.974 -0.584 25768 11255 1 13 . 1 1 61 61 LEU CB C 61 45.980 45.980 45.536 0.444 25768 11256 1 13 . 1 1 61 61 LEU H H 61 8.740 8.740 8.438 0.302 25768 11257 1 13 . 1 1 62 62 VAL N N 62 125.750 125.750 125.669 0.081 25768 11258 1 13 . 1 1 62 62 VAL C C 62 173.960 173.960 174.890 -0.930 25768 11259 1 13 . 1 1 62 62 VAL CA C 62 61.350 61.350 60.372 0.978 25768 11260 1 13 . 1 1 62 62 VAL CB C 62 34.740 34.740 34.088 0.652 25768 11261 1 13 . 1 1 62 62 VAL H H 62 8.790 8.790 8.017 0.773 25768 11262 1 13 . 1 1 63 63 ALA N N 63 127.230 127.230 125.591 1.639 25768 11263 1 13 . 1 1 63 63 ALA C C 63 173.930 173.930 175.118 -1.188 25768 11264 1 13 . 1 1 63 63 ALA CA C 63 51.140 51.140 52.130 -0.990 25768 11265 1 13 . 1 1 63 63 ALA CB C 63 22.500 22.500 21.513 0.987 25768 11266 1 13 . 1 1 63 63 ALA H H 63 8.740 8.740 8.558 0.182 25768 11267 1 13 . 1 1 64 64 ALA N N 64 120.410 120.410 125.616 -5.206 25768 11268 1 13 . 1 1 64 64 ALA C C 64 176.770 176.770 177.805 -1.035 25768 11269 1 13 . 1 1 64 64 ALA CA C 64 51.420 51.420 49.835 1.585 25768 11270 1 13 . 1 1 64 64 ALA CB C 64 22.590 22.590 21.754 0.836 25768 11271 1 13 . 1 1 64 64 ALA H H 64 8.290 8.290 8.350 -0.060 25768 11272 1 13 . 1 1 65 65 THR N N 65 116.130 116.130 114.210 1.920 25768 11273 1 13 . 1 1 65 65 THR C C 65 171.220 171.220 173.790 -2.570 25768 11274 1 13 . 1 1 65 65 THR CA C 65 58.860 58.860 60.052 -1.192 25768 11275 1 13 . 1 1 65 65 THR CB C 65 72.020 72.020 68.769 3.251 25768 11276 1 13 . 1 1 65 65 THR H H 65 8.760 8.760 8.407 0.353 25768 11277 1 13 . 1 1 66 66 PRO C C 66 176.720 176.720 176.060 0.660 25768 11278 1 13 . 1 1 66 66 PRO CA C 66 63.610 63.610 62.332 1.278 25768 11279 1 13 . 1 1 66 66 PRO CB C 66 32.550 32.550 32.361 0.188 25768 11280 1 13 . 1 1 67 67 PHE N N 67 120.360 120.360 120.633 -0.273 25768 11281 1 13 . 1 1 67 67 PHE C C 67 175.480 175.480 174.804 0.676 25768 11282 1 13 . 1 1 67 67 PHE CA C 67 58.840 58.840 57.326 1.514 25768 11283 1 13 . 1 1 67 67 PHE CB C 67 40.170 40.170 40.562 -0.392 25768 11284 1 13 . 1 1 67 67 PHE H H 67 8.590 8.590 8.355 0.235 25768 11285 1 13 . 1 1 68 68 ASN N N 68 119.030 119.030 126.847 -7.817 25768 11286 1 13 . 1 1 68 68 ASN C C 68 174.740 174.740 173.682 1.058 25768 11287 1 13 . 1 1 68 68 ASN CA C 68 53.430 53.430 53.034 0.396 25768 11288 1 13 . 1 1 68 68 ASN CB C 68 39.420 39.420 39.028 0.392 25768 11289 1 13 . 1 1 68 68 ASN H H 68 8.340 8.340 8.513 -0.173 25768 11290 1 13 . 1 1 69 69 HIS N N 69 119.590 119.590 123.556 -3.966 25768 11291 1 13 . 1 1 69 69 HIS C C 69 174.370 174.370 173.868 0.502 25768 11292 1 13 . 1 1 69 69 HIS CA C 69 55.950 55.950 54.908 1.042 25768 11293 1 13 . 1 1 69 69 HIS CB C 69 29.960 29.960 31.514 -1.554 25768 11294 1 13 . 1 1 69 69 HIS H H 69 8.350 8.350 8.531 -0.181 25768 11295 1 13 . 1 1 70 70 GLN N N 70 121.980 121.980 120.633 1.347 25768 11296 1 13 . 1 1 70 70 GLN C C 70 175.740 175.740 174.281 1.459 25768 11297 1 13 . 1 1 70 70 GLN CA C 70 56.340 56.340 55.148 1.192 25768 11298 1 13 . 1 1 70 70 GLN CB C 70 29.660 29.660 29.714 -0.054 25768 11299 1 13 . 1 1 70 70 GLN H H 70 8.350 8.350 8.504 -0.154 25768 11300 1 13 . 1 1 71 71 VAL N N 71 120.530 120.530 123.449 -2.919 25768 11301 1 13 . 1 1 71 71 VAL C C 71 175.500 175.500 174.206 1.294 25768 11302 1 13 . 1 1 71 71 VAL CA C 71 62.540 62.540 61.554 0.986 25768 11303 1 13 . 1 1 71 71 VAL CB C 71 33.090 33.090 34.256 -1.166 25768 11304 1 13 . 1 1 71 71 VAL H H 71 8.020 8.020 8.371 -0.351 25768 11305 1 13 . 1 1 72 72 ASP N N 72 123.910 123.910 126.189 -2.279 25768 11306 1 13 . 1 1 72 72 ASP C C 72 176.300 176.300 175.989 0.311 25768 11307 1 13 . 1 1 72 72 ASP CA C 72 54.340 54.340 53.818 0.522 25768 11308 1 13 . 1 1 72 72 ASP CB C 72 41.480 41.480 42.270 -0.790 25768 11309 1 13 . 1 1 72 72 ASP H H 72 8.280 8.280 8.433 -0.153 25768 11310 1 13 . 1 1 73 73 VAL N N 73 120.580 120.580 118.840 1.740 25768 11311 1 13 . 1 1 73 73 VAL C C 73 176.350 176.350 175.936 0.414 25768 11312 1 13 . 1 1 73 73 VAL CA C 73 62.970 62.970 61.760 1.210 25768 11313 1 13 . 1 1 73 73 VAL CB C 73 32.550 32.550 32.780 -0.230 25768 11314 1 13 . 1 1 73 73 VAL H H 73 7.960 7.960 8.380 -0.420 25768 11315 1 13 . 1 1 74 74 LYS N N 74 123.620 123.620 119.541 4.079 25768 11316 1 13 . 1 1 74 74 LYS C C 74 177.130 177.130 176.582 0.548 25768 11317 1 13 . 1 1 74 74 LYS CA C 74 57.060 57.060 56.461 0.599 25768 11318 1 13 . 1 1 74 74 LYS CB C 74 32.860 32.860 32.607 0.253 25768 11319 1 13 . 1 1 74 74 LYS H H 74 8.230 8.230 7.869 0.361 25768 11320 1 13 . 1 1 75 75 GLY N N 75 109.370 109.370 111.290 -1.920 25768 11321 1 13 . 1 1 75 75 GLY C C 75 174.030 174.030 173.335 0.695 25768 11322 1 13 . 1 1 75 75 GLY CA C 75 45.800 45.800 44.630 1.170 25768 11323 1 13 . 1 1 75 75 GLY H H 75 8.160 8.160 8.282 -0.122 25768 11324 1 13 . 1 1 76 76 LEU N N 76 121.660 121.660 122.827 -1.167 25768 11325 1 13 . 1 1 76 76 LEU C C 76 177.410 177.410 176.274 1.136 25768 11326 1 13 . 1 1 76 76 LEU CA C 76 55.410 55.410 54.976 0.434 25768 11327 1 13 . 1 1 76 76 LEU CB C 76 42.790 42.790 43.395 -0.605 25768 11328 1 13 . 1 1 76 76 LEU H H 76 8.030 8.030 7.880 0.150 25768 11329 1 13 . 1 1 77 77 GLY N N 77 109.330 109.330 109.559 -0.229 25768 11330 1 13 . 1 1 77 77 GLY C C 77 171.800 171.800 172.000 -0.200 25768 11331 1 13 . 1 1 77 77 GLY CA C 77 44.990 44.990 44.255 0.735 25768 11332 1 13 . 1 1 77 77 GLY H H 77 8.100 8.100 7.931 0.169 25768 11333 1 13 . 1 1 78 78 PRO C C 78 177.740 177.740 176.665 1.075 25768 11334 1 13 . 1 1 78 78 PRO CA C 78 63.890 63.890 63.180 0.710 25768 11335 1 13 . 1 1 78 78 PRO CB C 78 32.170 32.170 32.374 -0.204 25768 11336 1 13 . 1 1 79 79 GLY N N 79 109.530 109.530 108.011 1.519 25768 11337 1 13 . 1 1 79 79 GLY C C 79 174.460 174.460 174.245 0.215 25768 11338 1 13 . 1 1 79 79 GLY CA C 79 45.780 45.780 44.507 1.273 25768 11339 1 13 . 1 1 79 79 GLY H H 79 8.410 8.410 8.480 -0.070 25768 11340 1 13 . 1 1 80 80 LEU N N 80 121.880 121.880 121.055 0.825 25768 11341 1 13 . 1 1 80 80 LEU C C 80 177.100 177.100 177.312 -0.212 25768 11342 1 13 . 1 1 80 80 LEU CA C 80 55.720 55.720 56.796 -1.076 25768 11343 1 13 . 1 1 80 80 LEU CB C 80 42.580 42.580 41.937 0.643 25768 11344 1 13 . 1 1 80 80 LEU H H 80 8.010 8.010 8.846 -0.836 25768 11345 1 13 . 1 1 81 81 ASP N N 81 119.990 119.990 116.887 3.103 25768 11346 1 13 . 1 1 81 81 ASP C C 81 176.880 176.880 175.726 1.154 25768 11347 1 13 . 1 1 81 81 ASP CA C 81 54.770 54.770 53.122 1.648 25768 11348 1 13 . 1 1 81 81 ASP CB C 81 41.390 41.390 41.882 -0.492 25768 11349 1 13 . 1 1 81 81 ASP H H 81 8.220 8.220 8.145 0.075 25768 11350 1 13 . 1 1 82 82 GLY N N 82 109.270 109.270 106.279 2.991 25768 11351 1 13 . 1 1 82 82 GLY C C 82 174.190 174.190 173.099 1.091 25768 11352 1 13 . 1 1 82 82 GLY CA C 82 45.990 45.990 44.404 1.586 25768 11353 1 13 . 1 1 82 82 GLY H H 82 8.170 8.170 8.032 0.138 25768 11354 1 13 . 1 1 83 83 LYS N N 83 121.000 121.000 120.196 0.804 25768 11355 1 13 . 1 1 83 83 LYS C C 83 176.610 176.610 175.083 1.527 25768 11356 1 13 . 1 1 83 83 LYS CA C 83 56.620 56.620 57.062 -0.442 25768 11357 1 13 . 1 1 83 83 LYS CB C 83 33.020 33.020 33.256 -0.236 25768 11358 1 13 . 1 1 83 83 LYS H H 83 7.970 7.970 8.273 -0.303 25768 11359 1 13 . 1 1 84 84 LEU N N 84 123.120 123.120 124.464 -1.344 25768 11360 1 13 . 1 1 84 84 LEU C C 84 176.920 176.920 176.793 0.127 25768 11361 1 13 . 1 1 84 84 LEU CA C 84 55.550 55.550 55.622 -0.072 25768 11362 1 13 . 1 1 84 84 LEU CB C 84 42.430 42.430 42.939 -0.509 25768 11363 1 13 . 1 1 84 84 LEU H H 84 8.130 8.130 8.597 -0.467 25768 11364 1 13 . 1 1 85 85 ALA N N 85 123.930 123.930 123.730 0.200 25768 11365 1 13 . 1 1 85 85 ALA C C 85 177.060 177.060 176.528 0.532 25768 11366 1 13 . 1 1 85 85 ALA CA C 85 52.790 52.790 51.562 1.228 25768 11367 1 13 . 1 1 85 85 ALA CB C 85 19.670 19.670 19.526 0.144 25768 11368 1 13 . 1 1 85 85 ALA H H 85 8.040 8.040 7.803 0.237 25768 11369 1 13 . 1 1 86 86 ASP N N 86 119.760 119.760 121.657 -1.897 25768 11370 1 13 . 1 1 86 86 ASP C C 86 175.820 175.820 175.600 0.220 25768 11371 1 13 . 1 1 86 86 ASP CA C 86 54.520 54.520 53.592 0.928 25768 11372 1 13 . 1 1 86 86 ASP CB C 86 41.390 41.390 42.288 -0.899 25768 11373 1 13 . 1 1 86 86 ASP H H 86 8.110 8.110 8.505 -0.395 25768 11374 1 13 . 1 1 87 87 ILE N N 87 120.620 120.620 118.219 2.401 25768 11375 1 13 . 1 1 87 87 ILE C C 87 175.740 175.740 175.197 0.543 25768 11376 1 13 . 1 1 87 87 ILE CA C 87 61.160 61.160 60.280 0.880 25768 11377 1 13 . 1 1 87 87 ILE CB C 87 39.260 39.260 40.405 -1.145 25768 11378 1 13 . 1 1 87 87 ILE H H 87 7.800 7.800 8.040 -0.240 25768 11379 1 13 . 1 1 88 88 LYS N N 88 125.820 125.820 120.323 5.497 25768 11380 1 13 . 1 1 88 88 LYS C C 88 175.340 175.340 174.982 0.358 25768 11381 1 13 . 1 1 88 88 LYS CA C 88 56.300 56.300 55.643 0.657 25768 11382 1 13 . 1 1 88 88 LYS CB C 88 32.900 32.900 35.307 -2.407 25768 11383 1 13 . 1 1 88 88 LYS H H 88 8.250 8.250 8.427 -0.177 25768 11384 1 13 . 1 1 89 89 GLN N N 89 121.750 121.750 122.363 -0.613 25768 11385 1 13 . 1 1 89 89 GLN C C 89 175.000 175.000 174.897 0.103 25768 11386 1 13 . 1 1 89 89 GLN CA C 89 55.210 55.210 55.020 0.190 25768 11387 1 13 . 1 1 89 89 GLN CB C 89 30.570 30.570 29.779 0.791 25768 11388 1 13 . 1 1 89 89 GLN H H 89 8.000 8.000 8.521 -0.521 25768 11389 1 13 . 1 1 90 90 LEU N N 90 126.660 126.660 128.533 -1.873 25768 11390 1 13 . 1 1 90 90 LEU C C 90 174.240 174.240 175.422 -1.182 25768 11391 1 13 . 1 1 90 90 LEU CA C 90 52.720 52.720 53.937 -1.217 25768 11392 1 13 . 1 1 90 90 LEU CB C 90 42.350 42.350 41.449 0.901 25768 11393 1 13 . 1 1 90 90 LEU H H 90 8.630 8.630 8.628 0.002 25768 11394 1 13 . 1 1 92 92 PRO C C 92 173.900 173.900 176.619 -2.719 25768 11395 1 13 . 1 1 92 92 PRO CA C 92 63.320 63.320 63.507 -0.187 25768 11396 1 13 . 1 1 92 92 PRO CB C 92 31.920 31.920 32.249 -0.329 25768 11397 1 13 . 1 1 93 93 THR N N 93 119.770 119.770 116.961 2.809 25768 11398 1 13 . 1 1 93 93 THR C C 93 171.360 171.360 173.906 -2.546 25768 11399 1 13 . 1 1 93 93 THR CA C 93 62.610 62.610 61.987 0.623 25768 11400 1 13 . 1 1 93 93 THR CB C 93 72.680 72.680 69.451 3.229 25768 11401 1 13 . 1 1 93 93 THR H H 93 8.290 8.290 8.421 -0.131 25768 11402 1 13 . 1 1 94 94 LEU N N 94 128.880 128.880 128.320 0.560 25768 11403 1 13 . 1 1 94 94 LEU C C 94 175.130 175.130 174.680 0.450 25768 11404 1 13 . 1 1 94 94 LEU CA C 94 53.520 53.520 54.261 -0.741 25768 11405 1 13 . 1 1 94 94 LEU CB C 94 46.140 46.140 45.036 1.104 25768 11406 1 13 . 1 1 94 94 LEU H H 94 8.680 8.680 8.594 0.086 25768 11407 1 13 . 1 1 95 95 LEU N N 95 123.630 123.630 121.155 2.475 25768 11408 1 13 . 1 1 95 95 LEU C C 95 175.540 175.540 174.603 0.937 25768 11409 1 13 . 1 1 95 95 LEU CA C 95 55.190 55.190 53.986 1.204 25768 11410 1 13 . 1 1 95 95 LEU CB C 95 45.300 45.300 43.976 1.324 25768 11411 1 13 . 1 1 95 95 LEU H H 95 9.580 9.580 8.999 0.581 25768 11412 1 13 . 1 1 96 96 LEU N N 96 123.150 123.150 124.087 -0.937 25768 11413 1 13 . 1 1 96 96 LEU C C 96 174.960 174.960 175.519 -0.559 25768 11414 1 13 . 1 1 96 96 LEU CA C 96 54.420 54.420 54.571 -0.151 25768 11415 1 13 . 1 1 96 96 LEU CB C 96 44.560 44.560 44.294 0.267 25768 11416 1 13 . 1 1 96 96 LEU H H 96 8.770 8.770 8.503 0.267 25768 11417 1 13 . 1 1 97 97 GLN N N 97 121.290 121.290 120.672 0.618 25768 11418 1 13 . 1 1 97 97 GLN C C 97 174.380 174.380 173.667 0.713 25768 11419 1 13 . 1 1 97 97 GLN CA C 97 54.740 54.740 54.649 0.091 25768 11420 1 13 . 1 1 97 97 GLN CB C 97 36.600 36.600 33.840 2.760 25768 11421 1 13 . 1 1 97 97 GLN H H 97 9.480 9.480 8.603 0.877 25768 11422 1 13 . 1 1 98 98 TYR N N 98 122.250 122.250 116.435 5.815 25768 11423 1 13 . 1 1 98 98 TYR C C 98 173.460 173.460 173.683 -0.223 25768 11424 1 13 . 1 1 98 98 TYR CA C 98 55.160 55.160 55.551 -0.391 25768 11425 1 13 . 1 1 98 98 TYR CB C 98 42.420 42.420 40.605 1.815 25768 11426 1 13 . 1 1 98 98 TYR H H 98 9.010 9.010 8.065 0.945 25768 11427 1 13 . 1 1 99 99 TYR N N 99 126.860 126.860 119.968 6.892 25768 11428 1 13 . 1 1 99 99 TYR C C 99 175.380 175.380 173.361 2.019 25768 11429 1 13 . 1 1 99 99 TYR CA C 99 54.220 54.220 53.566 0.654 25768 11430 1 13 . 1 1 99 99 TYR CB C 99 38.890 38.890 37.310 1.580 25768 11431 1 13 . 1 1 99 99 TYR H H 99 8.300 8.300 7.593 0.707 25768 11432 1 13 . 1 1 100 100 PRO C C 100 178.330 178.330 177.043 1.287 25768 11433 1 13 . 1 1 100 100 PRO CA C 100 64.750 64.750 64.423 0.327 25768 11434 1 13 . 1 1 100 100 PRO CB C 100 32.130 32.130 32.155 -0.025 25768 11435 1 13 . 1 1 101 101 MET N N 101 114.520 114.520 115.203 -0.683 25768 11436 1 13 . 1 1 101 101 MET C C 101 178.240 178.240 176.869 1.371 25768 11437 1 13 . 1 1 101 101 MET CA C 101 53.500 53.500 55.757 -2.257 25768 11438 1 13 . 1 1 101 101 MET CB C 101 30.160 30.160 33.262 -3.102 25768 11439 1 13 . 1 1 101 101 MET H H 101 9.390 9.390 7.543 1.847 25768 11440 1 13 . 1 1 102 102 GLY N N 102 117.500 117.500 107.279 10.221 25768 11441 1 13 . 1 1 102 102 GLY C C 102 175.690 175.690 174.189 1.501 25768 11442 1 13 . 1 1 102 102 GLY CA C 102 46.760 46.760 45.989 0.771 25768 11443 1 13 . 1 1 102 102 GLY H H 102 8.640 8.640 8.109 0.531 25768 11444 1 13 . 1 1 103 103 GLY N N 103 111.030 111.030 110.780 0.250 25768 11445 1 13 . 1 1 103 103 GLY C C 103 174.070 174.070 172.879 1.191 25768 11446 1 13 . 1 1 103 103 GLY CA C 103 46.140 46.140 45.332 0.808 25768 11447 1 13 . 1 1 103 103 GLY H H 103 9.390 9.390 7.656 1.734 25768 11448 1 13 . 1 1 104 104 THR N N 104 109.290 109.290 111.778 -2.488 25768 11449 1 13 . 1 1 104 104 THR C C 104 174.290 174.290 174.701 -0.411 25768 11450 1 13 . 1 1 104 104 THR CA C 104 60.900 60.900 59.500 1.400 25768 11451 1 13 . 1 1 104 104 THR CB C 104 72.070 72.070 70.120 1.950 25768 11452 1 13 . 1 1 104 104 THR H H 104 7.290 7.290 7.480 -0.190 25768 11453 1 13 . 1 1 105 105 ASN C C 105 175.050 175.050 175.610 -0.560 25768 11454 1 13 . 1 1 105 105 ASN CA C 105 52.880 52.880 52.971 -0.090 25768 11455 1 13 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.084 0.176 25768 11456 1 13 . 1 1 106 106 SER N N 106 113.000 113.000 116.345 -3.345 25768 11457 1 13 . 1 1 106 106 SER C C 106 176.000 176.000 173.807 2.193 25768 11458 1 13 . 1 1 106 106 SER CA C 106 58.700 58.700 57.864 0.836 25768 11459 1 13 . 1 1 106 106 SER CB C 106 64.540 64.540 64.172 0.368 25768 11460 1 13 . 1 1 106 106 SER H H 106 7.450 7.450 7.795 -0.345 25768 11461 1 13 . 1 1 107 107 ALA N N 107 132.220 132.220 122.920 9.300 25768 11462 1 13 . 1 1 107 107 ALA C C 107 176.610 176.610 176.209 0.401 25768 11463 1 13 . 1 1 107 107 ALA CA C 107 54.380 54.380 52.877 1.502 25768 11464 1 13 . 1 1 107 107 ALA CB C 107 18.690 18.690 19.380 -0.690 25768 11465 1 13 . 1 1 107 107 ALA H H 107 8.870 8.870 7.954 0.916 25768 11466 1 13 . 1 1 108 108 PHE N N 108 116.050 116.050 113.563 2.487 25768 11467 1 13 . 1 1 108 108 PHE C C 108 174.270 174.270 174.343 -0.073 25768 11468 1 13 . 1 1 108 108 PHE CA C 108 56.140 56.140 55.816 0.325 25768 11469 1 13 . 1 1 108 108 PHE CB C 108 40.520 40.520 40.526 -0.006 25768 11470 1 13 . 1 1 108 108 PHE H H 108 7.550 7.550 6.804 0.746 25768 11471 1 13 . 1 1 109 109 GLN N N 109 128.260 128.260 120.569 7.691 25768 11472 1 13 . 1 1 109 109 GLN C C 109 172.300 172.300 174.115 -1.815 25768 11473 1 13 . 1 1 109 109 GLN CA C 109 52.310 52.310 52.955 -0.644 25768 11474 1 13 . 1 1 109 109 GLN CB C 109 29.050 29.050 30.273 -1.223 25768 11475 1 13 . 1 1 109 109 GLN H H 109 9.060 9.060 8.578 0.482 25768 11476 1 13 . 1 1 110 110 PRO C C 110 175.020 175.020 175.978 -0.958 25768 11477 1 13 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.448 -0.898 25768 11478 1 13 . 1 1 110 110 PRO CB C 110 33.280 33.280 31.807 1.473 25768 11479 1 13 . 1 1 111 111 TYR N N 111 115.730 115.730 123.223 -7.493 25768 11480 1 13 . 1 1 111 111 TYR C C 111 173.850 173.850 173.605 0.245 25768 11481 1 13 . 1 1 111 111 TYR CA C 111 56.470 56.470 58.765 -2.295 25768 11482 1 13 . 1 1 111 111 TYR CB C 111 38.650 38.650 41.281 -2.631 25768 11483 1 13 . 1 1 111 111 TYR H H 111 8.500 8.500 7.853 0.647 25768 11484 1 13 . 1 1 112 112 GLY N N 112 103.570 103.570 106.130 -2.560 25768 11485 1 13 . 1 1 112 112 GLY C C 112 172.020 172.020 172.005 0.015 25768 11486 1 13 . 1 1 112 112 GLY CA C 112 43.950 43.950 45.110 -1.160 25768 11487 1 13 . 1 1 112 112 GLY H H 112 8.110 8.110 8.083 0.027 25768 11488 1 13 . 1 1 113 113 GLY N N 113 108.510 108.510 106.853 1.657 25768 11489 1 13 . 1 1 113 113 GLY C C 113 171.540 171.540 172.623 -1.083 25768 11490 1 13 . 1 1 113 113 GLY CA C 113 46.120 46.120 45.368 0.752 25768 11491 1 13 . 1 1 113 113 GLY H H 113 9.080 9.080 7.971 1.109 25768 11492 1 13 . 1 1 114 114 LEU N N 114 120.270 120.270 120.047 0.223 25768 11493 1 13 . 1 1 114 114 LEU C C 114 175.810 175.810 176.026 -0.216 25768 11494 1 13 . 1 1 114 114 LEU CA C 114 53.920 53.920 53.700 0.220 25768 11495 1 13 . 1 1 114 114 LEU CB C 114 47.940 47.940 46.853 1.087 25768 11496 1 13 . 1 1 114 114 LEU H H 114 8.620 8.620 7.845 0.775 25768 11497 1 13 . 1 1 115 115 GLY N N 115 110.620 110.620 106.794 3.826 25768 11498 1 13 . 1 1 115 115 GLY C C 115 171.560 171.560 172.555 -0.995 25768 11499 1 13 . 1 1 115 115 GLY CA C 115 46.940 46.940 43.888 3.052 25768 11500 1 13 . 1 1 115 115 GLY H H 115 9.000 9.000 8.376 0.624 25768 11501 1 13 . 1 1 116 116 VAL N N 116 113.600 113.600 118.737 -5.137 25768 11502 1 13 . 1 1 116 116 VAL C C 116 174.120 174.120 175.238 -1.118 25768 11503 1 13 . 1 1 116 116 VAL CA C 116 58.970 58.970 61.465 -2.495 25768 11504 1 13 . 1 1 116 116 VAL CB C 116 36.600 36.600 34.480 2.120 25768 11505 1 13 . 1 1 116 116 VAL H H 116 8.680 8.680 7.755 0.925 25768 11506 1 13 . 1 1 117 117 ASN N N 117 120.020 120.020 121.976 -1.956 25768 11507 1 13 . 1 1 117 117 ASN CA C 117 52.190 52.190 52.409 -0.219 25768 11508 1 13 . 1 1 117 117 ASN CB C 117 42.450 42.450 39.520 2.930 25768 11509 1 13 . 1 1 117 117 ASN H H 117 8.840 8.840 8.361 0.479 25768 11510 1 13 . 1 1 119 119 THR C C 119 174.350 174.350 172.968 1.382 25768 11511 1 13 . 1 1 119 119 THR CA C 119 63.140 63.140 62.838 0.302 25768 11512 1 13 . 1 1 119 119 THR CB C 119 70.170 70.170 68.577 1.593 25768 11513 1 13 . 1 1 120 120 THR N N 120 114.120 114.120 118.143 -4.023 25768 11514 1 13 . 1 1 120 120 THR C C 120 174.220 174.220 172.772 1.448 25768 11515 1 13 . 1 1 120 120 THR CA C 120 61.900 61.900 62.288 -0.388 25768 11516 1 13 . 1 1 120 120 THR CB C 120 70.140 70.140 69.734 0.406 25768 11517 1 13 . 1 1 120 120 THR H H 120 7.570 7.570 7.956 -0.386 25768 11518 1 13 . 1 1 121 121 PHE N N 121 121.230 121.230 126.697 -5.467 25768 11519 1 13 . 1 1 121 121 PHE C C 121 174.910 174.910 173.926 0.984 25768 11520 1 13 . 1 1 121 121 PHE CA C 121 58.720 58.720 58.444 0.276 25768 11521 1 13 . 1 1 121 121 PHE CB C 121 40.470 40.470 40.062 0.409 25768 11522 1 13 . 1 1 121 121 PHE H H 121 7.830 7.830 8.156 -0.326 25768 11523 1 13 . 1 1 122 122 PHE C C 122 175.070 175.070 175.828 -0.758 25768 11524 1 13 . 1 1 122 122 PHE CA C 122 57.890 57.890 57.098 0.792 25768 11525 1 13 . 1 1 122 122 PHE CB C 122 39.870 39.870 40.372 -0.502 25768 11526 1 13 . 1 1 123 123 ASP N N 123 122.170 122.170 124.852 -2.682 25768 11527 1 13 . 1 1 123 123 ASP C C 123 176.150 176.150 176.104 0.046 25768 11528 1 13 . 1 1 123 123 ASP CA C 123 54.530 54.530 54.635 -0.105 25768 11529 1 13 . 1 1 123 123 ASP CB C 123 41.830 41.830 41.617 0.213 25768 11530 1 13 . 1 1 123 123 ASP H H 123 7.950 7.950 8.783 -0.833 25768 11531 1 13 . 1 1 124 124 GLU N N 124 122.690 122.690 120.664 2.026 25768 11532 1 13 . 1 1 124 124 GLU C C 124 176.630 176.630 177.680 -1.050 25768 11533 1 13 . 1 1 124 124 GLU CA C 124 57.620 57.620 57.776 -0.156 25768 11534 1 13 . 1 1 124 124 GLU CB C 124 30.450 30.450 30.219 0.231 25768 11535 1 13 . 1 1 124 124 GLU H H 124 8.340 8.340 8.725 -0.385 25768 11536 1 13 . 1 1 125 125 ASP N N 125 121.280 121.280 121.229 0.051 25768 11537 1 13 . 1 1 125 125 ASP C C 125 176.940 176.940 178.060 -1.120 25768 11538 1 13 . 1 1 125 125 ASP CA C 125 55.180 55.180 55.939 -0.759 25768 11539 1 13 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.190 1.030 25768 11540 1 13 . 1 1 125 125 ASP H H 125 8.310 8.310 8.628 -0.318 25768 11541 1 13 . 1 1 126 126 LEU N N 126 122.830 122.830 118.689 4.141 25768 11542 1 13 . 1 1 126 126 LEU C C 126 178.020 178.020 177.656 0.364 25768 11543 1 13 . 1 1 126 126 LEU CA C 126 56.450 56.450 55.864 0.586 25768 11544 1 13 . 1 1 126 126 LEU CB C 126 42.150 42.150 42.208 -0.058 25768 11545 1 13 . 1 1 126 126 LEU H H 126 8.010 8.010 7.818 0.192 25768 11546 1 13 . 1 1 127 127 ALA N N 127 122.660 122.660 119.950 2.710 25768 11547 1 13 . 1 1 127 127 ALA C C 127 178.600 178.600 177.902 0.698 25768 11548 1 13 . 1 1 127 127 ALA CA C 127 53.780 53.780 53.606 0.174 25768 11549 1 13 . 1 1 127 127 ALA CB C 127 19.000 19.000 18.737 0.263 25768 11550 1 13 . 1 1 127 127 ALA H H 127 8.100 8.100 7.907 0.193 25768 11551 1 13 . 1 1 128 128 SER N N 128 113.740 113.740 114.156 -0.416 25768 11552 1 13 . 1 1 128 128 SER C C 128 175.010 175.010 173.751 1.259 25768 11553 1 13 . 1 1 128 128 SER CA C 128 59.580 59.580 58.574 1.006 25768 11554 1 13 . 1 1 128 128 SER CB C 128 63.800 63.800 64.143 -0.343 25768 11555 1 13 . 1 1 128 128 SER H H 128 7.920 7.920 7.847 0.073 25768 11556 1 13 . 1 1 129 129 ASN N N 129 120.300 120.300 118.084 2.216 25768 11557 1 13 . 1 1 129 129 ASN C C 129 175.590 175.590 175.218 0.372 25768 11558 1 13 . 1 1 129 129 ASN CA C 129 54.180 54.180 54.655 -0.475 25768 11559 1 13 . 1 1 129 129 ASN CB C 129 38.900 38.900 38.898 0.002 25768 11560 1 13 . 1 1 129 129 ASN H H 129 8.120 8.120 8.477 -0.357 25768 11561 1 13 . 1 1 130 130 ARG N N 130 120.630 120.630 120.649 -0.019 25768 11562 1 13 . 1 1 130 130 ARG C C 130 176.720 176.720 176.572 0.148 25768 11563 1 13 . 1 1 130 130 ARG CA C 130 57.240 57.240 55.458 1.782 25768 11564 1 13 . 1 1 130 130 ARG CB C 130 30.500 30.500 31.524 -1.024 25768 11565 1 13 . 1 1 130 130 ARG H H 130 8.050 8.050 8.663 -0.613 25768 11566 1 13 . 1 1 131 131 LYS N N 131 121.150 121.150 119.847 1.303 25768 11567 1 13 . 1 1 131 131 LYS C C 131 176.750 176.750 175.654 1.096 25768 11568 1 13 . 1 1 131 131 LYS CA C 131 57.050 57.050 58.096 -1.046 25768 11569 1 13 . 1 1 131 131 LYS CB C 131 32.870 32.870 33.014 -0.144 25768 11570 1 13 . 1 1 131 131 LYS H H 131 8.020 8.020 8.518 -0.498 25768 11571 1 13 . 1 1 132 132 ALA N N 132 124.110 124.110 122.261 1.849 25768 11572 1 13 . 1 1 132 132 ALA C C 132 177.680 177.680 176.141 1.539 25768 11573 1 13 . 1 1 132 132 ALA CA C 132 53.070 53.070 51.703 1.367 25768 11574 1 13 . 1 1 132 132 ALA CB C 132 19.250 19.250 20.085 -0.835 25768 11575 1 13 . 1 1 132 132 ALA H H 132 8.010 8.010 7.478 0.532 25768 11576 1 13 . 1 1 133 133 GLN N N 133 118.830 118.830 118.756 0.074 25768 11577 1 13 . 1 1 133 133 GLN C C 133 176.380 176.380 175.316 1.064 25768 11578 1 13 . 1 1 133 133 GLN CA C 133 56.400 56.400 55.301 1.099 25768 11579 1 13 . 1 1 133 133 GLN CB C 133 29.670 29.670 31.014 -1.344 25768 11580 1 13 . 1 1 133 133 GLN H H 133 8.070 8.070 8.596 -0.526 25768 11581 1 13 . 1 1 134 134 GLY N N 134 109.400 109.400 110.551 -1.151 25768 11582 1 13 . 1 1 134 134 GLY C C 134 174.060 174.060 174.508 -0.448 25768 11583 1 13 . 1 1 134 134 GLY CA C 134 45.690 45.690 45.021 0.669 25768 11584 1 13 . 1 1 134 134 GLY H H 134 8.150 8.150 8.645 -0.495 25768 11585 1 13 . 1 1 135 135 PHE N N 135 120.480 120.480 123.650 -3.170 25768 11586 1 13 . 1 1 135 135 PHE C C 135 176.000 176.000 176.572 -0.572 25768 11587 1 13 . 1 1 135 135 PHE CA C 135 58.370 58.370 57.990 0.380 25768 11588 1 13 . 1 1 135 135 PHE CB C 135 39.710 39.710 39.468 0.242 25768 11589 1 13 . 1 1 135 135 PHE H H 135 8.060 8.060 8.727 -0.667 25768 11590 1 13 . 1 1 136 136 SER N N 136 116.740 116.740 116.112 0.628 25768 11591 1 13 . 1 1 136 136 SER C C 136 174.620 174.620 173.839 0.781 25768 11592 1 13 . 1 1 136 136 SER CA C 136 58.870 58.870 58.253 0.617 25768 11593 1 13 . 1 1 136 136 SER CB C 136 64.200 64.200 64.125 0.075 25768 11594 1 13 . 1 1 136 136 SER H H 136 8.160 8.160 8.138 0.022 25768 11595 1 13 . 1 1 137 137 SER N N 137 117.650 117.650 115.678 1.972 25768 11596 1 13 . 1 1 137 137 SER C C 137 174.410 174.410 173.910 0.500 25768 11597 1 13 . 1 1 137 137 SER CA C 137 58.880 58.880 58.178 0.702 25768 11598 1 13 . 1 1 137 137 SER CB C 137 64.140 64.140 63.723 0.417 25768 11599 1 13 . 1 1 137 137 SER H H 137 8.140 8.140 8.357 -0.217 25768 11600 1 13 . 1 1 138 138 MET N N 138 121.980 121.980 122.983 -1.003 25768 11601 1 13 . 1 1 138 138 MET C C 138 175.680 175.680 175.525 0.155 25768 11602 1 13 . 1 1 138 138 MET CA C 138 56.180 56.180 55.341 0.839 25768 11603 1 13 . 1 1 138 138 MET CB C 138 33.240 33.240 35.122 -1.882 25768 11604 1 13 . 1 1 138 138 MET H H 138 8.110 8.110 8.412 -0.302 25768 11605 1 13 . 1 1 139 139 LYS N N 139 122.110 122.110 123.525 -1.415 25768 11606 1 13 . 1 1 139 139 LYS C C 139 176.220 176.220 176.057 0.163 25768 11607 1 13 . 1 1 139 139 LYS CA C 139 56.370 56.370 55.527 0.843 25768 11608 1 13 . 1 1 139 139 LYS CB C 139 33.220 33.220 33.970 -0.750 25768 11609 1 13 . 1 1 139 139 LYS H H 139 8.140 8.140 8.312 -0.172 25768 11610 1 13 . 1 1 140 140 LEU N N 140 123.860 123.860 122.097 1.763 25768 11611 1 13 . 1 1 140 140 LEU C C 140 177.100 177.100 176.242 0.858 25768 11612 1 13 . 1 1 140 140 LEU CA C 140 55.710 55.710 55.589 0.121 25768 11613 1 13 . 1 1 140 140 LEU CB C 140 42.460 42.460 42.589 -0.129 25768 11614 1 13 . 1 1 140 140 LEU H H 140 8.140 8.140 8.407 -0.267 25768 11615 1 13 . 1 1 141 141 GLN N N 141 120.350 120.350 120.016 0.334 25768 11616 1 13 . 1 1 141 141 GLN C C 141 175.170 175.170 174.473 0.697 25768 11617 1 13 . 1 1 141 141 GLN CA C 141 56.200 56.200 55.963 0.237 25768 11618 1 13 . 1 1 141 141 GLN CB C 141 29.950 29.950 29.861 0.089 25768 11619 1 13 . 1 1 141 141 GLN H H 141 8.210 8.210 8.737 -0.527 25768 11620 1 13 . 1 1 142 142 ASP N N 142 120.950 120.950 121.045 -0.095 25768 11621 1 13 . 1 1 142 142 ASP C C 142 175.840 175.840 175.552 0.288 25768 11622 1 13 . 1 1 142 142 ASP CA C 142 54.700 54.700 54.876 -0.176 25768 11623 1 13 . 1 1 142 142 ASP CB C 142 41.760 41.760 40.803 0.957 25768 11624 1 13 . 1 1 142 142 ASP H H 142 8.120 8.120 8.494 -0.374 25768 11625 1 13 . 1 1 143 143 SER N N 143 114.880 114.880 116.192 -1.312 25768 11626 1 13 . 1 1 143 143 SER C C 143 173.290 173.290 173.984 -0.694 25768 11627 1 13 . 1 1 143 143 SER CA C 143 58.450 58.450 58.368 0.082 25768 11628 1 13 . 1 1 143 143 SER CB C 143 64.760 64.760 63.986 0.774 25768 11629 1 13 . 1 1 143 143 SER H H 143 7.960 7.960 7.973 -0.013 25768 11630 1 13 . 1 1 144 144 TRP N N 144 123.110 123.110 125.612 -2.502 25768 11631 1 13 . 1 1 144 144 TRP C C 144 175.880 175.880 176.509 -0.629 25768 11632 1 13 . 1 1 144 144 TRP CA C 144 56.420 56.420 57.340 -0.920 25768 11633 1 13 . 1 1 144 144 TRP CB C 144 31.160 31.160 29.678 1.482 25768 11634 1 13 . 1 1 144 144 TRP H H 144 8.080 8.080 8.251 -0.171 25768 11635 1 13 . 1 1 145 145 GLY N N 145 110.410 110.410 112.007 -1.597 25768 11636 1 13 . 1 1 145 145 GLY C C 145 172.870 172.870 173.626 -0.756 25768 11637 1 13 . 1 1 145 145 GLY CA C 145 45.130 45.130 44.467 0.663 25768 11638 1 13 . 1 1 145 145 GLY H H 145 8.660 8.660 8.527 0.133 25768 11639 1 13 . 1 1 148 148 GLY C C 148 171.800 171.800 172.982 -1.182 25768 11640 1 13 . 1 1 148 148 GLY CA C 148 44.140 44.140 44.784 -0.644 25768 11641 1 13 . 1 1 149 149 GLU N N 149 123.070 123.070 123.885 -0.815 25768 11642 1 13 . 1 1 149 149 GLU C C 149 174.210 174.210 174.547 -0.337 25768 11643 1 13 . 1 1 149 149 GLU CA C 149 55.120 55.120 55.910 -0.790 25768 11644 1 13 . 1 1 149 149 GLU CB C 149 37.410 37.410 32.952 4.458 25768 11645 1 13 . 1 1 149 149 GLU H H 149 8.550 8.550 8.828 -0.278 25768 11646 1 13 . 1 1 150 150 LEU N N 150 126.130 126.130 126.002 0.128 25768 11647 1 13 . 1 1 150 150 LEU C C 150 174.410 174.410 175.057 -0.647 25768 11648 1 13 . 1 1 150 150 LEU CA C 150 54.260 54.260 52.990 1.270 25768 11649 1 13 . 1 1 150 150 LEU CB C 150 47.510 47.510 46.276 1.234 25768 11650 1 13 . 1 1 150 150 LEU H H 150 8.550 8.550 7.873 0.677 25768 11651 1 13 . 1 1 151 151 GLY N N 151 109.500 109.500 108.361 1.139 25768 11652 1 13 . 1 1 151 151 GLY C C 151 170.610 170.610 171.763 -1.153 25768 11653 1 13 . 1 1 151 151 GLY CA C 151 45.980 45.980 45.821 0.159 25768 11654 1 13 . 1 1 151 151 GLY H H 151 8.090 8.090 8.093 -0.003 25768 11655 1 13 . 1 1 152 152 PHE N N 152 110.960 110.960 117.876 -6.916 25768 11656 1 13 . 1 1 152 152 PHE C C 152 171.510 171.510 173.827 -2.317 25768 11657 1 13 . 1 1 152 152 PHE CA C 152 58.170 58.170 57.371 0.799 25768 11658 1 13 . 1 1 152 152 PHE CB C 152 41.690 41.690 43.020 -1.330 25768 11659 1 13 . 1 1 152 152 PHE H H 152 8.380 8.380 7.999 0.381 25768 11660 1 13 . 1 1 153 153 ASP N N 153 118.880 118.880 122.847 -3.967 25768 11661 1 13 . 1 1 153 153 ASP C C 153 176.520 176.520 175.207 1.313 25768 11662 1 13 . 1 1 153 153 ASP CA C 153 52.940 52.940 53.470 -0.530 25768 11663 1 13 . 1 1 153 153 ASP CB C 153 44.540 44.540 43.230 1.310 25768 11664 1 13 . 1 1 153 153 ASP H H 153 7.970 7.970 8.503 -0.533 25768 11665 1 13 . 1 1 154 154 TYR N N 154 123.630 123.630 125.946 -2.316 25768 11666 1 13 . 1 1 154 154 TYR C C 154 175.610 175.610 174.665 0.945 25768 11667 1 13 . 1 1 154 154 TYR CA C 154 57.310 57.310 57.812 -0.502 25768 11668 1 13 . 1 1 154 154 TYR CB C 154 42.040 42.040 40.155 1.885 25768 11669 1 13 . 1 1 154 154 TYR H H 154 9.730 9.730 9.303 0.427 25768 11670 1 13 . 1 1 155 155 MET N N 155 126.190 126.190 124.105 2.085 25768 11671 1 13 . 1 1 155 155 MET C C 155 174.970 174.970 175.094 -0.124 25768 11672 1 13 . 1 1 155 155 MET CA C 155 54.720 54.720 54.745 -0.025 25768 11673 1 13 . 1 1 155 155 MET CB C 155 28.300 28.300 31.882 -3.582 25768 11674 1 13 . 1 1 155 155 MET H H 155 8.600 8.600 8.165 0.435 25768 11675 1 13 . 1 1 156 156 LEU N N 156 125.290 125.290 124.914 0.376 25768 11676 1 13 . 1 1 156 156 LEU C C 156 177.680 177.680 177.617 0.063 25768 11677 1 13 . 1 1 156 156 LEU CA C 156 56.040 56.040 54.809 1.231 25768 11678 1 13 . 1 1 156 156 LEU CB C 156 43.040 43.040 43.231 -0.191 25768 11679 1 13 . 1 1 156 156 LEU H H 156 9.190 9.190 8.361 0.829 25768 11680 1 13 . 1 1 157 157 ASN N N 157 114.690 114.690 116.898 -2.208 25768 11681 1 13 . 1 1 157 157 ASN C C 157 173.640 173.640 177.072 -3.432 25768 11682 1 13 . 1 1 157 157 ASN CA C 157 52.650 52.650 56.584 -3.934 25768 11683 1 13 . 1 1 157 157 ASN CB C 157 37.270 37.270 37.057 0.213 25768 11684 1 13 . 1 1 157 157 ASN H H 157 8.060 8.060 8.338 -0.278 25768 11685 1 13 . 1 1 158 158 GLU N N 158 114.530 114.530 121.313 -6.783 25768 11686 1 13 . 1 1 158 158 GLU C C 158 176.090 176.090 177.280 -1.190 25768 11687 1 13 . 1 1 158 158 GLU CA C 158 60.010 60.010 58.675 1.335 25768 11688 1 13 . 1 1 158 158 GLU CB C 158 29.730 29.730 29.671 0.059 25768 11689 1 13 . 1 1 158 158 GLU H H 158 8.560 8.560 8.496 0.064 25768 11690 1 13 . 1 1 159 159 HIS N N 159 110.480 110.480 119.566 -9.086 25768 11691 1 13 . 1 1 159 159 HIS C C 159 173.130 173.130 174.445 -1.315 25768 11692 1 13 . 1 1 159 159 HIS CA C 159 56.770 56.770 55.226 1.544 25768 11693 1 13 . 1 1 159 159 HIS CB C 159 32.630 32.630 29.340 3.290 25768 11694 1 13 . 1 1 159 159 HIS H H 159 8.190 8.190 7.678 0.512 25768 11695 1 13 . 1 1 160 160 ALA N N 160 122.890 122.890 120.575 2.315 25768 11696 1 13 . 1 1 160 160 ALA C C 160 176.200 176.200 175.119 1.081 25768 11697 1 13 . 1 1 160 160 ALA CA C 160 51.730 51.730 53.391 -1.661 25768 11698 1 13 . 1 1 160 160 ALA CB C 160 21.560 21.560 18.380 3.180 25768 11699 1 13 . 1 1 160 160 ALA H H 160 8.400 8.400 7.663 0.737 25768 11700 1 13 . 1 1 161 161 LEU N N 161 116.540 116.540 112.544 3.996 25768 11701 1 13 . 1 1 161 161 LEU C C 161 174.930 174.930 175.695 -0.765 25768 11702 1 13 . 1 1 161 161 LEU CA C 161 54.280 54.280 53.441 0.839 25768 11703 1 13 . 1 1 161 161 LEU CB C 161 45.640 45.640 45.013 0.627 25768 11704 1 13 . 1 1 161 161 LEU H H 161 8.590 8.590 7.723 0.867 25768 11705 1 13 . 1 1 162 162 PHE N N 162 121.780 121.780 120.179 1.601 25768 11706 1 13 . 1 1 162 162 PHE C C 162 171.960 171.960 175.014 -3.054 25768 11707 1 13 . 1 1 162 162 PHE CA C 162 56.420 56.420 56.405 0.015 25768 11708 1 13 . 1 1 162 162 PHE CB C 162 43.340 43.340 41.437 1.903 25768 11709 1 13 . 1 1 162 162 PHE H H 162 9.180 9.180 8.829 0.351 25768 11710 1 13 . 1 1 163 163 ASN N N 163 127.850 127.850 122.352 5.498 25768 11711 1 13 . 1 1 163 163 ASN C C 163 171.320 171.320 173.554 -2.234 25768 11712 1 13 . 1 1 163 163 ASN CA C 163 52.340 52.340 52.833 -0.493 25768 11713 1 13 . 1 1 163 163 ASN CB C 163 46.410 46.410 41.301 5.109 25768 11714 1 13 . 1 1 163 163 ASN H H 163 7.700 7.700 8.656 -0.956 25768 11715 1 13 . 1 1 164 164 MET N N 164 119.950 119.950 125.125 -5.175 25768 11716 1 13 . 1 1 164 164 MET C C 164 172.830 172.830 173.935 -1.105 25768 11717 1 13 . 1 1 164 164 MET CA C 164 55.180 55.180 54.651 0.529 25768 11718 1 13 . 1 1 164 164 MET CB C 164 37.770 37.770 36.966 0.804 25768 11719 1 13 . 1 1 164 164 MET H H 164 7.070 7.070 8.187 -1.117 25768 11720 1 13 . 1 1 165 165 ALA N N 165 120.600 120.600 127.467 -6.867 25768 11721 1 13 . 1 1 165 165 ALA C C 165 174.240 174.240 174.669 -0.429 25768 11722 1 13 . 1 1 165 165 ALA CA C 165 51.630 51.630 51.290 0.340 25768 11723 1 13 . 1 1 165 165 ALA CB C 165 22.330 22.330 23.064 -0.734 25768 11724 1 13 . 1 1 165 165 ALA H H 165 8.290 8.290 8.514 -0.224 25768 11725 1 13 . 1 1 166 166 VAL N N 166 117.900 117.900 118.391 -0.491 25768 11726 1 13 . 1 1 166 166 VAL C C 166 172.950 172.950 175.056 -2.106 25768 11727 1 13 . 1 1 166 166 VAL CA C 166 59.710 59.710 62.065 -2.355 25768 11728 1 13 . 1 1 166 166 VAL CB C 166 35.290 35.290 35.926 -0.636 25768 11729 1 13 . 1 1 166 166 VAL H H 166 8.720 8.720 8.845 -0.125 25768 11730 1 13 . 1 1 171 171 ILE C C 171 175.750 175.750 173.800 1.950 25768 11731 1 13 . 1 1 171 171 ILE CA C 171 61.720 61.720 62.494 -0.774 25768 11732 1 13 . 1 1 171 171 ILE CB C 171 39.300 39.300 39.382 -0.082 25768 11733 1 13 . 1 1 172 172 ASP N N 172 124.070 124.070 120.818 3.252 25768 11734 1 13 . 1 1 172 172 ASP C C 172 176.590 176.590 177.012 -0.422 25768 11735 1 13 . 1 1 172 172 ASP CA C 172 54.460 54.460 54.950 -0.490 25768 11736 1 13 . 1 1 172 172 ASP CB C 172 41.410 41.410 41.392 0.018 25768 11737 1 13 . 1 1 172 172 ASP H H 172 8.460 8.460 8.362 0.098 25768 11738 1 13 . 1 1 173 173 THR N N 173 115.570 115.570 115.983 -0.413 25768 11739 1 13 . 1 1 173 173 THR C C 173 175.030 175.030 175.622 -0.592 25768 11740 1 13 . 1 1 173 173 THR CA C 173 62.680 62.680 63.647 -0.966 25768 11741 1 13 . 1 1 173 173 THR CB C 173 69.840 69.840 69.207 0.632 25768 11742 1 13 . 1 1 173 173 THR H H 173 8.080 8.080 7.803 0.277 25768 11743 1 13 . 1 1 174 174 LYS N N 174 122.680 122.680 120.503 2.177 25768 11744 1 13 . 1 1 174 174 LYS C C 174 176.340 176.340 176.319 0.021 25768 11745 1 13 . 1 1 174 174 LYS CA C 174 56.820 56.820 56.195 0.625 25768 11746 1 13 . 1 1 174 174 LYS CB C 174 32.790 32.790 33.448 -0.658 25768 11747 1 13 . 1 1 174 174 LYS H H 174 8.180 8.180 8.056 0.124 25768 11748 1 13 . 1 1 175 175 ALA N N 175 124.050 124.050 121.663 2.387 25768 11749 1 13 . 1 1 175 175 ALA C C 175 177.550 177.550 176.180 1.370 25768 11750 1 13 . 1 1 175 175 ALA CA C 175 52.840 52.840 52.332 0.508 25768 11751 1 13 . 1 1 175 175 ALA CB C 175 19.580 19.580 18.447 1.133 25768 11752 1 13 . 1 1 175 175 ALA H H 175 8.050 8.050 8.021 0.029 25768 11753 1 13 . 1 1 176 176 SER N N 176 114.920 114.920 113.327 1.593 25768 11754 1 13 . 1 1 176 176 SER C C 176 174.240 174.240 173.463 0.777 25768 11755 1 13 . 1 1 176 176 SER CA C 176 58.390 58.390 57.529 0.861 25768 11756 1 13 . 1 1 176 176 SER CB C 176 64.370 64.370 64.439 -0.069 25768 11757 1 13 . 1 1 176 176 SER H H 176 8.070 8.070 8.206 -0.136 25768 11758 1 13 . 1 1 177 177 ILE N N 177 121.650 121.650 120.615 1.035 25768 11759 1 13 . 1 1 177 177 ILE C C 177 174.990 174.990 175.312 -0.322 25768 11760 1 13 . 1 1 177 177 ILE CA C 177 61.570 61.570 60.999 0.571 25768 11761 1 13 . 1 1 177 177 ILE CB C 177 39.100 39.100 38.620 0.480 25768 11762 1 13 . 1 1 177 177 ILE H H 177 7.960 7.960 8.230 -0.270 25768 11763 1 13 . 1 1 178 178 ASN N N 178 127.040 127.040 124.211 2.829 25768 11764 1 13 . 1 1 178 178 ASN C C 178 179.160 179.160 175.610 3.550 25768 11765 1 13 . 1 1 178 178 ASN CA C 178 55.100 55.100 53.470 1.630 25768 11766 1 13 . 1 1 178 178 ASN CB C 178 41.300 41.300 39.617 1.683 25768 11767 1 13 . 1 1 178 178 ASN H H 178 7.850 7.850 8.608 -0.758 25768 11768 1 13 . 1 1 180 180 PRO C C 180 177.520 177.520 176.870 0.650 25768 11769 1 13 . 1 1 180 180 PRO CA C 180 63.980 63.980 64.025 -0.045 25768 11770 1 13 . 1 1 180 180 PRO CB C 180 32.190 32.190 32.233 -0.043 25768 11771 1 13 . 1 1 181 181 SER N N 181 115.600 115.600 113.559 2.041 25768 11772 1 13 . 1 1 181 181 SER C C 181 174.710 174.710 173.709 1.001 25768 11773 1 13 . 1 1 181 181 SER CA C 181 58.900 58.900 57.602 1.298 25768 11774 1 13 . 1 1 181 181 SER CB C 181 64.070 64.070 62.946 1.124 25768 11775 1 13 . 1 1 181 181 SER H H 181 8.260 8.260 8.057 0.203 25768 11776 1 13 . 1 1 182 182 ALA N N 182 125.880 125.880 123.990 1.890 25768 11777 1 13 . 1 1 182 182 ALA C C 182 177.560 177.560 176.649 0.911 25768 11778 1 13 . 1 1 182 182 ALA CA C 182 53.090 53.090 52.516 0.574 25768 11779 1 13 . 1 1 182 182 ALA CB C 182 19.310 19.310 19.616 -0.306 25768 11780 1 13 . 1 1 182 182 ALA H H 182 8.130 8.130 7.937 0.193 25768 11781 1 13 . 1 1 183 183 LEU N N 183 119.980 119.980 121.311 -1.331 25768 11782 1 13 . 1 1 183 183 LEU C C 183 177.850 177.850 177.023 0.827 25768 11783 1 13 . 1 1 183 183 LEU CA C 183 55.650 55.650 54.533 1.117 25768 11784 1 13 . 1 1 183 183 LEU CB C 183 42.530 42.530 43.937 -1.407 25768 11785 1 13 . 1 1 183 183 LEU H H 183 7.940 7.940 8.442 -0.502 25768 11786 1 13 . 1 1 184 184 GLY N N 184 109.250 109.250 110.644 -1.394 25768 11787 1 13 . 1 1 184 184 GLY C C 184 174.250 174.250 173.917 0.333 25768 11788 1 13 . 1 1 184 184 GLY CA C 184 45.830 45.830 44.207 1.623 25768 11789 1 13 . 1 1 184 184 GLY H H 184 8.150 8.150 8.046 0.104 25768 11790 1 13 . 1 1 185 185 VAL N N 185 118.830 118.830 118.660 0.170 25768 11791 1 13 . 1 1 185 185 VAL C C 185 175.890 175.890 174.881 1.009 25768 11792 1 13 . 1 1 185 185 VAL CA C 185 62.740 62.740 62.281 0.459 25768 11793 1 13 . 1 1 185 185 VAL CB C 185 32.770 32.770 32.076 0.694 25768 11794 1 13 . 1 1 185 185 VAL H H 185 7.760 7.760 8.260 -0.500 25768 11795 1 13 . 1 1 186 186 ASN N N 186 121.850 121.850 120.161 1.689 25768 11796 1 13 . 1 1 186 186 ASN C C 186 174.970 174.970 174.286 0.684 25768 11797 1 13 . 1 1 186 186 ASN CA C 186 53.590 53.590 53.327 0.263 25768 11798 1 13 . 1 1 186 186 ASN CB C 186 39.160 39.160 39.375 -0.215 25768 11799 1 13 . 1 1 186 186 ASN H H 186 8.380 8.380 7.918 0.462 25768 11800 1 13 . 1 1 187 187 LYS N N 187 122.120 122.120 124.521 -2.401 25768 11801 1 13 . 1 1 187 187 LYS C C 187 176.490 176.490 176.515 -0.025 25768 11802 1 13 . 1 1 187 187 LYS CA C 187 56.750 56.750 55.800 0.950 25768 11803 1 13 . 1 1 187 187 LYS CB C 187 33.250 33.250 33.931 -0.681 25768 11804 1 13 . 1 1 187 187 LYS H H 187 8.140 8.140 8.397 -0.257 25768 11805 1 13 . 1 1 188 188 THR N N 188 115.250 115.250 112.663 2.587 25768 11806 1 13 . 1 1 188 188 THR C C 188 174.250 174.250 175.523 -1.273 25768 11807 1 13 . 1 1 188 188 THR CA C 188 62.360 62.360 62.509 -0.149 25768 11808 1 13 . 1 1 188 188 THR CB C 188 70.280 70.280 69.724 0.556 25768 11809 1 13 . 1 1 188 188 THR H H 188 8.100 8.100 8.482 -0.382 25768 11810 1 13 . 1 1 189 189 LYS N N 189 123.780 123.780 123.575 0.205 25768 11811 1 13 . 1 1 189 189 LYS C C 189 176.090 176.090 175.337 0.753 25768 11812 1 13 . 1 1 189 189 LYS CA C 189 56.590 56.590 55.851 0.739 25768 11813 1 13 . 1 1 189 189 LYS CB C 189 33.350 33.350 30.757 2.593 25768 11814 1 13 . 1 1 189 189 LYS H H 189 8.110 8.110 8.329 -0.219 25768 11815 1 13 . 1 1 190 190 VAL N N 190 120.920 120.920 116.673 4.247 25768 11816 1 13 . 1 1 190 190 VAL C C 190 175.590 175.590 175.775 -0.185 25768 11817 1 13 . 1 1 190 190 VAL CA C 190 62.400 62.400 61.681 0.719 25768 11818 1 13 . 1 1 190 190 VAL CB C 190 32.990 32.990 33.746 -0.756 25768 11819 1 13 . 1 1 190 190 VAL H H 190 8.040 8.040 7.404 0.636 25768 11820 1 13 . 1 1 191 191 ASP N N 191 123.790 123.790 121.911 1.879 25768 11821 1 13 . 1 1 191 191 ASP C C 191 175.750 175.750 174.692 1.058 25768 11822 1 13 . 1 1 191 191 ASP CA C 191 54.650 54.650 55.393 -0.743 25768 11823 1 13 . 1 1 191 191 ASP CB C 191 41.450 41.450 39.997 1.453 25768 11824 1 13 . 1 1 191 191 ASP H H 191 8.240 8.240 8.777 -0.537 25768 11825 1 13 . 1 1 192 192 VAL N N 192 118.850 118.850 116.230 2.620 25768 11826 1 13 . 1 1 192 192 VAL C C 192 175.380 175.380 175.499 -0.119 25768 11827 1 13 . 1 1 192 192 VAL CA C 192 62.110 62.110 62.818 -0.708 25768 11828 1 13 . 1 1 192 192 VAL CB C 192 33.290 33.290 32.979 0.311 25768 11829 1 13 . 1 1 192 192 VAL H H 192 7.860 7.860 7.984 -0.124 25768 11830 1 13 . 1 1 193 193 ASP N N 193 124.190 124.190 123.609 0.581 25768 11831 1 13 . 1 1 193 193 ASP C C 193 175.630 175.630 175.537 0.093 25768 11832 1 13 . 1 1 193 193 ASP CA C 193 54.540 54.540 53.611 0.929 25768 11833 1 13 . 1 1 193 193 ASP CB C 193 41.410 41.410 39.238 2.172 25768 11834 1 13 . 1 1 193 193 ASP H H 193 8.310 8.310 8.531 -0.221 25768 11835 1 13 . 1 1 194 194 VAL N N 194 119.580 119.580 117.862 1.718 25768 11836 1 13 . 1 1 194 194 VAL C C 194 174.950 174.950 175.222 -0.272 25768 11837 1 13 . 1 1 194 194 VAL CA C 194 61.770 61.770 61.498 0.272 25768 11838 1 13 . 1 1 194 194 VAL CB C 194 33.680 33.680 32.840 0.840 25768 11839 1 13 . 1 1 194 194 VAL H H 194 7.890 7.890 7.331 0.559 25768 11840 1 13 . 1 1 195 195 ASP N N 195 125.660 125.660 126.884 -1.224 25768 11841 1 13 . 1 1 195 195 ASP C C 195 174.290 174.290 175.119 -0.829 25768 11842 1 13 . 1 1 195 195 ASP CA C 195 51.940 51.940 50.925 1.015 25768 11843 1 13 . 1 1 195 195 ASP CB C 195 40.950 40.950 42.746 -1.796 25768 11844 1 13 . 1 1 195 195 ASP H H 195 8.410 8.410 8.149 0.261 25768 11845 1 13 . 1 1 198 198 VAL C C 198 173.940 173.940 174.795 -0.855 25768 11846 1 13 . 1 1 198 198 VAL CA C 198 61.270 61.270 61.878 -0.608 25768 11847 1 13 . 1 1 198 198 VAL CB C 198 35.910 35.910 31.929 3.981 25768 11848 1 13 . 1 1 199 199 TYR N N 199 123.780 123.780 121.550 2.230 25768 11849 1 13 . 1 1 199 199 TYR C C 199 174.150 174.150 173.864 0.286 25768 11850 1 13 . 1 1 199 199 TYR CA C 199 56.220 56.220 55.508 0.712 25768 11851 1 13 . 1 1 199 199 TYR CB C 199 41.660 41.660 40.853 0.807 25768 11852 1 13 . 1 1 199 199 TYR H H 199 8.540 8.540 7.773 0.767 25768 11853 1 13 . 1 1 200 200 MET N N 200 123.920 123.920 121.102 2.818 25768 11854 1 13 . 1 1 200 200 MET C C 200 173.810 173.810 175.408 -1.598 25768 11855 1 13 . 1 1 200 200 MET CA C 200 54.710 54.710 54.248 0.462 25768 11856 1 13 . 1 1 200 200 MET CB C 200 37.110 37.110 35.026 2.084 25768 11857 1 13 . 1 1 200 200 MET H H 200 9.130 9.130 8.250 0.880 25768 11858 1 13 . 1 1 201 201 ILE N N 201 123.670 123.670 117.227 6.443 25768 11859 1 13 . 1 1 201 201 ILE C C 201 174.030 174.030 174.210 -0.180 25768 11860 1 13 . 1 1 201 201 ILE CA C 201 59.820 59.820 59.493 0.327 25768 11861 1 13 . 1 1 201 201 ILE CB C 201 41.720 41.720 41.822 -0.102 25768 11862 1 13 . 1 1 201 201 ILE H H 201 8.030 8.030 8.196 -0.166 25768 11863 1 13 . 1 1 202 202 GLY N N 202 112.910 112.910 110.784 2.126 25768 11864 1 13 . 1 1 202 202 GLY C C 202 170.280 170.280 171.913 -1.633 25768 11865 1 13 . 1 1 202 202 GLY CA C 202 46.800 46.800 45.516 1.284 25768 11866 1 13 . 1 1 202 202 GLY H H 202 8.580 8.580 7.984 0.596 25768 11867 1 13 . 1 1 203 203 PHE N N 203 116.240 116.240 115.482 0.758 25768 11868 1 13 . 1 1 203 203 PHE C C 203 173.940 173.940 173.868 0.072 25768 11869 1 13 . 1 1 203 203 PHE CA C 203 55.890 55.890 54.042 1.848 25768 11870 1 13 . 1 1 203 203 PHE CB C 203 45.060 45.060 41.069 3.991 25768 11871 1 13 . 1 1 203 203 PHE H H 203 8.620 8.620 7.867 0.753 25768 11872 1 13 . 1 1 204 204 GLY N N 204 105.610 105.610 106.789 -1.179 25768 11873 1 13 . 1 1 204 204 GLY C C 204 171.190 171.190 171.377 -0.187 25768 11874 1 13 . 1 1 204 204 GLY CA C 204 46.720 46.720 45.404 1.316 25768 11875 1 13 . 1 1 204 204 GLY H H 204 8.960 8.960 8.408 0.552 25768 11876 1 13 . 1 1 205 205 TYR N N 205 121.160 121.160 116.851 4.309 25768 11877 1 13 . 1 1 205 205 TYR C C 205 173.030 173.030 174.241 -1.211 25768 11878 1 13 . 1 1 205 205 TYR CA C 205 57.190 57.190 57.086 0.104 25768 11879 1 13 . 1 1 205 205 TYR CB C 205 44.400 44.400 42.874 1.526 25768 11880 1 13 . 1 1 205 205 TYR H H 205 9.380 9.380 8.929 0.451 25768 11881 1 13 . 1 1 206 206 LYS N N 206 126.970 126.970 120.285 6.685 25768 11882 1 13 . 1 1 206 206 LYS C C 206 174.210 174.210 175.881 -1.671 25768 11883 1 13 . 1 1 206 206 LYS CA C 206 54.770 54.770 56.171 -1.401 25768 11884 1 13 . 1 1 206 206 LYS CB C 206 34.440 34.440 33.934 0.506 25768 11885 1 13 . 1 1 206 206 LYS H H 206 8.380 8.380 8.836 -0.456 25768 11886 1 13 . 1 1 207 207 PHE N N 207 126.330 126.330 124.216 2.114 25768 11887 1 13 . 1 1 207 207 PHE C C 207 175.020 175.020 174.494 0.526 25768 11888 1 13 . 1 1 207 207 PHE CA C 207 58.170 58.170 57.488 0.682 25768 11889 1 13 . 1 1 207 207 PHE CB C 207 40.920 40.920 40.057 0.863 25768 11890 1 13 . 1 1 207 207 PHE H H 207 9.290 9.290 8.248 1.042 25768 11891 1 13 . 1 1 208 208 LEU N N 208 122.740 122.740 126.024 -3.284 25768 11892 1 13 . 1 1 208 208 LEU C C 208 176.510 176.510 176.027 0.483 25768 11893 1 13 . 1 1 208 208 LEU CA C 208 54.910 54.910 54.497 0.413 25768 11894 1 13 . 1 1 208 208 LEU CB C 208 43.830 43.830 44.488 -0.658 25768 11895 1 13 . 1 1 208 208 LEU H H 208 8.310 8.310 8.452 -0.142 25768 11896 1 14 . 1 1 2 2 HIS C C 2 175.310 175.310 175.447 -0.137 25768 11897 1 14 . 1 1 3 3 LYS N N 3 122.080 122.080 122.742 -0.662 25768 11898 1 14 . 1 1 3 3 LYS C C 3 173.490 173.490 174.767 -1.277 25768 11899 1 14 . 1 1 3 3 LYS CA C 3 55.050 55.050 55.278 -0.228 25768 11900 1 14 . 1 1 3 3 LYS CB C 3 35.380 35.380 36.390 -1.010 25768 11901 1 14 . 1 1 3 3 LYS H H 3 8.620 8.620 8.371 0.249 25768 11902 1 14 . 1 1 4 4 ALA N N 4 120.860 120.860 123.201 -2.341 25768 11903 1 14 . 1 1 4 4 ALA C C 4 178.190 178.190 178.532 -0.342 25768 11904 1 14 . 1 1 4 4 ALA CA C 4 53.480 53.480 53.285 0.195 25768 11905 1 14 . 1 1 4 4 ALA CB C 4 18.140 18.140 18.329 -0.189 25768 11906 1 14 . 1 1 4 4 ALA H H 4 8.580 8.580 8.357 0.223 25768 11907 1 14 . 1 1 5 5 GLY N N 5 112.890 112.890 112.437 0.453 25768 11908 1 14 . 1 1 5 5 GLY C C 5 173.830 173.830 173.577 0.253 25768 11909 1 14 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.611 0.270 25768 11910 1 14 . 1 1 5 5 GLY H H 5 9.210 9.210 8.641 0.569 25768 11911 1 14 . 1 1 6 6 ASP N N 6 121.590 121.590 120.883 0.707 25768 11912 1 14 . 1 1 6 6 ASP C C 6 174.380 174.380 174.877 -0.497 25768 11913 1 14 . 1 1 6 6 ASP CA C 6 55.790 55.790 54.388 1.402 25768 11914 1 14 . 1 1 6 6 ASP CB C 6 41.760 41.760 41.615 0.145 25768 11915 1 14 . 1 1 6 6 ASP H H 6 7.620 7.620 7.438 0.182 25768 11916 1 14 . 1 1 7 7 PHE N N 7 120.860 120.860 120.758 0.102 25768 11917 1 14 . 1 1 7 7 PHE C C 7 174.050 174.050 174.739 -0.689 25768 11918 1 14 . 1 1 7 7 PHE CA C 7 56.110 56.110 58.579 -2.469 25768 11919 1 14 . 1 1 7 7 PHE CB C 7 42.550 42.550 41.164 1.386 25768 11920 1 14 . 1 1 7 7 PHE H H 7 8.250 8.250 8.549 -0.299 25768 11921 1 14 . 1 1 8 8 ILE N N 8 127.950 127.950 121.528 6.422 25768 11922 1 14 . 1 1 8 8 ILE C C 8 174.000 174.000 174.098 -0.098 25768 11923 1 14 . 1 1 8 8 ILE CA C 8 61.160 61.160 60.519 0.641 25768 11924 1 14 . 1 1 8 8 ILE CB C 8 42.660 42.660 41.939 0.721 25768 11925 1 14 . 1 1 8 8 ILE H H 8 9.230 9.230 7.997 1.233 25768 11926 1 14 . 1 1 9 9 ILE N N 9 125.380 125.380 120.721 4.659 25768 11927 1 14 . 1 1 9 9 ILE C C 9 173.630 173.630 173.966 -0.336 25768 11928 1 14 . 1 1 9 9 ILE CA C 9 59.600 59.600 59.887 -0.287 25768 11929 1 14 . 1 1 9 9 ILE CB C 9 41.180 41.180 41.316 -0.136 25768 11930 1 14 . 1 1 9 9 ILE H H 9 8.580 8.580 8.269 0.311 25768 11931 1 14 . 1 1 10 10 ARG N N 10 124.950 124.950 122.238 2.712 25768 11932 1 14 . 1 1 10 10 ARG C C 10 175.030 175.030 174.407 0.623 25768 11933 1 14 . 1 1 10 10 ARG CA C 10 53.920 53.920 54.864 -0.945 25768 11934 1 14 . 1 1 10 10 ARG CB C 10 31.880 31.880 34.900 -3.020 25768 11935 1 14 . 1 1 10 10 ARG H H 10 9.230 9.230 8.353 0.877 25768 11936 1 14 . 1 1 11 11 GLY N N 11 105.650 105.650 106.464 -0.814 25768 11937 1 14 . 1 1 11 11 GLY C C 11 172.090 172.090 172.309 -0.219 25768 11938 1 14 . 1 1 11 11 GLY CA C 11 44.460 44.460 44.405 0.055 25768 11939 1 14 . 1 1 11 11 GLY H H 11 8.780 8.780 7.881 0.899 25768 11940 1 14 . 1 1 12 12 GLY N N 12 107.800 107.800 107.405 0.395 25768 11941 1 14 . 1 1 12 12 GLY C C 12 171.460 171.460 171.523 -0.063 25768 11942 1 14 . 1 1 12 12 GLY CA C 12 46.630 46.630 43.827 2.803 25768 11943 1 14 . 1 1 12 12 GLY H H 12 8.510 8.510 7.817 0.693 25768 11944 1 14 . 1 1 13 13 PHE N N 13 119.900 119.900 118.108 1.792 25768 11945 1 14 . 1 1 13 13 PHE C C 13 174.190 174.190 173.658 0.532 25768 11946 1 14 . 1 1 13 13 PHE CA C 13 56.340 56.340 55.945 0.395 25768 11947 1 14 . 1 1 13 13 PHE CB C 13 41.090 41.090 43.730 -2.640 25768 11948 1 14 . 1 1 13 13 PHE H H 13 8.610 8.610 8.839 -0.229 25768 11949 1 14 . 1 1 14 14 ALA N N 14 128.030 128.030 124.302 3.728 25768 11950 1 14 . 1 1 14 14 ALA C C 14 176.560 176.560 176.558 0.002 25768 11951 1 14 . 1 1 14 14 ALA CA C 14 49.940 49.940 50.401 -0.461 25768 11952 1 14 . 1 1 14 14 ALA CB C 14 20.360 20.360 20.650 -0.290 25768 11953 1 14 . 1 1 14 14 ALA H H 14 9.220 9.220 7.658 1.562 25768 11954 1 14 . 1 1 15 15 THR N N 15 118.620 118.620 114.639 3.981 25768 11955 1 14 . 1 1 15 15 THR CA C 15 61.440 61.440 61.019 0.421 25768 11956 1 14 . 1 1 15 15 THR CB C 15 71.370 71.370 71.944 -0.574 25768 11957 1 14 . 1 1 15 15 THR H H 15 9.220 9.220 8.162 1.058 25768 11958 1 14 . 1 1 18 18 PRO C C 18 176.690 176.690 175.504 1.186 25768 11959 1 14 . 1 1 18 18 PRO CA C 18 63.610 63.610 63.521 0.089 25768 11960 1 14 . 1 1 18 18 PRO CB C 18 32.440 32.440 32.255 0.185 25768 11961 1 14 . 1 1 19 19 ASP N N 19 120.320 120.320 122.548 -2.228 25768 11962 1 14 . 1 1 19 19 ASP C C 19 175.950 175.950 175.934 0.016 25768 11963 1 14 . 1 1 19 19 ASP CA C 19 54.710 54.710 55.638 -0.928 25768 11964 1 14 . 1 1 19 19 ASP CB C 19 41.450 41.450 41.874 -0.424 25768 11965 1 14 . 1 1 19 19 ASP H H 19 8.330 8.330 8.729 -0.399 25768 11966 1 14 . 1 1 20 20 ASP N N 20 121.990 121.990 120.499 1.491 25768 11967 1 14 . 1 1 20 20 ASP C C 20 176.760 176.760 176.059 0.701 25768 11968 1 14 . 1 1 20 20 ASP CA C 20 54.470 54.470 54.128 0.342 25768 11969 1 14 . 1 1 20 20 ASP CB C 20 41.310 41.310 42.230 -0.920 25768 11970 1 14 . 1 1 20 20 ASP H H 20 8.240 8.240 8.587 -0.347 25768 11971 1 14 . 1 1 21 21 SER N N 21 117.050 117.050 115.123 1.927 25768 11972 1 14 . 1 1 21 21 SER C C 21 175.170 175.170 173.327 1.843 25768 11973 1 14 . 1 1 21 21 SER CA C 21 59.490 59.490 58.935 0.555 25768 11974 1 14 . 1 1 21 21 SER CB C 21 64.080 64.080 62.896 1.184 25768 11975 1 14 . 1 1 21 21 SER H H 21 8.360 8.360 8.488 -0.128 25768 11976 1 14 . 1 1 22 22 SER N N 22 117.820 117.820 119.700 -1.880 25768 11977 1 14 . 1 1 22 22 SER C C 22 174.940 174.940 175.172 -0.232 25768 11978 1 14 . 1 1 22 22 SER CA C 22 59.160 59.160 58.341 0.819 25768 11979 1 14 . 1 1 22 22 SER CB C 22 64.110 64.110 64.043 0.066 25768 11980 1 14 . 1 1 22 22 SER H H 22 8.310 8.310 8.180 0.130 25768 11981 1 14 . 1 1 23 23 SER N N 23 117.660 117.660 117.342 0.318 25768 11982 1 14 . 1 1 23 23 SER C C 23 174.340 174.340 172.762 1.578 25768 11983 1 14 . 1 1 23 23 SER CA C 23 59.050 59.050 59.211 -0.161 25768 11984 1 14 . 1 1 23 23 SER CB C 23 64.210 64.210 63.489 0.721 25768 11985 1 14 . 1 1 23 23 SER H H 23 8.120 8.120 8.716 -0.596 25768 11986 1 14 . 1 1 24 24 ASP N N 24 122.590 122.590 122.307 0.283 25768 11987 1 14 . 1 1 24 24 ASP C C 24 176.250 176.250 175.427 0.823 25768 11988 1 14 . 1 1 24 24 ASP CA C 24 54.910 54.910 53.522 1.388 25768 11989 1 14 . 1 1 24 24 ASP CB C 24 41.270 41.270 42.871 -1.601 25768 11990 1 14 . 1 1 24 24 ASP H H 24 8.230 8.230 8.053 0.177 25768 11991 1 14 . 1 1 25 25 ILE N N 25 120.650 120.650 122.361 -1.711 25768 11992 1 14 . 1 1 25 25 ILE C C 25 176.190 176.190 175.831 0.359 25768 11993 1 14 . 1 1 25 25 ILE CA C 25 61.880 61.880 61.556 0.324 25768 11994 1 14 . 1 1 25 25 ILE CB C 25 38.730 38.730 38.533 0.196 25768 11995 1 14 . 1 1 25 25 ILE H H 25 7.860 7.860 8.424 -0.564 25768 11996 1 14 . 1 1 26 26 LYS N N 26 124.420 124.420 123.164 1.256 25768 11997 1 14 . 1 1 26 26 LYS C C 26 176.640 176.640 175.982 0.658 25768 11998 1 14 . 1 1 26 26 LYS CA C 26 56.520 56.520 56.526 -0.006 25768 11999 1 14 . 1 1 26 26 LYS CB C 26 32.890 32.890 33.096 -0.206 25768 12000 1 14 . 1 1 26 26 LYS H H 26 8.140 8.140 8.280 -0.140 25768 12001 1 14 . 1 1 27 27 LEU N N 27 123.120 123.120 122.422 0.698 25768 12002 1 14 . 1 1 27 27 LEU C C 27 177.110 177.110 175.295 1.815 25768 12003 1 14 . 1 1 27 27 LEU CA C 27 55.590 55.590 54.368 1.222 25768 12004 1 14 . 1 1 27 27 LEU CB C 27 42.500 42.500 41.763 0.737 25768 12005 1 14 . 1 1 27 27 LEU H H 27 8.080 8.080 8.370 -0.290 25768 12006 1 14 . 1 1 28 28 ASP N N 28 120.850 120.850 125.972 -5.122 25768 12007 1 14 . 1 1 28 28 ASP C C 28 176.960 176.960 175.564 1.396 25768 12008 1 14 . 1 1 28 28 ASP CA C 28 54.800 54.800 54.330 0.470 25768 12009 1 14 . 1 1 28 28 ASP CB C 28 41.380 41.380 41.003 0.377 25768 12010 1 14 . 1 1 28 28 ASP H H 28 8.180 8.180 8.093 0.087 25768 12011 1 14 . 1 1 29 29 GLY N N 29 109.800 109.800 110.514 -0.714 25768 12012 1 14 . 1 1 29 29 GLY C C 29 174.370 174.370 172.831 1.539 25768 12013 1 14 . 1 1 29 29 GLY CA C 29 46.150 46.150 44.358 1.792 25768 12014 1 14 . 1 1 29 29 GLY H H 29 8.230 8.230 7.836 0.394 25768 12015 1 14 . 1 1 30 30 ALA N N 30 123.880 123.880 125.004 -1.124 25768 12016 1 14 . 1 1 30 30 ALA C C 30 178.040 178.040 176.118 1.922 25768 12017 1 14 . 1 1 30 30 ALA CA C 30 53.140 53.140 51.950 1.190 25768 12018 1 14 . 1 1 30 30 ALA CB C 30 19.350 19.350 20.764 -1.414 25768 12019 1 14 . 1 1 30 30 ALA H H 30 8.040 8.040 8.131 -0.091 25768 12020 1 14 . 1 1 31 31 LYS N N 31 119.800 119.800 122.025 -2.225 25768 12021 1 14 . 1 1 31 31 LYS C C 31 176.770 176.770 175.040 1.730 25768 12022 1 14 . 1 1 31 31 LYS CA C 31 56.870 56.870 56.225 0.645 25768 12023 1 14 . 1 1 31 31 LYS CB C 31 32.980 32.980 34.145 -1.165 25768 12024 1 14 . 1 1 31 31 LYS H H 31 8.060 8.060 8.294 -0.234 25768 12025 1 14 . 1 1 32 32 GLN N N 32 120.930 120.930 120.907 0.023 25768 12026 1 14 . 1 1 32 32 GLN C C 32 176.000 176.000 175.828 0.172 25768 12027 1 14 . 1 1 32 32 GLN CA C 32 56.280 56.280 55.139 1.141 25768 12028 1 14 . 1 1 32 32 GLN CB C 32 29.580 29.580 30.135 -0.555 25768 12029 1 14 . 1 1 32 32 GLN H H 32 8.170 8.170 8.388 -0.218 25768 12030 1 14 . 1 1 33 33 ARG N N 33 122.370 122.370 121.163 1.207 25768 12031 1 14 . 1 1 33 33 ARG C C 33 176.820 176.820 176.641 0.179 25768 12032 1 14 . 1 1 33 33 ARG CA C 33 56.680 56.680 55.585 1.095 25768 12033 1 14 . 1 1 33 33 ARG CB C 33 31.040 31.040 31.201 -0.161 25768 12034 1 14 . 1 1 33 33 ARG H H 33 8.270 8.270 8.459 -0.189 25768 12035 1 14 . 1 1 34 34 GLY N N 34 110.210 110.210 110.601 -0.391 25768 12036 1 14 . 1 1 34 34 GLY C C 34 174.280 174.280 174.838 -0.558 25768 12037 1 14 . 1 1 34 34 GLY CA C 34 45.770 45.770 45.733 0.037 25768 12038 1 14 . 1 1 34 34 GLY H H 34 8.360 8.360 8.794 -0.434 25768 12039 1 14 . 1 1 35 35 THR N N 35 114.100 114.100 112.240 1.860 25768 12040 1 14 . 1 1 35 35 THR C C 35 174.550 174.550 173.992 0.558 25768 12041 1 14 . 1 1 35 35 THR CA C 35 62.140 62.140 61.947 0.193 25768 12042 1 14 . 1 1 35 35 THR CB C 35 70.330 70.330 69.787 0.543 25768 12043 1 14 . 1 1 35 35 THR H H 35 7.970 7.970 7.771 0.199 25768 12044 1 14 . 1 1 36 36 LYS N N 36 123.850 123.850 122.556 1.294 25768 12045 1 14 . 1 1 36 36 LYS C C 36 176.040 176.040 175.920 0.120 25768 12046 1 14 . 1 1 36 36 LYS CA C 36 56.600 56.600 55.689 0.911 25768 12047 1 14 . 1 1 36 36 LYS CB C 36 33.280 33.280 33.469 -0.189 25768 12048 1 14 . 1 1 36 36 LYS H H 36 8.230 8.230 7.993 0.237 25768 12049 1 14 . 1 1 37 37 ALA N N 37 125.650 125.650 126.927 -1.277 25768 12050 1 14 . 1 1 37 37 ALA C C 37 177.570 177.570 177.087 0.483 25768 12051 1 14 . 1 1 37 37 ALA CA C 37 52.860 52.860 52.557 0.303 25768 12052 1 14 . 1 1 37 37 ALA CB C 37 19.610 19.610 19.408 0.202 25768 12053 1 14 . 1 1 37 37 ALA H H 37 8.290 8.290 8.589 -0.299 25768 12054 1 14 . 1 1 38 38 THR N N 38 113.350 113.350 112.054 1.296 25768 12055 1 14 . 1 1 38 38 THR C C 38 174.540 174.540 174.563 -0.023 25768 12056 1 14 . 1 1 38 38 THR CA C 38 62.010 62.010 61.914 0.096 25768 12057 1 14 . 1 1 38 38 THR CB C 38 70.350 70.350 68.821 1.529 25768 12058 1 14 . 1 1 38 38 THR H H 38 7.970 7.970 7.827 0.143 25768 12059 1 14 . 1 1 39 39 VAL N N 39 120.790 120.790 120.129 0.661 25768 12060 1 14 . 1 1 39 39 VAL C C 39 175.620 175.620 175.613 0.007 25768 12061 1 14 . 1 1 39 39 VAL CA C 39 62.470 62.470 61.968 0.502 25768 12062 1 14 . 1 1 39 39 VAL CB C 39 32.940 32.940 32.532 0.408 25768 12063 1 14 . 1 1 39 39 VAL H H 39 8.020 8.020 7.882 0.138 25768 12064 1 14 . 1 1 40 40 ASP N N 40 123.690 123.690 121.759 1.931 25768 12065 1 14 . 1 1 40 40 ASP C C 40 176.190 176.190 176.136 0.054 25768 12066 1 14 . 1 1 40 40 ASP CA C 40 54.780 54.780 54.642 0.138 25768 12067 1 14 . 1 1 40 40 ASP CB C 40 41.590 41.590 40.956 0.634 25768 12068 1 14 . 1 1 40 40 ASP H H 40 8.310 8.310 8.448 -0.138 25768 12069 1 14 . 1 1 41 41 SER N N 41 115.470 115.470 116.568 -1.098 25768 12070 1 14 . 1 1 41 41 SER C C 41 174.170 174.170 174.788 -0.618 25768 12071 1 14 . 1 1 41 41 SER CA C 41 59.000 59.000 60.023 -1.023 25768 12072 1 14 . 1 1 41 41 SER CB C 41 64.420 64.420 63.889 0.531 25768 12073 1 14 . 1 1 41 41 SER H H 41 8.130 8.130 8.418 -0.288 25768 12074 1 14 . 1 1 42 42 ASP N N 42 122.430 122.430 118.508 3.922 25768 12075 1 14 . 1 1 42 42 ASP C C 42 175.740 175.740 174.820 0.920 25768 12076 1 14 . 1 1 42 42 ASP CA C 42 54.780 54.780 53.237 1.543 25768 12077 1 14 . 1 1 42 42 ASP CB C 42 41.620 41.620 42.598 -0.978 25768 12078 1 14 . 1 1 42 42 ASP H H 42 8.410 8.410 7.875 0.535 25768 12079 1 14 . 1 1 43 43 THR N N 43 117.580 117.580 112.290 5.290 25768 12080 1 14 . 1 1 43 43 THR C C 43 173.630 173.630 174.154 -0.524 25768 12081 1 14 . 1 1 43 43 THR CA C 43 63.120 63.120 61.515 1.605 25768 12082 1 14 . 1 1 43 43 THR CB C 43 70.650 70.650 70.757 -0.107 25768 12083 1 14 . 1 1 43 43 THR H H 43 8.010 8.010 8.269 -0.259 25768 12084 1 14 . 1 1 44 44 GLN N N 44 125.420 125.420 125.216 0.204 25768 12085 1 14 . 1 1 44 44 GLN C C 44 174.080 174.080 175.488 -1.408 25768 12086 1 14 . 1 1 44 44 GLN CA C 44 55.110 55.110 55.155 -0.045 25768 12087 1 14 . 1 1 44 44 GLN CB C 44 31.570 31.570 28.801 2.769 25768 12088 1 14 . 1 1 44 44 GLN H H 44 9.260 9.260 8.478 0.782 25768 12089 1 14 . 1 1 45 45 LEU N N 45 124.190 124.190 126.436 -2.246 25768 12090 1 14 . 1 1 45 45 LEU C C 45 175.970 175.970 177.021 -1.051 25768 12091 1 14 . 1 1 45 45 LEU CA C 45 54.690 54.690 55.312 -0.622 25768 12092 1 14 . 1 1 45 45 LEU CB C 45 42.270 42.270 42.087 0.183 25768 12093 1 14 . 1 1 45 45 LEU H H 45 8.550 8.550 8.350 0.200 25768 12094 1 14 . 1 1 46 46 GLY N N 46 113.310 113.310 112.124 1.186 25768 12095 1 14 . 1 1 46 46 GLY C C 46 171.180 171.180 173.138 -1.958 25768 12096 1 14 . 1 1 46 46 GLY CA C 46 44.400 44.400 44.342 0.058 25768 12097 1 14 . 1 1 46 46 GLY H H 46 8.810 8.810 8.568 0.242 25768 12098 1 14 . 1 1 47 47 LEU N N 47 123.890 123.890 128.372 -4.482 25768 12099 1 14 . 1 1 47 47 LEU C C 47 175.400 175.400 175.128 0.272 25768 12100 1 14 . 1 1 47 47 LEU CA C 47 53.750 53.750 54.148 -0.398 25768 12101 1 14 . 1 1 47 47 LEU CB C 47 46.800 46.800 46.148 0.652 25768 12102 1 14 . 1 1 47 47 LEU H H 47 8.590 8.590 9.217 -0.627 25768 12103 1 14 . 1 1 48 48 THR N N 48 111.210 111.210 115.179 -3.969 25768 12104 1 14 . 1 1 48 48 THR C C 48 172.520 172.520 173.340 -0.820 25768 12105 1 14 . 1 1 48 48 THR CA C 48 58.950 58.950 59.921 -0.971 25768 12106 1 14 . 1 1 48 48 THR CB C 48 72.360 72.360 71.597 0.763 25768 12107 1 14 . 1 1 48 48 THR H H 48 8.620 8.620 9.155 -0.535 25768 12108 1 14 . 1 1 49 49 PHE N N 49 118.810 118.810 125.716 -6.906 25768 12109 1 14 . 1 1 49 49 PHE C C 49 174.700 174.700 175.645 -0.945 25768 12110 1 14 . 1 1 49 49 PHE CA C 49 55.080 55.080 56.809 -1.729 25768 12111 1 14 . 1 1 49 49 PHE CB C 49 42.360 42.360 41.190 1.170 25768 12112 1 14 . 1 1 49 49 PHE H H 49 8.410 8.410 8.303 0.107 25768 12113 1 14 . 1 1 50 50 THR N N 50 121.230 121.230 123.925 -2.695 25768 12114 1 14 . 1 1 50 50 THR C C 50 173.250 173.250 172.671 0.579 25768 12115 1 14 . 1 1 50 50 THR CA C 50 62.740 62.740 62.264 0.476 25768 12116 1 14 . 1 1 50 50 THR CB C 50 73.740 73.740 70.101 3.639 25768 12117 1 14 . 1 1 50 50 THR H H 50 9.330 9.330 8.246 1.084 25768 12118 1 14 . 1 1 51 51 TYR N N 51 126.010 126.010 127.308 -1.298 25768 12119 1 14 . 1 1 51 51 TYR C C 51 174.850 174.850 174.798 0.052 25768 12120 1 14 . 1 1 51 51 TYR CA C 51 56.240 56.240 56.681 -0.441 25768 12121 1 14 . 1 1 51 51 TYR CB C 51 41.630 41.630 41.003 0.627 25768 12122 1 14 . 1 1 51 51 TYR H H 51 9.150 9.150 9.170 -0.020 25768 12123 1 14 . 1 1 52 52 MET N N 52 127.390 127.390 127.131 0.259 25768 12124 1 14 . 1 1 52 52 MET C C 52 174.490 174.490 174.377 0.113 25768 12125 1 14 . 1 1 52 52 MET CA C 52 52.450 52.450 56.716 -4.266 25768 12126 1 14 . 1 1 52 52 MET CB C 52 28.590 28.590 33.275 -4.685 25768 12127 1 14 . 1 1 52 52 MET H H 52 7.950 7.950 8.122 -0.172 25768 12128 1 14 . 1 1 53 53 PHE N N 53 123.830 123.830 126.600 -2.770 25768 12129 1 14 . 1 1 53 53 PHE C C 53 173.720 173.720 173.616 0.104 25768 12130 1 14 . 1 1 53 53 PHE CA C 53 57.110 57.110 56.842 0.268 25768 12131 1 14 . 1 1 53 53 PHE CB C 53 39.420 39.420 41.220 -1.800 25768 12132 1 14 . 1 1 53 53 PHE H H 53 7.720 7.720 8.385 -0.665 25768 12133 1 14 . 1 1 54 54 ALA N N 54 125.650 125.650 127.952 -2.302 25768 12134 1 14 . 1 1 54 54 ALA C C 54 175.020 175.020 175.581 -0.561 25768 12135 1 14 . 1 1 54 54 ALA CA C 54 50.740 50.740 52.922 -2.182 25768 12136 1 14 . 1 1 54 54 ALA CB C 54 22.700 22.700 18.466 4.234 25768 12137 1 14 . 1 1 54 54 ALA H H 54 8.360 8.360 8.118 0.242 25768 12138 1 14 . 1 1 55 55 ASP N N 55 118.790 118.790 117.613 1.177 25768 12139 1 14 . 1 1 55 55 ASP C C 55 174.780 174.780 175.748 -0.968 25768 12140 1 14 . 1 1 55 55 ASP CA C 55 58.590 58.590 54.804 3.786 25768 12141 1 14 . 1 1 55 55 ASP CB C 55 40.430 40.430 40.460 -0.030 25768 12142 1 14 . 1 1 55 55 ASP H H 55 8.590 8.590 8.462 0.128 25768 12143 1 14 . 1 1 56 56 LYS N N 56 106.200 106.200 117.033 -10.833 25768 12144 1 14 . 1 1 56 56 LYS C C 56 174.940 174.940 174.966 -0.026 25768 12145 1 14 . 1 1 56 56 LYS CA C 56 55.260 55.260 56.635 -1.375 25768 12146 1 14 . 1 1 56 56 LYS CB C 56 34.510 34.510 34.992 -0.482 25768 12147 1 14 . 1 1 56 56 LYS H H 56 7.260 7.260 7.195 0.065 25768 12148 1 14 . 1 1 57 57 TRP N N 57 115.680 115.680 120.840 -5.160 25768 12149 1 14 . 1 1 57 57 TRP C C 57 173.940 173.940 175.921 -1.981 25768 12150 1 14 . 1 1 57 57 TRP CA C 57 55.410 55.410 56.631 -1.221 25768 12151 1 14 . 1 1 57 57 TRP CB C 57 34.470 34.470 32.556 1.915 25768 12152 1 14 . 1 1 57 57 TRP H H 57 6.570 6.570 8.064 -1.494 25768 12153 1 14 . 1 1 58 58 GLY N N 58 107.610 107.610 106.268 1.342 25768 12154 1 14 . 1 1 58 58 GLY C C 58 172.730 172.730 172.079 0.651 25768 12155 1 14 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.795 -0.745 25768 12156 1 14 . 1 1 58 58 GLY H H 58 9.260 9.260 8.421 0.839 25768 12157 1 14 . 1 1 59 59 VAL N N 59 118.130 118.130 121.035 -2.905 25768 12158 1 14 . 1 1 59 59 VAL C C 59 173.000 173.000 174.955 -1.955 25768 12159 1 14 . 1 1 59 59 VAL CA C 59 59.950 59.950 60.656 -0.706 25768 12160 1 14 . 1 1 59 59 VAL CB C 59 35.170 35.170 34.070 1.100 25768 12161 1 14 . 1 1 59 59 VAL H H 59 9.030 9.030 9.168 -0.138 25768 12162 1 14 . 1 1 60 60 GLU N N 60 127.900 127.900 125.243 2.657 25768 12163 1 14 . 1 1 60 60 GLU C C 60 174.470 174.470 174.072 0.398 25768 12164 1 14 . 1 1 60 60 GLU CA C 60 52.940 52.940 55.278 -2.338 25768 12165 1 14 . 1 1 60 60 GLU CB C 60 35.100 35.100 33.650 1.450 25768 12166 1 14 . 1 1 60 60 GLU H H 60 9.440 9.440 8.446 0.994 25768 12167 1 14 . 1 1 61 61 LEU N N 61 127.410 127.410 125.406 2.004 25768 12168 1 14 . 1 1 61 61 LEU C C 61 174.950 174.950 175.623 -0.673 25768 12169 1 14 . 1 1 61 61 LEU CA C 61 53.390 53.390 53.990 -0.600 25768 12170 1 14 . 1 1 61 61 LEU CB C 61 45.980 45.980 45.700 0.280 25768 12171 1 14 . 1 1 61 61 LEU H H 61 8.740 8.740 8.245 0.495 25768 12172 1 14 . 1 1 62 62 VAL N N 62 125.750 125.750 120.329 5.421 25768 12173 1 14 . 1 1 62 62 VAL C C 62 173.960 173.960 174.102 -0.142 25768 12174 1 14 . 1 1 62 62 VAL CA C 62 61.350 61.350 61.556 -0.206 25768 12175 1 14 . 1 1 62 62 VAL CB C 62 34.740 34.740 34.724 0.017 25768 12176 1 14 . 1 1 62 62 VAL H H 62 8.790 8.790 8.254 0.536 25768 12177 1 14 . 1 1 63 63 ALA N N 63 127.230 127.230 128.249 -1.019 25768 12178 1 14 . 1 1 63 63 ALA C C 63 173.930 173.930 175.121 -1.191 25768 12179 1 14 . 1 1 63 63 ALA CA C 63 51.140 51.140 51.456 -0.316 25768 12180 1 14 . 1 1 63 63 ALA CB C 63 22.500 22.500 22.299 0.201 25768 12181 1 14 . 1 1 63 63 ALA H H 63 8.740 8.740 8.544 0.196 25768 12182 1 14 . 1 1 64 64 ALA N N 64 120.410 120.410 124.296 -3.886 25768 12183 1 14 . 1 1 64 64 ALA C C 64 176.770 176.770 176.698 0.072 25768 12184 1 14 . 1 1 64 64 ALA CA C 64 51.420 51.420 50.757 0.663 25768 12185 1 14 . 1 1 64 64 ALA CB C 64 22.590 22.590 21.940 0.650 25768 12186 1 14 . 1 1 64 64 ALA H H 64 8.290 8.290 8.266 0.024 25768 12187 1 14 . 1 1 65 65 THR N N 65 116.130 116.130 114.571 1.559 25768 12188 1 14 . 1 1 65 65 THR C C 65 171.220 171.220 173.585 -2.365 25768 12189 1 14 . 1 1 65 65 THR CA C 65 58.860 58.860 58.641 0.219 25768 12190 1 14 . 1 1 65 65 THR CB C 65 72.020 72.020 68.927 3.093 25768 12191 1 14 . 1 1 65 65 THR H H 65 8.760 8.760 8.354 0.406 25768 12192 1 14 . 1 1 66 66 PRO C C 66 176.720 176.720 176.146 0.574 25768 12193 1 14 . 1 1 66 66 PRO CA C 66 63.610 63.610 64.025 -0.415 25768 12194 1 14 . 1 1 66 66 PRO CB C 66 32.550 32.550 31.860 0.690 25768 12195 1 14 . 1 1 67 67 PHE N N 67 120.360 120.360 115.921 4.439 25768 12196 1 14 . 1 1 67 67 PHE C C 67 175.480 175.480 175.612 -0.132 25768 12197 1 14 . 1 1 67 67 PHE CA C 67 58.840 58.840 58.507 0.333 25768 12198 1 14 . 1 1 67 67 PHE CB C 67 40.170 40.170 40.656 -0.486 25768 12199 1 14 . 1 1 67 67 PHE H H 67 8.590 8.590 7.803 0.787 25768 12200 1 14 . 1 1 68 68 ASN N N 68 119.030 119.030 118.352 0.678 25768 12201 1 14 . 1 1 68 68 ASN C C 68 174.740 174.740 174.584 0.156 25768 12202 1 14 . 1 1 68 68 ASN CA C 68 53.430 53.430 54.573 -1.143 25768 12203 1 14 . 1 1 68 68 ASN CB C 68 39.420 39.420 39.750 -0.330 25768 12204 1 14 . 1 1 68 68 ASN H H 68 8.340 8.340 8.794 -0.454 25768 12205 1 14 . 1 1 69 69 HIS N N 69 119.590 119.590 117.703 1.887 25768 12206 1 14 . 1 1 69 69 HIS C C 69 174.370 174.370 173.993 0.377 25768 12207 1 14 . 1 1 69 69 HIS CA C 69 55.950 55.950 57.225 -1.275 25768 12208 1 14 . 1 1 69 69 HIS CB C 69 29.960 29.960 33.004 -3.044 25768 12209 1 14 . 1 1 69 69 HIS H H 69 8.350 8.350 8.217 0.133 25768 12210 1 14 . 1 1 70 70 GLN N N 70 121.980 121.980 118.303 3.677 25768 12211 1 14 . 1 1 70 70 GLN C C 70 175.740 175.740 174.703 1.037 25768 12212 1 14 . 1 1 70 70 GLN CA C 70 56.340 56.340 55.799 0.541 25768 12213 1 14 . 1 1 70 70 GLN CB C 70 29.660 29.660 31.769 -2.109 25768 12214 1 14 . 1 1 70 70 GLN H H 70 8.350 8.350 8.137 0.213 25768 12215 1 14 . 1 1 71 71 VAL N N 71 120.530 120.530 117.396 3.134 25768 12216 1 14 . 1 1 71 71 VAL C C 71 175.500 175.500 175.519 -0.019 25768 12217 1 14 . 1 1 71 71 VAL CA C 71 62.540 62.540 63.048 -0.508 25768 12218 1 14 . 1 1 71 71 VAL CB C 71 33.090 33.090 32.409 0.681 25768 12219 1 14 . 1 1 71 71 VAL H H 71 8.020 8.020 8.297 -0.277 25768 12220 1 14 . 1 1 72 72 ASP N N 72 123.910 123.910 121.446 2.464 25768 12221 1 14 . 1 1 72 72 ASP C C 72 176.300 176.300 176.225 0.075 25768 12222 1 14 . 1 1 72 72 ASP CA C 72 54.340 54.340 53.883 0.457 25768 12223 1 14 . 1 1 72 72 ASP CB C 72 41.480 41.480 41.865 -0.385 25768 12224 1 14 . 1 1 72 72 ASP H H 72 8.280 8.280 8.067 0.213 25768 12225 1 14 . 1 1 73 73 VAL N N 73 120.580 120.580 118.914 1.666 25768 12226 1 14 . 1 1 73 73 VAL C C 73 176.350 176.350 176.148 0.202 25768 12227 1 14 . 1 1 73 73 VAL CA C 73 62.970 62.970 62.536 0.434 25768 12228 1 14 . 1 1 73 73 VAL CB C 73 32.550 32.550 32.469 0.081 25768 12229 1 14 . 1 1 73 73 VAL H H 73 7.960 7.960 8.454 -0.494 25768 12230 1 14 . 1 1 74 74 LYS N N 74 123.620 123.620 121.927 1.693 25768 12231 1 14 . 1 1 74 74 LYS C C 74 177.130 177.130 175.778 1.352 25768 12232 1 14 . 1 1 74 74 LYS CA C 74 57.060 57.060 55.784 1.276 25768 12233 1 14 . 1 1 74 74 LYS CB C 74 32.860 32.860 34.066 -1.206 25768 12234 1 14 . 1 1 74 74 LYS H H 74 8.230 8.230 7.971 0.259 25768 12235 1 14 . 1 1 75 75 GLY N N 75 109.370 109.370 110.655 -1.285 25768 12236 1 14 . 1 1 75 75 GLY C C 75 174.030 174.030 174.628 -0.598 25768 12237 1 14 . 1 1 75 75 GLY CA C 75 45.800 45.800 44.410 1.390 25768 12238 1 14 . 1 1 75 75 GLY H H 75 8.160 8.160 8.252 -0.092 25768 12239 1 14 . 1 1 76 76 LEU N N 76 121.660 121.660 122.544 -0.884 25768 12240 1 14 . 1 1 76 76 LEU C C 76 177.410 177.410 177.688 -0.278 25768 12241 1 14 . 1 1 76 76 LEU CA C 76 55.410 55.410 55.824 -0.414 25768 12242 1 14 . 1 1 76 76 LEU CB C 76 42.790 42.790 42.746 0.044 25768 12243 1 14 . 1 1 76 76 LEU H H 76 8.030 8.030 8.517 -0.487 25768 12244 1 14 . 1 1 77 77 GLY N N 77 109.330 109.330 111.983 -2.653 25768 12245 1 14 . 1 1 77 77 GLY C C 77 171.800 171.800 173.539 -1.739 25768 12246 1 14 . 1 1 77 77 GLY CA C 77 44.990 44.990 45.143 -0.153 25768 12247 1 14 . 1 1 77 77 GLY H H 77 8.100 8.100 8.823 -0.723 25768 12248 1 14 . 1 1 78 78 PRO C C 78 177.740 177.740 176.782 0.958 25768 12249 1 14 . 1 1 78 78 PRO CA C 78 63.890 63.890 62.528 1.363 25768 12250 1 14 . 1 1 78 78 PRO CB C 78 32.170 32.170 32.284 -0.114 25768 12251 1 14 . 1 1 79 79 GLY N N 79 109.530 109.530 107.668 1.862 25768 12252 1 14 . 1 1 79 79 GLY C C 79 174.460 174.460 174.444 0.016 25768 12253 1 14 . 1 1 79 79 GLY CA C 79 45.780 45.780 44.267 1.513 25768 12254 1 14 . 1 1 79 79 GLY H H 79 8.410 8.410 8.131 0.279 25768 12255 1 14 . 1 1 80 80 LEU N N 80 121.880 121.880 120.912 0.968 25768 12256 1 14 . 1 1 80 80 LEU C C 80 177.100 177.100 176.363 0.737 25768 12257 1 14 . 1 1 80 80 LEU CA C 80 55.720 55.720 56.108 -0.388 25768 12258 1 14 . 1 1 80 80 LEU CB C 80 42.580 42.580 41.853 0.727 25768 12259 1 14 . 1 1 80 80 LEU H H 80 8.010 8.010 8.272 -0.262 25768 12260 1 14 . 1 1 81 81 ASP N N 81 119.990 119.990 122.895 -2.905 25768 12261 1 14 . 1 1 81 81 ASP C C 81 176.880 176.880 176.296 0.584 25768 12262 1 14 . 1 1 81 81 ASP CA C 81 54.770 54.770 54.399 0.371 25768 12263 1 14 . 1 1 81 81 ASP CB C 81 41.390 41.390 41.571 -0.181 25768 12264 1 14 . 1 1 81 81 ASP H H 81 8.220 8.220 8.626 -0.406 25768 12265 1 14 . 1 1 82 82 GLY N N 82 109.270 109.270 109.370 -0.100 25768 12266 1 14 . 1 1 82 82 GLY C C 82 174.190 174.190 174.639 -0.449 25768 12267 1 14 . 1 1 82 82 GLY CA C 82 45.990 45.990 45.684 0.306 25768 12268 1 14 . 1 1 82 82 GLY H H 82 8.170 8.170 8.757 -0.587 25768 12269 1 14 . 1 1 83 83 LYS N N 83 121.000 121.000 117.517 3.483 25768 12270 1 14 . 1 1 83 83 LYS C C 83 176.610 176.610 175.973 0.637 25768 12271 1 14 . 1 1 83 83 LYS CA C 83 56.620 56.620 56.348 0.272 25768 12272 1 14 . 1 1 83 83 LYS CB C 83 33.020 33.020 32.313 0.707 25768 12273 1 14 . 1 1 83 83 LYS H H 83 7.970 7.970 8.361 -0.391 25768 12274 1 14 . 1 1 84 84 LEU N N 84 123.120 123.120 121.905 1.215 25768 12275 1 14 . 1 1 84 84 LEU C C 84 176.920 176.920 177.364 -0.444 25768 12276 1 14 . 1 1 84 84 LEU CA C 84 55.550 55.550 54.024 1.526 25768 12277 1 14 . 1 1 84 84 LEU CB C 84 42.430 42.430 42.679 -0.249 25768 12278 1 14 . 1 1 84 84 LEU H H 84 8.130 8.130 7.597 0.533 25768 12279 1 14 . 1 1 85 85 ALA N N 85 123.930 123.930 122.705 1.225 25768 12280 1 14 . 1 1 85 85 ALA C C 85 177.060 177.060 177.686 -0.626 25768 12281 1 14 . 1 1 85 85 ALA CA C 85 52.790 52.790 53.154 -0.364 25768 12282 1 14 . 1 1 85 85 ALA CB C 85 19.670 19.670 19.123 0.547 25768 12283 1 14 . 1 1 85 85 ALA H H 85 8.040 8.040 8.264 -0.224 25768 12284 1 14 . 1 1 86 86 ASP N N 86 119.760 119.760 116.455 3.305 25768 12285 1 14 . 1 1 86 86 ASP C C 86 175.820 175.820 173.788 2.032 25768 12286 1 14 . 1 1 86 86 ASP CA C 86 54.520 54.520 54.339 0.181 25768 12287 1 14 . 1 1 86 86 ASP CB C 86 41.390 41.390 42.087 -0.697 25768 12288 1 14 . 1 1 86 86 ASP H H 86 8.110 8.110 7.973 0.137 25768 12289 1 14 . 1 1 87 87 ILE N N 87 120.620 120.620 122.852 -2.232 25768 12290 1 14 . 1 1 87 87 ILE C C 87 175.740 175.740 174.837 0.903 25768 12291 1 14 . 1 1 87 87 ILE CA C 87 61.160 61.160 60.588 0.572 25768 12292 1 14 . 1 1 87 87 ILE CB C 87 39.260 39.260 38.639 0.621 25768 12293 1 14 . 1 1 87 87 ILE H H 87 7.800 7.800 8.214 -0.414 25768 12294 1 14 . 1 1 88 88 LYS N N 88 125.820 125.820 127.543 -1.723 25768 12295 1 14 . 1 1 88 88 LYS C C 88 175.340 175.340 174.987 0.353 25768 12296 1 14 . 1 1 88 88 LYS CA C 88 56.300 56.300 55.193 1.107 25768 12297 1 14 . 1 1 88 88 LYS CB C 88 32.900 32.900 33.508 -0.608 25768 12298 1 14 . 1 1 88 88 LYS H H 88 8.250 8.250 8.431 -0.181 25768 12299 1 14 . 1 1 89 89 GLN N N 89 121.750 121.750 120.388 1.362 25768 12300 1 14 . 1 1 89 89 GLN C C 89 175.000 175.000 175.240 -0.240 25768 12301 1 14 . 1 1 89 89 GLN CA C 89 55.210 55.210 55.703 -0.493 25768 12302 1 14 . 1 1 89 89 GLN CB C 89 30.570 30.570 29.542 1.028 25768 12303 1 14 . 1 1 89 89 GLN H H 89 8.000 8.000 8.286 -0.286 25768 12304 1 14 . 1 1 90 90 LEU N N 90 126.660 126.660 123.813 2.847 25768 12305 1 14 . 1 1 90 90 LEU C C 90 174.240 174.240 175.347 -1.107 25768 12306 1 14 . 1 1 90 90 LEU CA C 90 52.720 52.720 52.286 0.434 25768 12307 1 14 . 1 1 90 90 LEU CB C 90 42.350 42.350 43.416 -1.066 25768 12308 1 14 . 1 1 90 90 LEU H H 90 8.630 8.630 8.405 0.225 25768 12309 1 14 . 1 1 92 92 PRO C C 92 173.900 173.900 176.997 -3.097 25768 12310 1 14 . 1 1 92 92 PRO CA C 92 63.320 63.320 62.378 0.942 25768 12311 1 14 . 1 1 92 92 PRO CB C 92 31.920 31.920 32.787 -0.867 25768 12312 1 14 . 1 1 93 93 THR N N 93 119.770 119.770 113.204 6.566 25768 12313 1 14 . 1 1 93 93 THR C C 93 171.360 171.360 173.761 -2.401 25768 12314 1 14 . 1 1 93 93 THR CA C 93 62.610 62.610 62.038 0.572 25768 12315 1 14 . 1 1 93 93 THR CB C 93 72.680 72.680 71.195 1.485 25768 12316 1 14 . 1 1 93 93 THR H H 93 8.290 8.290 8.154 0.136 25768 12317 1 14 . 1 1 94 94 LEU N N 94 128.880 128.880 126.544 2.336 25768 12318 1 14 . 1 1 94 94 LEU C C 94 175.130 175.130 175.426 -0.296 25768 12319 1 14 . 1 1 94 94 LEU CA C 94 53.520 53.520 54.711 -1.191 25768 12320 1 14 . 1 1 94 94 LEU CB C 94 46.140 46.140 44.709 1.431 25768 12321 1 14 . 1 1 94 94 LEU H H 94 8.680 8.680 8.750 -0.070 25768 12322 1 14 . 1 1 95 95 LEU N N 95 123.630 123.630 121.645 1.985 25768 12323 1 14 . 1 1 95 95 LEU C C 95 175.540 175.540 175.153 0.387 25768 12324 1 14 . 1 1 95 95 LEU CA C 95 55.190 55.190 54.619 0.571 25768 12325 1 14 . 1 1 95 95 LEU CB C 95 45.300 45.300 46.745 -1.445 25768 12326 1 14 . 1 1 95 95 LEU H H 95 9.580 9.580 8.606 0.974 25768 12327 1 14 . 1 1 96 96 LEU N N 96 123.150 123.150 122.486 0.664 25768 12328 1 14 . 1 1 96 96 LEU C C 96 174.960 174.960 175.908 -0.948 25768 12329 1 14 . 1 1 96 96 LEU CA C 96 54.420 54.420 54.745 -0.325 25768 12330 1 14 . 1 1 96 96 LEU CB C 96 44.560 44.560 42.760 1.800 25768 12331 1 14 . 1 1 96 96 LEU H H 96 8.770 8.770 9.123 -0.353 25768 12332 1 14 . 1 1 97 97 GLN N N 97 121.290 121.290 124.334 -3.044 25768 12333 1 14 . 1 1 97 97 GLN C C 97 174.380 174.380 174.666 -0.286 25768 12334 1 14 . 1 1 97 97 GLN CA C 97 54.740 54.740 54.397 0.344 25768 12335 1 14 . 1 1 97 97 GLN CB C 97 36.600 36.600 31.816 4.784 25768 12336 1 14 . 1 1 97 97 GLN H H 97 9.480 9.480 9.014 0.466 25768 12337 1 14 . 1 1 98 98 TYR N N 98 122.250 122.250 119.789 2.461 25768 12338 1 14 . 1 1 98 98 TYR C C 98 173.460 173.460 173.745 -0.285 25768 12339 1 14 . 1 1 98 98 TYR CA C 98 55.160 55.160 55.499 -0.339 25768 12340 1 14 . 1 1 98 98 TYR CB C 98 42.420 42.420 41.009 1.411 25768 12341 1 14 . 1 1 98 98 TYR H H 98 9.010 9.010 8.625 0.385 25768 12342 1 14 . 1 1 99 99 TYR N N 99 126.860 126.860 119.294 7.566 25768 12343 1 14 . 1 1 99 99 TYR C C 99 175.380 175.380 174.026 1.354 25768 12344 1 14 . 1 1 99 99 TYR CA C 99 54.220 54.220 54.392 -0.172 25768 12345 1 14 . 1 1 99 99 TYR CB C 99 38.890 38.890 37.583 1.307 25768 12346 1 14 . 1 1 99 99 TYR H H 99 8.300 8.300 7.707 0.593 25768 12347 1 14 . 1 1 100 100 PRO C C 100 178.330 178.330 177.938 0.392 25768 12348 1 14 . 1 1 100 100 PRO CA C 100 64.750 64.750 65.010 -0.260 25768 12349 1 14 . 1 1 100 100 PRO CB C 100 32.130 32.130 32.219 -0.089 25768 12350 1 14 . 1 1 101 101 MET N N 101 114.520 114.520 117.083 -2.563 25768 12351 1 14 . 1 1 101 101 MET C C 101 178.240 178.240 175.375 2.865 25768 12352 1 14 . 1 1 101 101 MET CA C 101 53.500 53.500 53.990 -0.490 25768 12353 1 14 . 1 1 101 101 MET CB C 101 30.160 30.160 32.343 -2.183 25768 12354 1 14 . 1 1 101 101 MET H H 101 9.390 9.390 8.011 1.379 25768 12355 1 14 . 1 1 102 102 GLY N N 102 117.500 117.500 108.538 8.962 25768 12356 1 14 . 1 1 102 102 GLY C C 102 175.690 175.690 173.791 1.899 25768 12357 1 14 . 1 1 102 102 GLY CA C 102 46.760 46.760 45.050 1.710 25768 12358 1 14 . 1 1 102 102 GLY H H 102 8.640 8.640 7.614 1.026 25768 12359 1 14 . 1 1 103 103 GLY N N 103 111.030 111.030 112.912 -1.882 25768 12360 1 14 . 1 1 103 103 GLY C C 103 174.070 174.070 174.043 0.027 25768 12361 1 14 . 1 1 103 103 GLY CA C 103 46.140 46.140 45.117 1.023 25768 12362 1 14 . 1 1 103 103 GLY H H 103 9.390 9.390 8.308 1.082 25768 12363 1 14 . 1 1 104 104 THR N N 104 109.290 109.290 112.546 -3.256 25768 12364 1 14 . 1 1 104 104 THR C C 104 174.290 174.290 174.542 -0.252 25768 12365 1 14 . 1 1 104 104 THR CA C 104 60.900 60.900 59.610 1.290 25768 12366 1 14 . 1 1 104 104 THR CB C 104 72.070 72.070 70.513 1.558 25768 12367 1 14 . 1 1 104 104 THR H H 104 7.290 7.290 7.670 -0.380 25768 12368 1 14 . 1 1 105 105 ASN C C 105 175.050 175.050 175.259 -0.209 25768 12369 1 14 . 1 1 105 105 ASN CA C 105 52.880 52.880 53.377 -0.497 25768 12370 1 14 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.632 -0.372 25768 12371 1 14 . 1 1 106 106 SER N N 106 113.000 113.000 116.130 -3.130 25768 12372 1 14 . 1 1 106 106 SER C C 106 176.000 176.000 174.376 1.624 25768 12373 1 14 . 1 1 106 106 SER CA C 106 58.700 58.700 58.491 0.209 25768 12374 1 14 . 1 1 106 106 SER CB C 106 64.540 64.540 63.824 0.716 25768 12375 1 14 . 1 1 106 106 SER H H 106 7.450 7.450 7.645 -0.195 25768 12376 1 14 . 1 1 107 107 ALA N N 107 132.220 132.220 126.960 5.260 25768 12377 1 14 . 1 1 107 107 ALA C C 107 176.610 176.610 177.094 -0.484 25768 12378 1 14 . 1 1 107 107 ALA CA C 107 54.380 54.380 53.745 0.635 25768 12379 1 14 . 1 1 107 107 ALA CB C 107 18.690 18.690 19.150 -0.460 25768 12380 1 14 . 1 1 107 107 ALA H H 107 8.870 8.870 8.289 0.581 25768 12381 1 14 . 1 1 108 108 PHE N N 108 116.050 116.050 117.258 -1.208 25768 12382 1 14 . 1 1 108 108 PHE C C 108 174.270 174.270 175.132 -0.862 25768 12383 1 14 . 1 1 108 108 PHE CA C 108 56.140 56.140 56.336 -0.196 25768 12384 1 14 . 1 1 108 108 PHE CB C 108 40.520 40.520 40.004 0.516 25768 12385 1 14 . 1 1 108 108 PHE H H 108 7.550 7.550 7.507 0.043 25768 12386 1 14 . 1 1 109 109 GLN N N 109 128.260 128.260 123.174 5.086 25768 12387 1 14 . 1 1 109 109 GLN C C 109 172.300 172.300 174.147 -1.847 25768 12388 1 14 . 1 1 109 109 GLN CA C 109 52.310 52.310 52.336 -0.026 25768 12389 1 14 . 1 1 109 109 GLN CB C 109 29.050 29.050 29.803 -0.753 25768 12390 1 14 . 1 1 109 109 GLN H H 109 9.060 9.060 8.546 0.514 25768 12391 1 14 . 1 1 110 110 PRO C C 110 175.020 175.020 176.063 -1.043 25768 12392 1 14 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.617 -1.067 25768 12393 1 14 . 1 1 110 110 PRO CB C 110 33.280 33.280 32.506 0.774 25768 12394 1 14 . 1 1 111 111 TYR N N 111 115.730 115.730 119.498 -3.768 25768 12395 1 14 . 1 1 111 111 TYR C C 111 173.850 173.850 175.466 -1.616 25768 12396 1 14 . 1 1 111 111 TYR CA C 111 56.470 56.470 57.703 -1.233 25768 12397 1 14 . 1 1 111 111 TYR CB C 111 38.650 38.650 42.560 -3.910 25768 12398 1 14 . 1 1 111 111 TYR H H 111 8.500 8.500 8.724 -0.224 25768 12399 1 14 . 1 1 112 112 GLY N N 112 103.570 103.570 110.215 -6.645 25768 12400 1 14 . 1 1 112 112 GLY C C 112 172.020 172.020 172.496 -0.476 25768 12401 1 14 . 1 1 112 112 GLY CA C 112 43.950 43.950 43.640 0.310 25768 12402 1 14 . 1 1 112 112 GLY H H 112 8.110 8.110 8.396 -0.286 25768 12403 1 14 . 1 1 113 113 GLY N N 113 108.510 108.510 110.678 -2.168 25768 12404 1 14 . 1 1 113 113 GLY C C 113 171.540 171.540 172.167 -0.627 25768 12405 1 14 . 1 1 113 113 GLY CA C 113 46.120 46.120 44.218 1.902 25768 12406 1 14 . 1 1 113 113 GLY H H 113 9.080 9.080 8.166 0.914 25768 12407 1 14 . 1 1 114 114 LEU N N 114 120.270 120.270 124.921 -4.651 25768 12408 1 14 . 1 1 114 114 LEU C C 114 175.810 175.810 175.946 -0.136 25768 12409 1 14 . 1 1 114 114 LEU CA C 114 53.920 53.920 53.592 0.328 25768 12410 1 14 . 1 1 114 114 LEU CB C 114 47.940 47.940 47.002 0.938 25768 12411 1 14 . 1 1 114 114 LEU H H 114 8.620 8.620 9.090 -0.470 25768 12412 1 14 . 1 1 115 115 GLY N N 115 110.620 110.620 112.215 -1.595 25768 12413 1 14 . 1 1 115 115 GLY C C 115 171.560 171.560 173.161 -1.601 25768 12414 1 14 . 1 1 115 115 GLY CA C 115 46.940 46.940 44.893 2.047 25768 12415 1 14 . 1 1 115 115 GLY H H 115 9.000 9.000 9.157 -0.157 25768 12416 1 14 . 1 1 116 116 VAL N N 116 113.600 113.600 122.659 -9.059 25768 12417 1 14 . 1 1 116 116 VAL C C 116 174.120 174.120 174.318 -0.198 25768 12418 1 14 . 1 1 116 116 VAL CA C 116 58.970 58.970 61.377 -2.407 25768 12419 1 14 . 1 1 116 116 VAL CB C 116 36.600 36.600 34.565 2.035 25768 12420 1 14 . 1 1 116 116 VAL H H 116 8.680 8.680 7.767 0.913 25768 12421 1 14 . 1 1 117 117 ASN N N 117 120.020 120.020 123.859 -3.839 25768 12422 1 14 . 1 1 117 117 ASN CA C 117 52.190 52.190 53.014 -0.825 25768 12423 1 14 . 1 1 117 117 ASN CB C 117 42.450 42.450 39.815 2.635 25768 12424 1 14 . 1 1 117 117 ASN H H 117 8.840 8.840 8.470 0.370 25768 12425 1 14 . 1 1 119 119 THR C C 119 174.350 174.350 173.727 0.623 25768 12426 1 14 . 1 1 119 119 THR CA C 119 63.140 63.140 61.150 1.990 25768 12427 1 14 . 1 1 119 119 THR CB C 119 70.170 70.170 70.669 -0.499 25768 12428 1 14 . 1 1 120 120 THR N N 120 114.120 114.120 117.747 -3.627 25768 12429 1 14 . 1 1 120 120 THR C C 120 174.220 174.220 174.492 -0.272 25768 12430 1 14 . 1 1 120 120 THR CA C 120 61.900 61.900 63.748 -1.848 25768 12431 1 14 . 1 1 120 120 THR CB C 120 70.140 70.140 69.283 0.857 25768 12432 1 14 . 1 1 120 120 THR H H 120 7.570 7.570 8.278 -0.708 25768 12433 1 14 . 1 1 121 121 PHE N N 121 121.230 121.230 119.799 1.431 25768 12434 1 14 . 1 1 121 121 PHE C C 121 174.910 174.910 174.293 0.617 25768 12435 1 14 . 1 1 121 121 PHE CA C 121 58.720 58.720 56.472 2.248 25768 12436 1 14 . 1 1 121 121 PHE CB C 121 40.470 40.470 40.065 0.405 25768 12437 1 14 . 1 1 121 121 PHE H H 121 7.830 7.830 7.058 0.772 25768 12438 1 14 . 1 1 122 122 PHE C C 122 175.070 175.070 173.899 1.171 25768 12439 1 14 . 1 1 122 122 PHE CA C 122 57.890 57.890 57.992 -0.102 25768 12440 1 14 . 1 1 122 122 PHE CB C 122 39.870 39.870 40.573 -0.703 25768 12441 1 14 . 1 1 123 123 ASP N N 123 122.170 122.170 125.350 -3.180 25768 12442 1 14 . 1 1 123 123 ASP C C 123 176.150 176.150 175.321 0.829 25768 12443 1 14 . 1 1 123 123 ASP CA C 123 54.530 54.530 53.819 0.710 25768 12444 1 14 . 1 1 123 123 ASP CB C 123 41.830 41.830 44.074 -2.244 25768 12445 1 14 . 1 1 123 123 ASP H H 123 7.950 7.950 8.264 -0.314 25768 12446 1 14 . 1 1 124 124 GLU N N 124 122.690 122.690 121.916 0.774 25768 12447 1 14 . 1 1 124 124 GLU C C 124 176.630 176.630 177.174 -0.544 25768 12448 1 14 . 1 1 124 124 GLU CA C 124 57.620 57.620 58.095 -0.475 25768 12449 1 14 . 1 1 124 124 GLU CB C 124 30.450 30.450 30.279 0.171 25768 12450 1 14 . 1 1 124 124 GLU H H 124 8.340 8.340 8.565 -0.225 25768 12451 1 14 . 1 1 125 125 ASP N N 125 121.280 121.280 120.945 0.335 25768 12452 1 14 . 1 1 125 125 ASP C C 125 176.940 176.940 177.521 -0.581 25768 12453 1 14 . 1 1 125 125 ASP CA C 125 55.180 55.180 56.949 -1.768 25768 12454 1 14 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.232 0.988 25768 12455 1 14 . 1 1 125 125 ASP H H 125 8.310 8.310 8.363 -0.053 25768 12456 1 14 . 1 1 126 126 LEU N N 126 122.830 122.830 119.154 3.676 25768 12457 1 14 . 1 1 126 126 LEU C C 126 178.020 178.020 178.716 -0.696 25768 12458 1 14 . 1 1 126 126 LEU CA C 126 56.450 56.450 56.571 -0.121 25768 12459 1 14 . 1 1 126 126 LEU CB C 126 42.150 42.150 41.774 0.376 25768 12460 1 14 . 1 1 126 126 LEU H H 126 8.010 8.010 7.780 0.230 25768 12461 1 14 . 1 1 127 127 ALA N N 127 122.660 122.660 119.827 2.833 25768 12462 1 14 . 1 1 127 127 ALA C C 127 178.600 178.600 177.940 0.660 25768 12463 1 14 . 1 1 127 127 ALA CA C 127 53.780 53.780 53.463 0.317 25768 12464 1 14 . 1 1 127 127 ALA CB C 127 19.000 19.000 18.827 0.173 25768 12465 1 14 . 1 1 127 127 ALA H H 127 8.100 8.100 7.855 0.245 25768 12466 1 14 . 1 1 128 128 SER N N 128 113.740 113.740 113.461 0.279 25768 12467 1 14 . 1 1 128 128 SER C C 128 175.010 175.010 174.240 0.770 25768 12468 1 14 . 1 1 128 128 SER CA C 128 59.580 59.580 58.765 0.815 25768 12469 1 14 . 1 1 128 128 SER CB C 128 63.800 63.800 63.648 0.152 25768 12470 1 14 . 1 1 128 128 SER H H 128 7.920 7.920 7.660 0.260 25768 12471 1 14 . 1 1 129 129 ASN N N 129 120.300 120.300 121.876 -1.576 25768 12472 1 14 . 1 1 129 129 ASN C C 129 175.590 175.590 175.922 -0.332 25768 12473 1 14 . 1 1 129 129 ASN CA C 129 54.180 54.180 53.718 0.462 25768 12474 1 14 . 1 1 129 129 ASN CB C 129 38.900 38.900 38.454 0.446 25768 12475 1 14 . 1 1 129 129 ASN H H 129 8.120 8.120 8.493 -0.373 25768 12476 1 14 . 1 1 130 130 ARG N N 130 120.630 120.630 121.872 -1.242 25768 12477 1 14 . 1 1 130 130 ARG C C 130 176.720 176.720 175.782 0.938 25768 12478 1 14 . 1 1 130 130 ARG CA C 130 57.240 57.240 57.116 0.124 25768 12479 1 14 . 1 1 130 130 ARG CB C 130 30.500 30.500 31.093 -0.593 25768 12480 1 14 . 1 1 130 130 ARG H H 130 8.050 8.050 8.430 -0.380 25768 12481 1 14 . 1 1 131 131 LYS N N 131 121.150 121.150 119.312 1.838 25768 12482 1 14 . 1 1 131 131 LYS C C 131 176.750 176.750 175.362 1.388 25768 12483 1 14 . 1 1 131 131 LYS CA C 131 57.050 57.050 55.922 1.128 25768 12484 1 14 . 1 1 131 131 LYS CB C 131 32.870 32.870 33.897 -1.027 25768 12485 1 14 . 1 1 131 131 LYS H H 131 8.020 8.020 8.311 -0.291 25768 12486 1 14 . 1 1 132 132 ALA N N 132 124.110 124.110 125.188 -1.078 25768 12487 1 14 . 1 1 132 132 ALA C C 132 177.680 177.680 176.994 0.686 25768 12488 1 14 . 1 1 132 132 ALA CA C 132 53.070 53.070 52.355 0.715 25768 12489 1 14 . 1 1 132 132 ALA CB C 132 19.250 19.250 19.296 -0.045 25768 12490 1 14 . 1 1 132 132 ALA H H 132 8.010 8.010 8.323 -0.313 25768 12491 1 14 . 1 1 133 133 GLN N N 133 118.830 118.830 122.273 -3.443 25768 12492 1 14 . 1 1 133 133 GLN C C 133 176.380 176.380 176.417 -0.037 25768 12493 1 14 . 1 1 133 133 GLN CA C 133 56.400 56.400 56.049 0.351 25768 12494 1 14 . 1 1 133 133 GLN CB C 133 29.670 29.670 27.691 1.979 25768 12495 1 14 . 1 1 133 133 GLN H H 133 8.070 8.070 8.401 -0.331 25768 12496 1 14 . 1 1 134 134 GLY N N 134 109.400 109.400 111.330 -1.930 25768 12497 1 14 . 1 1 134 134 GLY C C 134 174.060 174.060 173.776 0.284 25768 12498 1 14 . 1 1 134 134 GLY CA C 134 45.690 45.690 44.805 0.885 25768 12499 1 14 . 1 1 134 134 GLY H H 134 8.150 8.150 8.253 -0.103 25768 12500 1 14 . 1 1 135 135 PHE N N 135 120.480 120.480 119.183 1.297 25768 12501 1 14 . 1 1 135 135 PHE C C 135 176.000 176.000 176.536 -0.536 25768 12502 1 14 . 1 1 135 135 PHE CA C 135 58.370 58.370 59.480 -1.110 25768 12503 1 14 . 1 1 135 135 PHE CB C 135 39.710 39.710 39.647 0.063 25768 12504 1 14 . 1 1 135 135 PHE H H 135 8.060 8.060 8.171 -0.111 25768 12505 1 14 . 1 1 136 136 SER N N 136 116.740 116.740 113.179 3.561 25768 12506 1 14 . 1 1 136 136 SER C C 136 174.620 174.620 173.974 0.646 25768 12507 1 14 . 1 1 136 136 SER CA C 136 58.870 58.870 57.902 0.968 25768 12508 1 14 . 1 1 136 136 SER CB C 136 64.200 64.200 64.692 -0.492 25768 12509 1 14 . 1 1 136 136 SER H H 136 8.160 8.160 8.172 -0.012 25768 12510 1 14 . 1 1 137 137 SER N N 137 117.650 117.650 121.408 -3.758 25768 12511 1 14 . 1 1 137 137 SER C C 137 174.410 174.410 175.674 -1.264 25768 12512 1 14 . 1 1 137 137 SER CA C 137 58.880 58.880 58.615 0.265 25768 12513 1 14 . 1 1 137 137 SER CB C 137 64.140 64.140 63.499 0.641 25768 12514 1 14 . 1 1 137 137 SER H H 137 8.140 8.140 8.674 -0.534 25768 12515 1 14 . 1 1 138 138 MET N N 138 121.980 121.980 120.355 1.625 25768 12516 1 14 . 1 1 138 138 MET C C 138 175.680 175.680 175.361 0.319 25768 12517 1 14 . 1 1 138 138 MET CA C 138 56.180 56.180 57.082 -0.902 25768 12518 1 14 . 1 1 138 138 MET CB C 138 33.240 33.240 31.833 1.407 25768 12519 1 14 . 1 1 138 138 MET H H 138 8.110 8.110 8.244 -0.134 25768 12520 1 14 . 1 1 139 139 LYS N N 139 122.110 122.110 120.952 1.158 25768 12521 1 14 . 1 1 139 139 LYS C C 139 176.220 176.220 176.824 -0.604 25768 12522 1 14 . 1 1 139 139 LYS CA C 139 56.370 56.370 56.478 -0.108 25768 12523 1 14 . 1 1 139 139 LYS CB C 139 33.220 33.220 31.627 1.593 25768 12524 1 14 . 1 1 139 139 LYS H H 139 8.140 8.140 8.100 0.040 25768 12525 1 14 . 1 1 140 140 LEU N N 140 123.860 123.860 124.020 -0.160 25768 12526 1 14 . 1 1 140 140 LEU C C 140 177.100 177.100 177.352 -0.252 25768 12527 1 14 . 1 1 140 140 LEU CA C 140 55.710 55.710 56.322 -0.612 25768 12528 1 14 . 1 1 140 140 LEU CB C 140 42.460 42.460 42.856 -0.396 25768 12529 1 14 . 1 1 140 140 LEU H H 140 8.140 8.140 8.286 -0.146 25768 12530 1 14 . 1 1 141 141 GLN N N 141 120.350 120.350 118.673 1.677 25768 12531 1 14 . 1 1 141 141 GLN C C 141 175.170 175.170 174.422 0.748 25768 12532 1 14 . 1 1 141 141 GLN CA C 141 56.200 56.200 55.612 0.588 25768 12533 1 14 . 1 1 141 141 GLN CB C 141 29.950 29.950 29.922 0.028 25768 12534 1 14 . 1 1 141 141 GLN H H 141 8.210 8.210 8.156 0.054 25768 12535 1 14 . 1 1 142 142 ASP N N 142 120.950 120.950 122.353 -1.403 25768 12536 1 14 . 1 1 142 142 ASP C C 142 175.840 175.840 175.385 0.455 25768 12537 1 14 . 1 1 142 142 ASP CA C 142 54.700 54.700 54.116 0.584 25768 12538 1 14 . 1 1 142 142 ASP CB C 142 41.760 41.760 41.996 -0.236 25768 12539 1 14 . 1 1 142 142 ASP H H 142 8.120 8.120 8.463 -0.343 25768 12540 1 14 . 1 1 143 143 SER N N 143 114.880 114.880 115.980 -1.100 25768 12541 1 14 . 1 1 143 143 SER C C 143 173.290 173.290 174.055 -0.765 25768 12542 1 14 . 1 1 143 143 SER CA C 143 58.450 58.450 57.490 0.960 25768 12543 1 14 . 1 1 143 143 SER CB C 143 64.760 64.760 63.178 1.581 25768 12544 1 14 . 1 1 143 143 SER H H 143 7.960 7.960 7.930 0.030 25768 12545 1 14 . 1 1 144 144 TRP N N 144 123.110 123.110 125.963 -2.853 25768 12546 1 14 . 1 1 144 144 TRP C C 144 175.880 175.880 176.439 -0.559 25768 12547 1 14 . 1 1 144 144 TRP CA C 144 56.420 56.420 57.414 -0.994 25768 12548 1 14 . 1 1 144 144 TRP CB C 144 31.160 31.160 30.632 0.528 25768 12549 1 14 . 1 1 144 144 TRP H H 144 8.080 8.080 8.664 -0.584 25768 12550 1 14 . 1 1 145 145 GLY N N 145 110.410 110.410 113.552 -3.142 25768 12551 1 14 . 1 1 145 145 GLY C C 145 172.870 172.870 173.352 -0.482 25768 12552 1 14 . 1 1 145 145 GLY CA C 145 45.130 45.130 44.578 0.552 25768 12553 1 14 . 1 1 145 145 GLY H H 145 8.660 8.660 8.637 0.023 25768 12554 1 14 . 1 1 148 148 GLY C C 148 171.800 171.800 172.099 -0.299 25768 12555 1 14 . 1 1 148 148 GLY CA C 148 44.140 44.140 43.841 0.299 25768 12556 1 14 . 1 1 149 149 GLU N N 149 123.070 123.070 119.742 3.328 25768 12557 1 14 . 1 1 149 149 GLU C C 149 174.210 174.210 174.190 0.020 25768 12558 1 14 . 1 1 149 149 GLU CA C 149 55.120 55.120 55.986 -0.866 25768 12559 1 14 . 1 1 149 149 GLU CB C 149 37.410 37.410 34.418 2.992 25768 12560 1 14 . 1 1 149 149 GLU H H 149 8.550 8.550 8.035 0.515 25768 12561 1 14 . 1 1 150 150 LEU N N 150 126.130 126.130 121.775 4.355 25768 12562 1 14 . 1 1 150 150 LEU C C 150 174.410 174.410 175.814 -1.404 25768 12563 1 14 . 1 1 150 150 LEU CA C 150 54.260 54.260 53.200 1.060 25768 12564 1 14 . 1 1 150 150 LEU CB C 150 47.510 47.510 44.303 3.207 25768 12565 1 14 . 1 1 150 150 LEU H H 150 8.550 8.550 8.209 0.341 25768 12566 1 14 . 1 1 151 151 GLY N N 151 109.500 109.500 107.628 1.872 25768 12567 1 14 . 1 1 151 151 GLY C C 151 170.610 170.610 172.819 -2.209 25768 12568 1 14 . 1 1 151 151 GLY CA C 151 45.980 45.980 44.049 1.931 25768 12569 1 14 . 1 1 151 151 GLY H H 151 8.090 8.090 8.354 -0.264 25768 12570 1 14 . 1 1 152 152 PHE N N 152 110.960 110.960 124.263 -13.303 25768 12571 1 14 . 1 1 152 152 PHE C C 152 171.510 171.510 174.942 -3.432 25768 12572 1 14 . 1 1 152 152 PHE CA C 152 58.170 58.170 56.364 1.806 25768 12573 1 14 . 1 1 152 152 PHE CB C 152 41.690 41.690 39.590 2.100 25768 12574 1 14 . 1 1 152 152 PHE H H 152 8.380 8.380 7.891 0.489 25768 12575 1 14 . 1 1 153 153 ASP N N 153 118.880 118.880 125.245 -6.365 25768 12576 1 14 . 1 1 153 153 ASP C C 153 176.520 176.520 175.312 1.208 25768 12577 1 14 . 1 1 153 153 ASP CA C 153 52.940 52.940 53.823 -0.883 25768 12578 1 14 . 1 1 153 153 ASP CB C 153 44.540 44.540 42.987 1.553 25768 12579 1 14 . 1 1 153 153 ASP H H 153 7.970 7.970 8.605 -0.635 25768 12580 1 14 . 1 1 154 154 TYR N N 154 123.630 123.630 122.871 0.759 25768 12581 1 14 . 1 1 154 154 TYR C C 154 175.610 175.610 174.235 1.375 25768 12582 1 14 . 1 1 154 154 TYR CA C 154 57.310 57.310 57.150 0.160 25768 12583 1 14 . 1 1 154 154 TYR CB C 154 42.040 42.040 42.229 -0.189 25768 12584 1 14 . 1 1 154 154 TYR H H 154 9.730 9.730 8.838 0.892 25768 12585 1 14 . 1 1 155 155 MET N N 155 126.190 126.190 126.737 -0.547 25768 12586 1 14 . 1 1 155 155 MET C C 155 174.970 174.970 175.150 -0.180 25768 12587 1 14 . 1 1 155 155 MET CA C 155 54.720 54.720 55.944 -1.224 25768 12588 1 14 . 1 1 155 155 MET CB C 155 28.300 28.300 32.618 -4.319 25768 12589 1 14 . 1 1 155 155 MET H H 155 8.600 8.600 8.807 -0.207 25768 12590 1 14 . 1 1 156 156 LEU N N 156 125.290 125.290 123.866 1.424 25768 12591 1 14 . 1 1 156 156 LEU C C 156 177.680 177.680 177.435 0.245 25768 12592 1 14 . 1 1 156 156 LEU CA C 156 56.040 56.040 54.536 1.504 25768 12593 1 14 . 1 1 156 156 LEU CB C 156 43.040 43.040 43.298 -0.258 25768 12594 1 14 . 1 1 156 156 LEU H H 156 9.190 9.190 8.581 0.609 25768 12595 1 14 . 1 1 157 157 ASN N N 157 114.690 114.690 116.938 -2.248 25768 12596 1 14 . 1 1 157 157 ASN C C 157 173.640 173.640 177.350 -3.710 25768 12597 1 14 . 1 1 157 157 ASN CA C 157 52.650 52.650 56.228 -3.578 25768 12598 1 14 . 1 1 157 157 ASN CB C 157 37.270 37.270 36.974 0.296 25768 12599 1 14 . 1 1 157 157 ASN H H 157 8.060 8.060 8.112 -0.052 25768 12600 1 14 . 1 1 158 158 GLU N N 158 114.530 114.530 119.032 -4.502 25768 12601 1 14 . 1 1 158 158 GLU C C 158 176.090 176.090 176.994 -0.904 25768 12602 1 14 . 1 1 158 158 GLU CA C 158 60.010 60.010 58.186 1.824 25768 12603 1 14 . 1 1 158 158 GLU CB C 158 29.730 29.730 29.961 -0.231 25768 12604 1 14 . 1 1 158 158 GLU H H 158 8.560 8.560 8.297 0.263 25768 12605 1 14 . 1 1 159 159 HIS N N 159 110.480 110.480 116.068 -5.588 25768 12606 1 14 . 1 1 159 159 HIS C C 159 173.130 173.130 173.610 -0.480 25768 12607 1 14 . 1 1 159 159 HIS CA C 159 56.770 56.770 54.661 2.109 25768 12608 1 14 . 1 1 159 159 HIS CB C 159 32.630 32.630 29.155 3.474 25768 12609 1 14 . 1 1 159 159 HIS H H 159 8.190 8.190 7.750 0.440 25768 12610 1 14 . 1 1 160 160 ALA N N 160 122.890 122.890 120.786 2.104 25768 12611 1 14 . 1 1 160 160 ALA C C 160 176.200 176.200 175.021 1.179 25768 12612 1 14 . 1 1 160 160 ALA CA C 160 51.730 51.730 53.682 -1.952 25768 12613 1 14 . 1 1 160 160 ALA CB C 160 21.560 21.560 18.160 3.400 25768 12614 1 14 . 1 1 160 160 ALA H H 160 8.400 8.400 7.740 0.660 25768 12615 1 14 . 1 1 161 161 LEU N N 161 116.540 116.540 117.975 -1.435 25768 12616 1 14 . 1 1 161 161 LEU C C 161 174.930 174.930 176.174 -1.244 25768 12617 1 14 . 1 1 161 161 LEU CA C 161 54.280 54.280 53.862 0.418 25768 12618 1 14 . 1 1 161 161 LEU CB C 161 45.640 45.640 45.550 0.090 25768 12619 1 14 . 1 1 161 161 LEU H H 161 8.590 8.590 8.358 0.232 25768 12620 1 14 . 1 1 162 162 PHE N N 162 121.780 121.780 123.920 -2.140 25768 12621 1 14 . 1 1 162 162 PHE C C 162 171.960 171.960 174.501 -2.541 25768 12622 1 14 . 1 1 162 162 PHE CA C 162 56.420 56.420 57.212 -0.792 25768 12623 1 14 . 1 1 162 162 PHE CB C 162 43.340 43.340 41.738 1.602 25768 12624 1 14 . 1 1 162 162 PHE H H 162 9.180 9.180 9.138 0.042 25768 12625 1 14 . 1 1 163 163 ASN N N 163 127.850 127.850 126.369 1.481 25768 12626 1 14 . 1 1 163 163 ASN C C 163 171.320 171.320 173.833 -2.513 25768 12627 1 14 . 1 1 163 163 ASN CA C 163 52.340 52.340 52.693 -0.353 25768 12628 1 14 . 1 1 163 163 ASN CB C 163 46.410 46.410 41.021 5.389 25768 12629 1 14 . 1 1 163 163 ASN H H 163 7.700 7.700 8.722 -1.022 25768 12630 1 14 . 1 1 164 164 MET N N 164 119.950 119.950 124.894 -4.944 25768 12631 1 14 . 1 1 164 164 MET C C 164 172.830 172.830 174.024 -1.194 25768 12632 1 14 . 1 1 164 164 MET CA C 164 55.180 55.180 54.556 0.624 25768 12633 1 14 . 1 1 164 164 MET CB C 164 37.770 37.770 37.411 0.359 25768 12634 1 14 . 1 1 164 164 MET H H 164 7.070 7.070 8.311 -1.241 25768 12635 1 14 . 1 1 165 165 ALA N N 165 120.600 120.600 122.376 -1.776 25768 12636 1 14 . 1 1 165 165 ALA C C 165 174.240 174.240 175.349 -1.109 25768 12637 1 14 . 1 1 165 165 ALA CA C 165 51.630 51.630 50.617 1.013 25768 12638 1 14 . 1 1 165 165 ALA CB C 165 22.330 22.330 23.039 -0.709 25768 12639 1 14 . 1 1 165 165 ALA H H 165 8.290 8.290 8.826 -0.536 25768 12640 1 14 . 1 1 166 166 VAL N N 166 117.900 117.900 120.174 -2.274 25768 12641 1 14 . 1 1 166 166 VAL C C 166 172.950 172.950 173.814 -0.864 25768 12642 1 14 . 1 1 166 166 VAL CA C 166 59.710 59.710 62.346 -2.635 25768 12643 1 14 . 1 1 166 166 VAL CB C 166 35.290 35.290 36.230 -0.940 25768 12644 1 14 . 1 1 166 166 VAL H H 166 8.720 8.720 8.040 0.680 25768 12645 1 14 . 1 1 171 171 ILE C C 171 175.750 175.750 174.805 0.945 25768 12646 1 14 . 1 1 171 171 ILE CA C 171 61.720 61.720 60.630 1.090 25768 12647 1 14 . 1 1 171 171 ILE CB C 171 39.300 39.300 37.985 1.315 25768 12648 1 14 . 1 1 172 172 ASP N N 172 124.070 124.070 123.064 1.006 25768 12649 1 14 . 1 1 172 172 ASP C C 172 176.590 176.590 175.718 0.872 25768 12650 1 14 . 1 1 172 172 ASP CA C 172 54.460 54.460 54.192 0.268 25768 12651 1 14 . 1 1 172 172 ASP CB C 172 41.410 41.410 41.345 0.065 25768 12652 1 14 . 1 1 172 172 ASP H H 172 8.460 8.460 8.275 0.185 25768 12653 1 14 . 1 1 173 173 THR N N 173 115.570 115.570 114.824 0.746 25768 12654 1 14 . 1 1 173 173 THR C C 173 175.030 175.030 175.685 -0.655 25768 12655 1 14 . 1 1 173 173 THR CA C 173 62.680 62.680 62.817 -0.137 25768 12656 1 14 . 1 1 173 173 THR CB C 173 69.840 69.840 69.485 0.355 25768 12657 1 14 . 1 1 173 173 THR H H 173 8.080 8.080 7.968 0.112 25768 12658 1 14 . 1 1 174 174 LYS N N 174 122.680 122.680 121.057 1.623 25768 12659 1 14 . 1 1 174 174 LYS C C 174 176.340 176.340 175.720 0.620 25768 12660 1 14 . 1 1 174 174 LYS CA C 174 56.820 56.820 55.605 1.215 25768 12661 1 14 . 1 1 174 174 LYS CB C 174 32.790 32.790 33.021 -0.231 25768 12662 1 14 . 1 1 174 174 LYS H H 174 8.180 8.180 8.030 0.150 25768 12663 1 14 . 1 1 175 175 ALA N N 175 124.050 124.050 124.786 -0.736 25768 12664 1 14 . 1 1 175 175 ALA C C 175 177.550 177.550 177.889 -0.339 25768 12665 1 14 . 1 1 175 175 ALA CA C 175 52.840 52.840 53.030 -0.190 25768 12666 1 14 . 1 1 175 175 ALA CB C 175 19.580 19.580 18.969 0.611 25768 12667 1 14 . 1 1 175 175 ALA H H 175 8.050 8.050 7.905 0.145 25768 12668 1 14 . 1 1 176 176 SER N N 176 114.920 114.920 119.088 -4.168 25768 12669 1 14 . 1 1 176 176 SER C C 176 174.240 174.240 173.604 0.636 25768 12670 1 14 . 1 1 176 176 SER CA C 176 58.390 58.390 57.813 0.577 25768 12671 1 14 . 1 1 176 176 SER CB C 176 64.370 64.370 62.520 1.849 25768 12672 1 14 . 1 1 176 176 SER H H 176 8.070 8.070 8.432 -0.362 25768 12673 1 14 . 1 1 177 177 ILE N N 177 121.650 121.650 124.740 -3.090 25768 12674 1 14 . 1 1 177 177 ILE C C 177 174.990 174.990 174.599 0.391 25768 12675 1 14 . 1 1 177 177 ILE CA C 177 61.570 61.570 61.254 0.316 25768 12676 1 14 . 1 1 177 177 ILE CB C 177 39.100 39.100 39.907 -0.808 25768 12677 1 14 . 1 1 177 177 ILE H H 177 7.960 7.960 8.001 -0.041 25768 12678 1 14 . 1 1 178 178 ASN N N 178 127.040 127.040 126.232 0.808 25768 12679 1 14 . 1 1 178 178 ASN C C 178 179.160 179.160 174.875 4.285 25768 12680 1 14 . 1 1 178 178 ASN CA C 178 55.100 55.100 53.575 1.525 25768 12681 1 14 . 1 1 178 178 ASN CB C 178 41.300 41.300 39.014 2.286 25768 12682 1 14 . 1 1 178 178 ASN H H 178 7.850 7.850 8.590 -0.740 25768 12683 1 14 . 1 1 180 180 PRO C C 180 177.520 177.520 176.816 0.704 25768 12684 1 14 . 1 1 180 180 PRO CA C 180 63.980 63.980 63.730 0.250 25768 12685 1 14 . 1 1 180 180 PRO CB C 180 32.190 32.190 32.458 -0.268 25768 12686 1 14 . 1 1 181 181 SER N N 181 115.600 115.600 111.508 4.092 25768 12687 1 14 . 1 1 181 181 SER C C 181 174.710 174.710 173.324 1.386 25768 12688 1 14 . 1 1 181 181 SER CA C 181 58.900 58.900 58.226 0.674 25768 12689 1 14 . 1 1 181 181 SER CB C 181 64.070 64.070 63.471 0.598 25768 12690 1 14 . 1 1 181 181 SER H H 181 8.260 8.260 7.831 0.429 25768 12691 1 14 . 1 1 182 182 ALA N N 182 125.880 125.880 124.413 1.467 25768 12692 1 14 . 1 1 182 182 ALA C C 182 177.560 177.560 176.830 0.730 25768 12693 1 14 . 1 1 182 182 ALA CA C 182 53.090 53.090 51.471 1.619 25768 12694 1 14 . 1 1 182 182 ALA CB C 182 19.310 19.310 20.118 -0.808 25768 12695 1 14 . 1 1 182 182 ALA H H 182 8.130 8.130 7.775 0.355 25768 12696 1 14 . 1 1 183 183 LEU N N 183 119.980 119.980 115.712 4.268 25768 12697 1 14 . 1 1 183 183 LEU C C 183 177.850 177.850 176.981 0.869 25768 12698 1 14 . 1 1 183 183 LEU CA C 183 55.650 55.650 55.970 -0.320 25768 12699 1 14 . 1 1 183 183 LEU CB C 183 42.530 42.530 43.116 -0.586 25768 12700 1 14 . 1 1 183 183 LEU H H 183 7.940 7.940 8.457 -0.517 25768 12701 1 14 . 1 1 184 184 GLY N N 184 109.250 109.250 108.416 0.834 25768 12702 1 14 . 1 1 184 184 GLY C C 184 174.250 174.250 173.952 0.298 25768 12703 1 14 . 1 1 184 184 GLY CA C 184 45.830 45.830 45.106 0.724 25768 12704 1 14 . 1 1 184 184 GLY H H 184 8.150 8.150 8.141 0.009 25768 12705 1 14 . 1 1 185 185 VAL N N 185 118.830 118.830 116.612 2.218 25768 12706 1 14 . 1 1 185 185 VAL C C 185 175.890 175.890 176.198 -0.308 25768 12707 1 14 . 1 1 185 185 VAL CA C 185 62.740 62.740 62.532 0.208 25768 12708 1 14 . 1 1 185 185 VAL CB C 185 32.770 32.770 32.144 0.626 25768 12709 1 14 . 1 1 185 185 VAL H H 185 7.760 7.760 7.647 0.113 25768 12710 1 14 . 1 1 186 186 ASN N N 186 121.850 121.850 118.827 3.023 25768 12711 1 14 . 1 1 186 186 ASN C C 186 174.970 174.970 174.970 0.000 25768 12712 1 14 . 1 1 186 186 ASN CA C 186 53.590 53.590 53.481 0.109 25768 12713 1 14 . 1 1 186 186 ASN CB C 186 39.160 39.160 38.605 0.555 25768 12714 1 14 . 1 1 186 186 ASN H H 186 8.380 8.380 8.297 0.083 25768 12715 1 14 . 1 1 187 187 LYS N N 187 122.120 122.120 119.023 3.097 25768 12716 1 14 . 1 1 187 187 LYS C C 187 176.490 176.490 175.458 1.032 25768 12717 1 14 . 1 1 187 187 LYS CA C 187 56.750 56.750 57.466 -0.716 25768 12718 1 14 . 1 1 187 187 LYS CB C 187 33.250 33.250 32.555 0.695 25768 12719 1 14 . 1 1 187 187 LYS H H 187 8.140 8.140 7.996 0.144 25768 12720 1 14 . 1 1 188 188 THR N N 188 115.250 115.250 111.484 3.766 25768 12721 1 14 . 1 1 188 188 THR C C 188 174.250 174.250 173.169 1.081 25768 12722 1 14 . 1 1 188 188 THR CA C 188 62.360 62.360 61.169 1.191 25768 12723 1 14 . 1 1 188 188 THR CB C 188 70.280 70.280 70.918 -0.638 25768 12724 1 14 . 1 1 188 188 THR H H 188 8.100 8.100 8.185 -0.085 25768 12725 1 14 . 1 1 189 189 LYS N N 189 123.780 123.780 120.597 3.183 25768 12726 1 14 . 1 1 189 189 LYS C C 189 176.090 176.090 175.286 0.804 25768 12727 1 14 . 1 1 189 189 LYS CA C 189 56.590 56.590 56.194 0.396 25768 12728 1 14 . 1 1 189 189 LYS CB C 189 33.350 33.350 34.786 -1.436 25768 12729 1 14 . 1 1 189 189 LYS H H 189 8.110 8.110 8.341 -0.231 25768 12730 1 14 . 1 1 190 190 VAL N N 190 120.920 120.920 119.279 1.641 25768 12731 1 14 . 1 1 190 190 VAL C C 190 175.590 175.590 175.014 0.576 25768 12732 1 14 . 1 1 190 190 VAL CA C 190 62.400 62.400 61.819 0.582 25768 12733 1 14 . 1 1 190 190 VAL CB C 190 32.990 32.990 32.393 0.597 25768 12734 1 14 . 1 1 190 190 VAL H H 190 8.040 8.040 8.348 -0.308 25768 12735 1 14 . 1 1 191 191 ASP N N 191 123.790 123.790 122.787 1.003 25768 12736 1 14 . 1 1 191 191 ASP C C 191 175.750 175.750 176.741 -0.991 25768 12737 1 14 . 1 1 191 191 ASP CA C 191 54.650 54.650 55.622 -0.972 25768 12738 1 14 . 1 1 191 191 ASP CB C 191 41.450 41.450 42.291 -0.841 25768 12739 1 14 . 1 1 191 191 ASP H H 191 8.240 8.240 8.074 0.166 25768 12740 1 14 . 1 1 192 192 VAL N N 192 118.850 118.850 117.166 1.684 25768 12741 1 14 . 1 1 192 192 VAL C C 192 175.380 175.380 173.581 1.799 25768 12742 1 14 . 1 1 192 192 VAL CA C 192 62.110 62.110 62.052 0.058 25768 12743 1 14 . 1 1 192 192 VAL CB C 192 33.290 33.290 32.121 1.169 25768 12744 1 14 . 1 1 192 192 VAL H H 192 7.860 7.860 7.636 0.224 25768 12745 1 14 . 1 1 193 193 ASP N N 193 124.190 124.190 120.915 3.275 25768 12746 1 14 . 1 1 193 193 ASP C C 193 175.630 175.630 175.576 0.054 25768 12747 1 14 . 1 1 193 193 ASP CA C 193 54.540 54.540 53.805 0.735 25768 12748 1 14 . 1 1 193 193 ASP CB C 193 41.410 41.410 41.438 -0.028 25768 12749 1 14 . 1 1 193 193 ASP H H 193 8.310 8.310 8.068 0.242 25768 12750 1 14 . 1 1 194 194 VAL N N 194 119.580 119.580 118.721 0.859 25768 12751 1 14 . 1 1 194 194 VAL C C 194 174.950 174.950 175.249 -0.299 25768 12752 1 14 . 1 1 194 194 VAL CA C 194 61.770 61.770 62.608 -0.838 25768 12753 1 14 . 1 1 194 194 VAL CB C 194 33.680 33.680 32.927 0.753 25768 12754 1 14 . 1 1 194 194 VAL H H 194 7.890 7.890 7.748 0.142 25768 12755 1 14 . 1 1 195 195 ASP N N 195 125.660 125.660 121.525 4.135 25768 12756 1 14 . 1 1 195 195 ASP C C 195 174.290 174.290 174.743 -0.453 25768 12757 1 14 . 1 1 195 195 ASP CA C 195 51.940 51.940 52.002 -0.062 25768 12758 1 14 . 1 1 195 195 ASP CB C 195 40.950 40.950 42.997 -2.047 25768 12759 1 14 . 1 1 195 195 ASP H H 195 8.410 8.410 8.232 0.178 25768 12760 1 14 . 1 1 198 198 VAL C C 198 173.940 173.940 174.375 -0.435 25768 12761 1 14 . 1 1 198 198 VAL CA C 198 61.270 61.270 60.724 0.546 25768 12762 1 14 . 1 1 198 198 VAL CB C 198 35.910 35.910 33.183 2.727 25768 12763 1 14 . 1 1 199 199 TYR N N 199 123.780 123.780 123.526 0.254 25768 12764 1 14 . 1 1 199 199 TYR C C 199 174.150 174.150 174.194 -0.044 25768 12765 1 14 . 1 1 199 199 TYR CA C 199 56.220 56.220 56.311 -0.091 25768 12766 1 14 . 1 1 199 199 TYR CB C 199 41.660 41.660 40.770 0.890 25768 12767 1 14 . 1 1 199 199 TYR H H 199 8.540 8.540 8.153 0.387 25768 12768 1 14 . 1 1 200 200 MET N N 200 123.920 123.920 119.571 4.349 25768 12769 1 14 . 1 1 200 200 MET C C 200 173.810 173.810 174.154 -0.344 25768 12770 1 14 . 1 1 200 200 MET CA C 200 54.710 54.710 54.469 0.241 25768 12771 1 14 . 1 1 200 200 MET CB C 200 37.110 37.110 36.666 0.444 25768 12772 1 14 . 1 1 200 200 MET H H 200 9.130 9.130 8.240 0.890 25768 12773 1 14 . 1 1 201 201 ILE N N 201 123.670 123.670 117.797 5.873 25768 12774 1 14 . 1 1 201 201 ILE C C 201 174.030 174.030 174.043 -0.013 25768 12775 1 14 . 1 1 201 201 ILE CA C 201 59.820 59.820 59.048 0.772 25768 12776 1 14 . 1 1 201 201 ILE CB C 201 41.720 41.720 41.969 -0.249 25768 12777 1 14 . 1 1 201 201 ILE H H 201 8.030 8.030 8.589 -0.559 25768 12778 1 14 . 1 1 202 202 GLY N N 202 112.910 112.910 111.347 1.563 25768 12779 1 14 . 1 1 202 202 GLY C C 202 170.280 170.280 171.602 -1.322 25768 12780 1 14 . 1 1 202 202 GLY CA C 202 46.800 46.800 45.370 1.430 25768 12781 1 14 . 1 1 202 202 GLY H H 202 8.580 8.580 8.588 -0.008 25768 12782 1 14 . 1 1 203 203 PHE N N 203 116.240 116.240 115.207 1.033 25768 12783 1 14 . 1 1 203 203 PHE C C 203 173.940 173.940 173.807 0.133 25768 12784 1 14 . 1 1 203 203 PHE CA C 203 55.890 55.890 55.319 0.571 25768 12785 1 14 . 1 1 203 203 PHE CB C 203 45.060 45.060 41.784 3.276 25768 12786 1 14 . 1 1 203 203 PHE H H 203 8.620 8.620 7.451 1.169 25768 12787 1 14 . 1 1 204 204 GLY N N 204 105.610 105.610 106.775 -1.165 25768 12788 1 14 . 1 1 204 204 GLY C C 204 171.190 171.190 171.423 -0.233 25768 12789 1 14 . 1 1 204 204 GLY CA C 204 46.720 46.720 45.357 1.363 25768 12790 1 14 . 1 1 204 204 GLY H H 204 8.960 8.960 9.028 -0.068 25768 12791 1 14 . 1 1 205 205 TYR N N 205 121.160 121.160 120.115 1.045 25768 12792 1 14 . 1 1 205 205 TYR C C 205 173.030 173.030 173.586 -0.556 25768 12793 1 14 . 1 1 205 205 TYR CA C 205 57.190 57.190 55.731 1.459 25768 12794 1 14 . 1 1 205 205 TYR CB C 205 44.400 44.400 42.986 1.415 25768 12795 1 14 . 1 1 205 205 TYR H H 205 9.380 9.380 8.343 1.037 25768 12796 1 14 . 1 1 206 206 LYS N N 206 126.970 126.970 123.379 3.591 25768 12797 1 14 . 1 1 206 206 LYS C C 206 174.210 174.210 174.879 -0.669 25768 12798 1 14 . 1 1 206 206 LYS CA C 206 54.770 54.770 54.485 0.285 25768 12799 1 14 . 1 1 206 206 LYS CB C 206 34.440 34.440 33.627 0.813 25768 12800 1 14 . 1 1 206 206 LYS H H 206 8.380 8.380 7.709 0.671 25768 12801 1 14 . 1 1 207 207 PHE N N 207 126.330 126.330 126.552 -0.222 25768 12802 1 14 . 1 1 207 207 PHE C C 207 175.020 175.020 173.958 1.062 25768 12803 1 14 . 1 1 207 207 PHE CA C 207 58.170 58.170 59.446 -1.276 25768 12804 1 14 . 1 1 207 207 PHE CB C 207 40.920 40.920 39.797 1.123 25768 12805 1 14 . 1 1 207 207 PHE H H 207 9.290 9.290 8.481 0.809 25768 12806 1 14 . 1 1 208 208 LEU N N 208 122.740 122.740 126.025 -3.285 25768 12807 1 14 . 1 1 208 208 LEU C C 208 176.510 176.510 175.886 0.624 25768 12808 1 14 . 1 1 208 208 LEU CA C 208 54.910 54.910 53.731 1.179 25768 12809 1 14 . 1 1 208 208 LEU CB C 208 43.830 43.830 44.887 -1.057 25768 12810 1 14 . 1 1 208 208 LEU H H 208 8.310 8.310 7.848 0.462 25768 12811 1 15 . 1 1 2 2 HIS C C 2 175.310 175.310 174.495 0.815 25768 12812 1 15 . 1 1 3 3 LYS N N 3 122.080 122.080 122.014 0.066 25768 12813 1 15 . 1 1 3 3 LYS C C 3 173.490 173.490 175.144 -1.654 25768 12814 1 15 . 1 1 3 3 LYS CA C 3 55.050 55.050 54.839 0.211 25768 12815 1 15 . 1 1 3 3 LYS CB C 3 35.380 35.380 35.678 -0.298 25768 12816 1 15 . 1 1 3 3 LYS H H 3 8.620 8.620 8.503 0.117 25768 12817 1 15 . 1 1 4 4 ALA N N 4 120.860 120.860 121.240 -0.380 25768 12818 1 15 . 1 1 4 4 ALA C C 4 178.190 178.190 178.264 -0.074 25768 12819 1 15 . 1 1 4 4 ALA CA C 4 53.480 53.480 52.138 1.342 25768 12820 1 15 . 1 1 4 4 ALA CB C 4 18.140 18.140 18.739 -0.599 25768 12821 1 15 . 1 1 4 4 ALA H H 4 8.580 8.580 8.139 0.441 25768 12822 1 15 . 1 1 5 5 GLY N N 5 112.890 112.890 111.623 1.267 25768 12823 1 15 . 1 1 5 5 GLY C C 5 173.830 173.830 173.714 0.116 25768 12824 1 15 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.488 0.392 25768 12825 1 15 . 1 1 5 5 GLY H H 5 9.210 9.210 7.728 1.482 25768 12826 1 15 . 1 1 6 6 ASP N N 6 121.590 121.590 120.908 0.682 25768 12827 1 15 . 1 1 6 6 ASP C C 6 174.380 174.380 174.793 -0.413 25768 12828 1 15 . 1 1 6 6 ASP CA C 6 55.790 55.790 54.544 1.246 25768 12829 1 15 . 1 1 6 6 ASP CB C 6 41.760 41.760 42.259 -0.499 25768 12830 1 15 . 1 1 6 6 ASP H H 6 7.620 7.620 7.398 0.222 25768 12831 1 15 . 1 1 7 7 PHE N N 7 120.860 120.860 124.256 -3.396 25768 12832 1 15 . 1 1 7 7 PHE C C 7 174.050 174.050 174.403 -0.353 25768 12833 1 15 . 1 1 7 7 PHE CA C 7 56.110 56.110 58.292 -2.182 25768 12834 1 15 . 1 1 7 7 PHE CB C 7 42.550 42.550 41.136 1.414 25768 12835 1 15 . 1 1 7 7 PHE H H 7 8.250 8.250 8.925 -0.675 25768 12836 1 15 . 1 1 8 8 ILE N N 8 127.950 127.950 125.835 2.115 25768 12837 1 15 . 1 1 8 8 ILE C C 8 174.000 174.000 174.326 -0.326 25768 12838 1 15 . 1 1 8 8 ILE CA C 8 61.160 61.160 59.033 2.127 25768 12839 1 15 . 1 1 8 8 ILE CB C 8 42.660 42.660 41.255 1.405 25768 12840 1 15 . 1 1 8 8 ILE H H 8 9.230 9.230 9.168 0.062 25768 12841 1 15 . 1 1 9 9 ILE N N 9 125.380 125.380 125.904 -0.524 25768 12842 1 15 . 1 1 9 9 ILE C C 9 173.630 173.630 174.376 -0.746 25768 12843 1 15 . 1 1 9 9 ILE CA C 9 59.600 59.600 60.169 -0.569 25768 12844 1 15 . 1 1 9 9 ILE CB C 9 41.180 41.180 40.549 0.631 25768 12845 1 15 . 1 1 9 9 ILE H H 9 8.580 8.580 8.742 -0.162 25768 12846 1 15 . 1 1 10 10 ARG N N 10 124.950 124.950 125.879 -0.929 25768 12847 1 15 . 1 1 10 10 ARG C C 10 175.030 175.030 174.565 0.465 25768 12848 1 15 . 1 1 10 10 ARG CA C 10 53.920 53.920 54.725 -0.805 25768 12849 1 15 . 1 1 10 10 ARG CB C 10 31.880 31.880 34.918 -3.038 25768 12850 1 15 . 1 1 10 10 ARG H H 10 9.230 9.230 8.847 0.383 25768 12851 1 15 . 1 1 11 11 GLY N N 11 105.650 105.650 109.173 -3.523 25768 12852 1 15 . 1 1 11 11 GLY C C 11 172.090 172.090 171.781 0.309 25768 12853 1 15 . 1 1 11 11 GLY CA C 11 44.460 44.460 43.969 0.491 25768 12854 1 15 . 1 1 11 11 GLY H H 11 8.780 8.780 8.792 -0.012 25768 12855 1 15 . 1 1 12 12 GLY N N 12 107.800 107.800 106.995 0.805 25768 12856 1 15 . 1 1 12 12 GLY C C 12 171.460 171.460 171.780 -0.320 25768 12857 1 15 . 1 1 12 12 GLY CA C 12 46.630 46.630 44.894 1.736 25768 12858 1 15 . 1 1 12 12 GLY H H 12 8.510 8.510 8.294 0.216 25768 12859 1 15 . 1 1 13 13 PHE N N 13 119.900 119.900 114.308 5.592 25768 12860 1 15 . 1 1 13 13 PHE C C 13 174.190 174.190 173.452 0.738 25768 12861 1 15 . 1 1 13 13 PHE CA C 13 56.340 56.340 55.294 1.046 25768 12862 1 15 . 1 1 13 13 PHE CB C 13 41.090 41.090 41.439 -0.349 25768 12863 1 15 . 1 1 13 13 PHE H H 13 8.610 8.610 8.511 0.099 25768 12864 1 15 . 1 1 14 14 ALA N N 14 128.030 128.030 122.499 5.531 25768 12865 1 15 . 1 1 14 14 ALA C C 14 176.560 176.560 177.778 -1.218 25768 12866 1 15 . 1 1 14 14 ALA CA C 14 49.940 49.940 50.541 -0.601 25768 12867 1 15 . 1 1 14 14 ALA CB C 14 20.360 20.360 21.366 -1.006 25768 12868 1 15 . 1 1 14 14 ALA H H 14 9.220 9.220 8.699 0.521 25768 12869 1 15 . 1 1 15 15 THR N N 15 118.620 118.620 116.296 2.324 25768 12870 1 15 . 1 1 15 15 THR CA C 15 61.440 61.440 61.573 -0.133 25768 12871 1 15 . 1 1 15 15 THR CB C 15 71.370 71.370 69.650 1.720 25768 12872 1 15 . 1 1 15 15 THR H H 15 9.220 9.220 8.241 0.979 25768 12873 1 15 . 1 1 18 18 PRO C C 18 176.690 176.690 176.193 0.497 25768 12874 1 15 . 1 1 18 18 PRO CA C 18 63.610 63.610 62.607 1.003 25768 12875 1 15 . 1 1 18 18 PRO CB C 18 32.440 32.440 32.758 -0.318 25768 12876 1 15 . 1 1 19 19 ASP N N 19 120.320 120.320 119.162 1.158 25768 12877 1 15 . 1 1 19 19 ASP C C 19 175.950 175.950 177.253 -1.303 25768 12878 1 15 . 1 1 19 19 ASP CA C 19 54.710 54.710 55.280 -0.570 25768 12879 1 15 . 1 1 19 19 ASP CB C 19 41.450 41.450 40.785 0.665 25768 12880 1 15 . 1 1 19 19 ASP H H 19 8.330 8.330 8.509 -0.179 25768 12881 1 15 . 1 1 20 20 ASP N N 20 121.990 121.990 117.657 4.333 25768 12882 1 15 . 1 1 20 20 ASP C C 20 176.760 176.760 176.597 0.163 25768 12883 1 15 . 1 1 20 20 ASP CA C 20 54.470 54.470 55.648 -1.178 25768 12884 1 15 . 1 1 20 20 ASP CB C 20 41.310 41.310 41.522 -0.211 25768 12885 1 15 . 1 1 20 20 ASP H H 20 8.240 8.240 8.234 0.006 25768 12886 1 15 . 1 1 21 21 SER N N 21 117.050 117.050 112.831 4.219 25768 12887 1 15 . 1 1 21 21 SER C C 21 175.170 175.170 173.775 1.395 25768 12888 1 15 . 1 1 21 21 SER CA C 21 59.490 59.490 58.407 1.083 25768 12889 1 15 . 1 1 21 21 SER CB C 21 64.080 64.080 64.947 -0.867 25768 12890 1 15 . 1 1 21 21 SER H H 21 8.360 8.360 7.907 0.453 25768 12891 1 15 . 1 1 22 22 SER N N 22 117.820 117.820 117.022 0.798 25768 12892 1 15 . 1 1 22 22 SER C C 22 174.940 174.940 173.632 1.308 25768 12893 1 15 . 1 1 22 22 SER CA C 22 59.160 59.160 57.868 1.292 25768 12894 1 15 . 1 1 22 22 SER CB C 22 64.110 64.110 63.431 0.679 25768 12895 1 15 . 1 1 22 22 SER H H 22 8.310 8.310 8.082 0.228 25768 12896 1 15 . 1 1 23 23 SER N N 23 117.660 117.660 118.708 -1.048 25768 12897 1 15 . 1 1 23 23 SER C C 23 174.340 174.340 173.995 0.345 25768 12898 1 15 . 1 1 23 23 SER CA C 23 59.050 59.050 58.657 0.393 25768 12899 1 15 . 1 1 23 23 SER CB C 23 64.210 64.210 63.751 0.459 25768 12900 1 15 . 1 1 23 23 SER H H 23 8.120 8.120 7.930 0.190 25768 12901 1 15 . 1 1 24 24 ASP N N 24 122.590 122.590 122.529 0.061 25768 12902 1 15 . 1 1 24 24 ASP C C 24 176.250 176.250 175.011 1.239 25768 12903 1 15 . 1 1 24 24 ASP CA C 24 54.910 54.910 54.134 0.776 25768 12904 1 15 . 1 1 24 24 ASP CB C 24 41.270 41.270 41.836 -0.566 25768 12905 1 15 . 1 1 24 24 ASP H H 24 8.230 8.230 8.240 -0.010 25768 12906 1 15 . 1 1 25 25 ILE N N 25 120.650 120.650 122.456 -1.806 25768 12907 1 15 . 1 1 25 25 ILE C C 25 176.190 176.190 175.187 1.003 25768 12908 1 15 . 1 1 25 25 ILE CA C 25 61.880 61.880 61.877 0.003 25768 12909 1 15 . 1 1 25 25 ILE CB C 25 38.730 38.730 38.149 0.581 25768 12910 1 15 . 1 1 25 25 ILE H H 25 7.860 7.860 8.193 -0.333 25768 12911 1 15 . 1 1 26 26 LYS N N 26 124.420 124.420 124.554 -0.134 25768 12912 1 15 . 1 1 26 26 LYS C C 26 176.640 176.640 176.880 -0.240 25768 12913 1 15 . 1 1 26 26 LYS CA C 26 56.520 56.520 56.407 0.113 25768 12914 1 15 . 1 1 26 26 LYS CB C 26 32.890 32.890 33.239 -0.349 25768 12915 1 15 . 1 1 26 26 LYS H H 26 8.140 8.140 8.205 -0.065 25768 12916 1 15 . 1 1 27 27 LEU N N 27 123.120 123.120 120.935 2.185 25768 12917 1 15 . 1 1 27 27 LEU C C 27 177.110 177.110 176.551 0.559 25768 12918 1 15 . 1 1 27 27 LEU CA C 27 55.590 55.590 54.659 0.931 25768 12919 1 15 . 1 1 27 27 LEU CB C 27 42.500 42.500 43.166 -0.666 25768 12920 1 15 . 1 1 27 27 LEU H H 27 8.080 8.080 7.976 0.104 25768 12921 1 15 . 1 1 28 28 ASP N N 28 120.850 120.850 120.988 -0.138 25768 12922 1 15 . 1 1 28 28 ASP C C 28 176.960 176.960 175.585 1.375 25768 12923 1 15 . 1 1 28 28 ASP CA C 28 54.800 54.800 54.042 0.758 25768 12924 1 15 . 1 1 28 28 ASP CB C 28 41.380 41.380 41.376 0.004 25768 12925 1 15 . 1 1 28 28 ASP H H 28 8.180 8.180 8.433 -0.253 25768 12926 1 15 . 1 1 29 29 GLY N N 29 109.800 109.800 107.743 2.057 25768 12927 1 15 . 1 1 29 29 GLY C C 29 174.370 174.370 172.828 1.542 25768 12928 1 15 . 1 1 29 29 GLY CA C 29 46.150 46.150 44.624 1.526 25768 12929 1 15 . 1 1 29 29 GLY H H 29 8.230 8.230 7.585 0.645 25768 12930 1 15 . 1 1 30 30 ALA N N 30 123.880 123.880 121.885 1.995 25768 12931 1 15 . 1 1 30 30 ALA C C 30 178.040 178.040 176.668 1.372 25768 12932 1 15 . 1 1 30 30 ALA CA C 30 53.140 53.140 51.452 1.688 25768 12933 1 15 . 1 1 30 30 ALA CB C 30 19.350 19.350 20.597 -1.247 25768 12934 1 15 . 1 1 30 30 ALA H H 30 8.040 8.040 8.125 -0.085 25768 12935 1 15 . 1 1 31 31 LYS N N 31 119.800 119.800 120.992 -1.192 25768 12936 1 15 . 1 1 31 31 LYS C C 31 176.770 176.770 175.267 1.503 25768 12937 1 15 . 1 1 31 31 LYS CA C 31 56.870 56.870 56.911 -0.041 25768 12938 1 15 . 1 1 31 31 LYS CB C 31 32.980 32.980 30.207 2.773 25768 12939 1 15 . 1 1 31 31 LYS H H 31 8.060 8.060 8.591 -0.531 25768 12940 1 15 . 1 1 32 32 GLN N N 32 120.930 120.930 119.727 1.203 25768 12941 1 15 . 1 1 32 32 GLN C C 32 176.000 176.000 175.368 0.632 25768 12942 1 15 . 1 1 32 32 GLN CA C 32 56.280 56.280 54.967 1.313 25768 12943 1 15 . 1 1 32 32 GLN CB C 32 29.580 29.580 30.983 -1.403 25768 12944 1 15 . 1 1 32 32 GLN H H 32 8.170 8.170 8.253 -0.083 25768 12945 1 15 . 1 1 33 33 ARG N N 33 122.370 122.370 120.053 2.317 25768 12946 1 15 . 1 1 33 33 ARG C C 33 176.820 176.820 175.942 0.878 25768 12947 1 15 . 1 1 33 33 ARG CA C 33 56.680 56.680 55.835 0.845 25768 12948 1 15 . 1 1 33 33 ARG CB C 33 31.040 31.040 30.740 0.300 25768 12949 1 15 . 1 1 33 33 ARG H H 33 8.270 8.270 8.551 -0.281 25768 12950 1 15 . 1 1 34 34 GLY N N 34 110.210 110.210 110.468 -0.258 25768 12951 1 15 . 1 1 34 34 GLY C C 34 174.280 174.280 173.328 0.952 25768 12952 1 15 . 1 1 34 34 GLY CA C 34 45.770 45.770 45.461 0.309 25768 12953 1 15 . 1 1 34 34 GLY H H 34 8.360 8.360 8.126 0.234 25768 12954 1 15 . 1 1 35 35 THR N N 35 114.100 114.100 111.115 2.985 25768 12955 1 15 . 1 1 35 35 THR C C 35 174.550 174.550 173.839 0.711 25768 12956 1 15 . 1 1 35 35 THR CA C 35 62.140 62.140 60.844 1.296 25768 12957 1 15 . 1 1 35 35 THR CB C 35 70.330 70.330 71.054 -0.724 25768 12958 1 15 . 1 1 35 35 THR H H 35 7.970 7.970 7.546 0.424 25768 12959 1 15 . 1 1 36 36 LYS N N 36 123.850 123.850 120.422 3.428 25768 12960 1 15 . 1 1 36 36 LYS C C 36 176.040 176.040 176.530 -0.490 25768 12961 1 15 . 1 1 36 36 LYS CA C 36 56.600 56.600 56.609 -0.009 25768 12962 1 15 . 1 1 36 36 LYS CB C 36 33.280 33.280 33.514 -0.234 25768 12963 1 15 . 1 1 36 36 LYS H H 36 8.230 8.230 8.453 -0.223 25768 12964 1 15 . 1 1 37 37 ALA N N 37 125.650 125.650 123.120 2.530 25768 12965 1 15 . 1 1 37 37 ALA C C 37 177.570 177.570 176.964 0.606 25768 12966 1 15 . 1 1 37 37 ALA CA C 37 52.860 52.860 52.188 0.673 25768 12967 1 15 . 1 1 37 37 ALA CB C 37 19.610 19.610 18.516 1.094 25768 12968 1 15 . 1 1 37 37 ALA H H 37 8.290 8.290 8.110 0.180 25768 12969 1 15 . 1 1 38 38 THR N N 38 113.350 113.350 113.618 -0.268 25768 12970 1 15 . 1 1 38 38 THR C C 38 174.540 174.540 175.958 -1.418 25768 12971 1 15 . 1 1 38 38 THR CA C 38 62.010 62.010 62.708 -0.698 25768 12972 1 15 . 1 1 38 38 THR CB C 38 70.350 70.350 69.349 1.001 25768 12973 1 15 . 1 1 38 38 THR H H 38 7.970 7.970 8.129 -0.159 25768 12974 1 15 . 1 1 39 39 VAL N N 39 120.790 120.790 116.896 3.894 25768 12975 1 15 . 1 1 39 39 VAL C C 39 175.620 175.620 176.148 -0.528 25768 12976 1 15 . 1 1 39 39 VAL CA C 39 62.470 62.470 63.138 -0.667 25768 12977 1 15 . 1 1 39 39 VAL CB C 39 32.940 32.940 31.770 1.170 25768 12978 1 15 . 1 1 39 39 VAL H H 39 8.020 8.020 8.022 -0.002 25768 12979 1 15 . 1 1 40 40 ASP N N 40 123.690 123.690 119.950 3.740 25768 12980 1 15 . 1 1 40 40 ASP C C 40 176.190 176.190 176.681 -0.491 25768 12981 1 15 . 1 1 40 40 ASP CA C 40 54.780 54.780 55.751 -0.971 25768 12982 1 15 . 1 1 40 40 ASP CB C 40 41.590 41.590 41.848 -0.258 25768 12983 1 15 . 1 1 40 40 ASP H H 40 8.310 8.310 7.671 0.639 25768 12984 1 15 . 1 1 41 41 SER N N 41 115.470 115.470 114.613 0.857 25768 12985 1 15 . 1 1 41 41 SER C C 41 174.170 174.170 174.999 -0.829 25768 12986 1 15 . 1 1 41 41 SER CA C 41 59.000 59.000 59.342 -0.342 25768 12987 1 15 . 1 1 41 41 SER CB C 41 64.420 64.420 64.089 0.331 25768 12988 1 15 . 1 1 41 41 SER H H 41 8.130 8.130 8.650 -0.520 25768 12989 1 15 . 1 1 42 42 ASP N N 42 122.430 122.430 119.707 2.723 25768 12990 1 15 . 1 1 42 42 ASP C C 42 175.740 175.740 176.078 -0.338 25768 12991 1 15 . 1 1 42 42 ASP CA C 42 54.780 54.780 57.000 -2.220 25768 12992 1 15 . 1 1 42 42 ASP CB C 42 41.620 41.620 39.227 2.393 25768 12993 1 15 . 1 1 42 42 ASP H H 42 8.410 8.410 8.044 0.366 25768 12994 1 15 . 1 1 43 43 THR N N 43 117.580 117.580 115.087 2.493 25768 12995 1 15 . 1 1 43 43 THR C C 43 173.630 173.630 173.430 0.200 25768 12996 1 15 . 1 1 43 43 THR CA C 43 63.120 63.120 62.807 0.313 25768 12997 1 15 . 1 1 43 43 THR CB C 43 70.650 70.650 69.801 0.849 25768 12998 1 15 . 1 1 43 43 THR H H 43 8.010 8.010 8.127 -0.117 25768 12999 1 15 . 1 1 44 44 GLN N N 44 125.420 125.420 123.240 2.180 25768 13000 1 15 . 1 1 44 44 GLN C C 44 174.080 174.080 175.470 -1.390 25768 13001 1 15 . 1 1 44 44 GLN CA C 44 55.110 55.110 54.316 0.794 25768 13002 1 15 . 1 1 44 44 GLN CB C 44 31.570 31.570 31.709 -0.139 25768 13003 1 15 . 1 1 44 44 GLN H H 44 9.260 9.260 8.348 0.911 25768 13004 1 15 . 1 1 45 45 LEU N N 45 124.190 124.190 125.910 -1.720 25768 13005 1 15 . 1 1 45 45 LEU C C 45 175.970 175.970 177.372 -1.402 25768 13006 1 15 . 1 1 45 45 LEU CA C 45 54.690 54.690 54.999 -0.309 25768 13007 1 15 . 1 1 45 45 LEU CB C 45 42.270 42.270 41.698 0.572 25768 13008 1 15 . 1 1 45 45 LEU H H 45 8.550 8.550 8.765 -0.215 25768 13009 1 15 . 1 1 46 46 GLY N N 46 113.310 113.310 113.015 0.295 25768 13010 1 15 . 1 1 46 46 GLY C C 46 171.180 171.180 172.985 -1.805 25768 13011 1 15 . 1 1 46 46 GLY CA C 46 44.400 44.400 44.969 -0.569 25768 13012 1 15 . 1 1 46 46 GLY H H 46 8.810 8.810 8.756 0.054 25768 13013 1 15 . 1 1 47 47 LEU N N 47 123.890 123.890 128.163 -4.273 25768 13014 1 15 . 1 1 47 47 LEU C C 47 175.400 175.400 175.526 -0.126 25768 13015 1 15 . 1 1 47 47 LEU CA C 47 53.750 53.750 54.403 -0.653 25768 13016 1 15 . 1 1 47 47 LEU CB C 47 46.800 46.800 45.031 1.769 25768 13017 1 15 . 1 1 47 47 LEU H H 47 8.590 8.590 8.824 -0.234 25768 13018 1 15 . 1 1 48 48 THR N N 48 111.210 111.210 117.002 -5.792 25768 13019 1 15 . 1 1 48 48 THR C C 48 172.520 172.520 173.073 -0.553 25768 13020 1 15 . 1 1 48 48 THR CA C 48 58.950 58.950 60.746 -1.796 25768 13021 1 15 . 1 1 48 48 THR CB C 48 72.360 72.360 71.553 0.807 25768 13022 1 15 . 1 1 48 48 THR H H 48 8.620 8.620 8.470 0.150 25768 13023 1 15 . 1 1 49 49 PHE N N 49 118.810 118.810 124.838 -6.028 25768 13024 1 15 . 1 1 49 49 PHE C C 49 174.700 174.700 175.224 -0.524 25768 13025 1 15 . 1 1 49 49 PHE CA C 49 55.080 55.080 56.520 -1.440 25768 13026 1 15 . 1 1 49 49 PHE CB C 49 42.360 42.360 40.818 1.542 25768 13027 1 15 . 1 1 49 49 PHE H H 49 8.410 8.410 8.322 0.088 25768 13028 1 15 . 1 1 50 50 THR N N 50 121.230 121.230 118.018 3.212 25768 13029 1 15 . 1 1 50 50 THR C C 50 173.250 173.250 173.523 -0.273 25768 13030 1 15 . 1 1 50 50 THR CA C 50 62.740 62.740 60.453 2.287 25768 13031 1 15 . 1 1 50 50 THR CB C 50 73.740 73.740 70.105 3.635 25768 13032 1 15 . 1 1 50 50 THR H H 50 9.330 9.330 8.846 0.484 25768 13033 1 15 . 1 1 51 51 TYR N N 51 126.010 126.010 123.883 2.127 25768 13034 1 15 . 1 1 51 51 TYR C C 51 174.850 174.850 175.720 -0.870 25768 13035 1 15 . 1 1 51 51 TYR CA C 51 56.240 56.240 55.564 0.676 25768 13036 1 15 . 1 1 51 51 TYR CB C 51 41.630 41.630 39.166 2.464 25768 13037 1 15 . 1 1 51 51 TYR H H 51 9.150 9.150 9.280 -0.130 25768 13038 1 15 . 1 1 52 52 MET N N 52 127.390 127.390 124.513 2.877 25768 13039 1 15 . 1 1 52 52 MET C C 52 174.490 174.490 174.414 0.076 25768 13040 1 15 . 1 1 52 52 MET CA C 52 52.450 52.450 56.540 -4.090 25768 13041 1 15 . 1 1 52 52 MET CB C 52 28.590 28.590 33.027 -4.437 25768 13042 1 15 . 1 1 52 52 MET H H 52 7.950 7.950 8.341 -0.391 25768 13043 1 15 . 1 1 53 53 PHE N N 53 123.830 123.830 127.033 -3.203 25768 13044 1 15 . 1 1 53 53 PHE C C 53 173.720 173.720 174.007 -0.287 25768 13045 1 15 . 1 1 53 53 PHE CA C 53 57.110 57.110 57.064 0.046 25768 13046 1 15 . 1 1 53 53 PHE CB C 53 39.420 39.420 40.918 -1.498 25768 13047 1 15 . 1 1 53 53 PHE H H 53 7.720 7.720 8.222 -0.502 25768 13048 1 15 . 1 1 54 54 ALA N N 54 125.650 125.650 125.869 -0.219 25768 13049 1 15 . 1 1 54 54 ALA C C 54 175.020 175.020 175.616 -0.596 25768 13050 1 15 . 1 1 54 54 ALA CA C 54 50.740 50.740 52.975 -2.235 25768 13051 1 15 . 1 1 54 54 ALA CB C 54 22.700 22.700 18.596 4.104 25768 13052 1 15 . 1 1 54 54 ALA H H 54 8.360 8.360 8.203 0.157 25768 13053 1 15 . 1 1 55 55 ASP N N 55 118.790 118.790 121.770 -2.980 25768 13054 1 15 . 1 1 55 55 ASP C C 55 174.780 174.780 176.009 -1.229 25768 13055 1 15 . 1 1 55 55 ASP CA C 55 58.590 58.590 54.351 4.239 25768 13056 1 15 . 1 1 55 55 ASP CB C 55 40.430 40.430 40.259 0.171 25768 13057 1 15 . 1 1 55 55 ASP H H 55 8.590 8.590 8.535 0.055 25768 13058 1 15 . 1 1 56 56 LYS N N 56 106.200 106.200 116.850 -10.650 25768 13059 1 15 . 1 1 56 56 LYS C C 56 174.940 174.940 175.331 -0.391 25768 13060 1 15 . 1 1 56 56 LYS CA C 56 55.260 55.260 56.710 -1.450 25768 13061 1 15 . 1 1 56 56 LYS CB C 56 34.510 34.510 34.813 -0.303 25768 13062 1 15 . 1 1 56 56 LYS H H 56 7.260 7.260 7.390 -0.130 25768 13063 1 15 . 1 1 57 57 TRP N N 57 115.680 115.680 121.959 -6.279 25768 13064 1 15 . 1 1 57 57 TRP C C 57 173.940 173.940 175.457 -1.517 25768 13065 1 15 . 1 1 57 57 TRP CA C 57 55.410 55.410 58.488 -3.078 25768 13066 1 15 . 1 1 57 57 TRP CB C 57 34.470 34.470 31.306 3.164 25768 13067 1 15 . 1 1 57 57 TRP H H 57 6.570 6.570 8.178 -1.608 25768 13068 1 15 . 1 1 58 58 GLY N N 58 107.610 107.610 109.389 -1.779 25768 13069 1 15 . 1 1 58 58 GLY C C 58 172.730 172.730 171.933 0.797 25768 13070 1 15 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.465 -0.415 25768 13071 1 15 . 1 1 58 58 GLY H H 58 9.260 9.260 8.082 1.178 25768 13072 1 15 . 1 1 59 59 VAL N N 59 118.130 118.130 124.970 -6.840 25768 13073 1 15 . 1 1 59 59 VAL C C 59 173.000 173.000 174.290 -1.290 25768 13074 1 15 . 1 1 59 59 VAL CA C 59 59.950 59.950 60.712 -0.762 25768 13075 1 15 . 1 1 59 59 VAL CB C 59 35.170 35.170 33.253 1.917 25768 13076 1 15 . 1 1 59 59 VAL H H 59 9.030 9.030 8.207 0.823 25768 13077 1 15 . 1 1 60 60 GLU N N 60 127.900 127.900 124.809 3.091 25768 13078 1 15 . 1 1 60 60 GLU C C 60 174.470 174.470 174.441 0.029 25768 13079 1 15 . 1 1 60 60 GLU CA C 60 52.940 52.940 53.978 -1.038 25768 13080 1 15 . 1 1 60 60 GLU CB C 60 35.100 35.100 33.808 1.292 25768 13081 1 15 . 1 1 60 60 GLU H H 60 9.440 9.440 8.319 1.121 25768 13082 1 15 . 1 1 61 61 LEU N N 61 127.410 127.410 122.978 4.432 25768 13083 1 15 . 1 1 61 61 LEU C C 61 174.950 174.950 175.228 -0.278 25768 13084 1 15 . 1 1 61 61 LEU CA C 61 53.390 53.390 53.595 -0.205 25768 13085 1 15 . 1 1 61 61 LEU CB C 61 45.980 45.980 46.189 -0.209 25768 13086 1 15 . 1 1 61 61 LEU H H 61 8.740 8.740 7.991 0.749 25768 13087 1 15 . 1 1 62 62 VAL N N 62 125.750 125.750 117.326 8.424 25768 13088 1 15 . 1 1 62 62 VAL C C 62 173.960 173.960 174.219 -0.259 25768 13089 1 15 . 1 1 62 62 VAL CA C 62 61.350 61.350 59.899 1.451 25768 13090 1 15 . 1 1 62 62 VAL CB C 62 34.740 34.740 33.557 1.183 25768 13091 1 15 . 1 1 62 62 VAL H H 62 8.790 8.790 7.816 0.974 25768 13092 1 15 . 1 1 63 63 ALA N N 63 127.230 127.230 126.263 0.967 25768 13093 1 15 . 1 1 63 63 ALA C C 63 173.930 173.930 175.191 -1.261 25768 13094 1 15 . 1 1 63 63 ALA CA C 63 51.140 51.140 52.317 -1.177 25768 13095 1 15 . 1 1 63 63 ALA CB C 63 22.500 22.500 22.133 0.367 25768 13096 1 15 . 1 1 63 63 ALA H H 63 8.740 8.740 7.972 0.768 25768 13097 1 15 . 1 1 64 64 ALA N N 64 120.410 120.410 124.177 -3.767 25768 13098 1 15 . 1 1 64 64 ALA C C 64 176.770 176.770 176.758 0.012 25768 13099 1 15 . 1 1 64 64 ALA CA C 64 51.420 51.420 50.559 0.861 25768 13100 1 15 . 1 1 64 64 ALA CB C 64 22.590 22.590 20.965 1.625 25768 13101 1 15 . 1 1 64 64 ALA H H 64 8.290 8.290 8.279 0.011 25768 13102 1 15 . 1 1 65 65 THR N N 65 116.130 116.130 118.019 -1.889 25768 13103 1 15 . 1 1 65 65 THR C C 65 171.220 171.220 173.703 -2.483 25768 13104 1 15 . 1 1 65 65 THR CA C 65 58.860 58.860 60.140 -1.280 25768 13105 1 15 . 1 1 65 65 THR CB C 65 72.020 72.020 69.146 2.874 25768 13106 1 15 . 1 1 65 65 THR H H 65 8.760 8.760 7.990 0.770 25768 13107 1 15 . 1 1 66 66 PRO C C 66 176.720 176.720 176.546 0.174 25768 13108 1 15 . 1 1 66 66 PRO CA C 66 63.610 63.610 65.057 -1.447 25768 13109 1 15 . 1 1 66 66 PRO CB C 66 32.550 32.550 31.914 0.636 25768 13110 1 15 . 1 1 67 67 PHE N N 67 120.360 120.360 112.857 7.503 25768 13111 1 15 . 1 1 67 67 PHE C C 67 175.480 175.480 175.438 0.042 25768 13112 1 15 . 1 1 67 67 PHE CA C 67 58.840 58.840 58.897 -0.057 25768 13113 1 15 . 1 1 67 67 PHE CB C 67 40.170 40.170 39.906 0.264 25768 13114 1 15 . 1 1 67 67 PHE H H 67 8.590 8.590 7.586 1.004 25768 13115 1 15 . 1 1 68 68 ASN N N 68 119.030 119.030 118.660 0.370 25768 13116 1 15 . 1 1 68 68 ASN C C 68 174.740 174.740 173.528 1.212 25768 13117 1 15 . 1 1 68 68 ASN CA C 68 53.430 53.430 53.200 0.230 25768 13118 1 15 . 1 1 68 68 ASN CB C 68 39.420 39.420 40.971 -1.551 25768 13119 1 15 . 1 1 68 68 ASN H H 68 8.340 8.340 8.480 -0.140 25768 13120 1 15 . 1 1 69 69 HIS N N 69 119.590 119.590 117.828 1.762 25768 13121 1 15 . 1 1 69 69 HIS C C 69 174.370 174.370 174.741 -0.371 25768 13122 1 15 . 1 1 69 69 HIS CA C 69 55.950 55.950 56.037 -0.087 25768 13123 1 15 . 1 1 69 69 HIS CB C 69 29.960 29.960 30.679 -0.719 25768 13124 1 15 . 1 1 69 69 HIS H H 69 8.350 8.350 8.644 -0.294 25768 13125 1 15 . 1 1 70 70 GLN N N 70 121.980 121.980 121.728 0.252 25768 13126 1 15 . 1 1 70 70 GLN C C 70 175.740 175.740 176.270 -0.530 25768 13127 1 15 . 1 1 70 70 GLN CA C 70 56.340 56.340 55.104 1.236 25768 13128 1 15 . 1 1 70 70 GLN CB C 70 29.660 29.660 27.669 1.992 25768 13129 1 15 . 1 1 70 70 GLN H H 70 8.350 8.350 8.383 -0.033 25768 13130 1 15 . 1 1 71 71 VAL N N 71 120.530 120.530 118.448 2.082 25768 13131 1 15 . 1 1 71 71 VAL C C 71 175.500 175.500 174.198 1.302 25768 13132 1 15 . 1 1 71 71 VAL CA C 71 62.540 62.540 63.106 -0.566 25768 13133 1 15 . 1 1 71 71 VAL CB C 71 33.090 33.090 31.157 1.933 25768 13134 1 15 . 1 1 71 71 VAL H H 71 8.020 8.020 7.881 0.139 25768 13135 1 15 . 1 1 72 72 ASP N N 72 123.910 123.910 125.092 -1.182 25768 13136 1 15 . 1 1 72 72 ASP C C 72 176.300 176.300 176.962 -0.662 25768 13137 1 15 . 1 1 72 72 ASP CA C 72 54.340 54.340 53.131 1.209 25768 13138 1 15 . 1 1 72 72 ASP CB C 72 41.480 41.480 43.115 -1.635 25768 13139 1 15 . 1 1 72 72 ASP H H 72 8.280 8.280 7.932 0.348 25768 13140 1 15 . 1 1 73 73 VAL N N 73 120.580 120.580 120.011 0.569 25768 13141 1 15 . 1 1 73 73 VAL C C 73 176.350 176.350 175.337 1.013 25768 13142 1 15 . 1 1 73 73 VAL CA C 73 62.970 62.970 64.849 -1.879 25768 13143 1 15 . 1 1 73 73 VAL CB C 73 32.550 32.550 30.563 1.987 25768 13144 1 15 . 1 1 73 73 VAL H H 73 7.960 7.960 8.592 -0.632 25768 13145 1 15 . 1 1 74 74 LYS N N 74 123.620 123.620 123.575 0.045 25768 13146 1 15 . 1 1 74 74 LYS C C 74 177.130 177.130 176.122 1.008 25768 13147 1 15 . 1 1 74 74 LYS CA C 74 57.060 57.060 55.801 1.259 25768 13148 1 15 . 1 1 74 74 LYS CB C 74 32.860 32.860 33.465 -0.605 25768 13149 1 15 . 1 1 74 74 LYS H H 74 8.230 8.230 8.128 0.102 25768 13150 1 15 . 1 1 75 75 GLY N N 75 109.370 109.370 111.248 -1.878 25768 13151 1 15 . 1 1 75 75 GLY C C 75 174.030 174.030 174.597 -0.567 25768 13152 1 15 . 1 1 75 75 GLY CA C 75 45.800 45.800 44.516 1.284 25768 13153 1 15 . 1 1 75 75 GLY H H 75 8.160 8.160 8.616 -0.456 25768 13154 1 15 . 1 1 76 76 LEU N N 76 121.660 121.660 119.299 2.361 25768 13155 1 15 . 1 1 76 76 LEU C C 76 177.410 177.410 177.216 0.194 25768 13156 1 15 . 1 1 76 76 LEU CA C 76 55.410 55.410 54.677 0.733 25768 13157 1 15 . 1 1 76 76 LEU CB C 76 42.790 42.790 41.078 1.712 25768 13158 1 15 . 1 1 76 76 LEU H H 76 8.030 8.030 8.082 -0.053 25768 13159 1 15 . 1 1 77 77 GLY N N 77 109.330 109.330 111.180 -1.850 25768 13160 1 15 . 1 1 77 77 GLY C C 77 171.800 171.800 174.093 -2.293 25768 13161 1 15 . 1 1 77 77 GLY CA C 77 44.990 44.990 44.530 0.460 25768 13162 1 15 . 1 1 77 77 GLY H H 77 8.100 8.100 8.506 -0.406 25768 13163 1 15 . 1 1 78 78 PRO C C 78 177.740 177.740 177.456 0.284 25768 13164 1 15 . 1 1 78 78 PRO CA C 78 63.890 63.890 63.428 0.462 25768 13165 1 15 . 1 1 78 78 PRO CB C 78 32.170 32.170 32.097 0.073 25768 13166 1 15 . 1 1 79 79 GLY N N 79 109.530 109.530 107.840 1.690 25768 13167 1 15 . 1 1 79 79 GLY C C 79 174.460 174.460 173.862 0.598 25768 13168 1 15 . 1 1 79 79 GLY CA C 79 45.780 45.780 44.321 1.459 25768 13169 1 15 . 1 1 79 79 GLY H H 79 8.410 8.410 7.752 0.658 25768 13170 1 15 . 1 1 80 80 LEU N N 80 121.880 121.880 118.740 3.140 25768 13171 1 15 . 1 1 80 80 LEU C C 80 177.100 177.100 176.625 0.475 25768 13172 1 15 . 1 1 80 80 LEU CA C 80 55.720 55.720 55.299 0.421 25768 13173 1 15 . 1 1 80 80 LEU CB C 80 42.580 42.580 42.655 -0.075 25768 13174 1 15 . 1 1 80 80 LEU H H 80 8.010 8.010 8.198 -0.188 25768 13175 1 15 . 1 1 81 81 ASP N N 81 119.990 119.990 119.183 0.807 25768 13176 1 15 . 1 1 81 81 ASP C C 81 176.880 176.880 176.273 0.607 25768 13177 1 15 . 1 1 81 81 ASP CA C 81 54.770 54.770 53.719 1.051 25768 13178 1 15 . 1 1 81 81 ASP CB C 81 41.390 41.390 42.554 -1.164 25768 13179 1 15 . 1 1 81 81 ASP H H 81 8.220 8.220 7.870 0.350 25768 13180 1 15 . 1 1 82 82 GLY N N 82 109.270 109.270 109.124 0.146 25768 13181 1 15 . 1 1 82 82 GLY C C 82 174.190 174.190 174.189 0.001 25768 13182 1 15 . 1 1 82 82 GLY CA C 82 45.990 45.990 45.244 0.746 25768 13183 1 15 . 1 1 82 82 GLY H H 82 8.170 8.170 8.615 -0.445 25768 13184 1 15 . 1 1 83 83 LYS N N 83 121.000 121.000 117.868 3.132 25768 13185 1 15 . 1 1 83 83 LYS C C 83 176.610 176.610 176.804 -0.194 25768 13186 1 15 . 1 1 83 83 LYS CA C 83 56.620 56.620 56.386 0.234 25768 13187 1 15 . 1 1 83 83 LYS CB C 83 33.020 33.020 33.044 -0.024 25768 13188 1 15 . 1 1 83 83 LYS H H 83 7.970 7.970 8.142 -0.172 25768 13189 1 15 . 1 1 84 84 LEU N N 84 123.120 123.120 119.036 4.084 25768 13190 1 15 . 1 1 84 84 LEU C C 84 176.920 176.920 175.094 1.826 25768 13191 1 15 . 1 1 84 84 LEU CA C 84 55.550 55.550 56.178 -0.628 25768 13192 1 15 . 1 1 84 84 LEU CB C 84 42.430 42.430 43.030 -0.600 25768 13193 1 15 . 1 1 84 84 LEU H H 84 8.130 8.130 8.215 -0.085 25768 13194 1 15 . 1 1 85 85 ALA N N 85 123.930 123.930 122.431 1.499 25768 13195 1 15 . 1 1 85 85 ALA C C 85 177.060 177.060 176.069 0.991 25768 13196 1 15 . 1 1 85 85 ALA CA C 85 52.790 52.790 51.892 0.898 25768 13197 1 15 . 1 1 85 85 ALA CB C 85 19.670 19.670 20.091 -0.421 25768 13198 1 15 . 1 1 85 85 ALA H H 85 8.040 8.040 7.683 0.357 25768 13199 1 15 . 1 1 86 86 ASP N N 86 119.760 119.760 117.944 1.816 25768 13200 1 15 . 1 1 86 86 ASP C C 86 175.820 175.820 175.818 0.002 25768 13201 1 15 . 1 1 86 86 ASP CA C 86 54.520 54.520 53.166 1.354 25768 13202 1 15 . 1 1 86 86 ASP CB C 86 41.390 41.390 42.422 -1.032 25768 13203 1 15 . 1 1 86 86 ASP H H 86 8.110 8.110 7.999 0.111 25768 13204 1 15 . 1 1 87 87 ILE N N 87 120.620 120.620 115.435 5.185 25768 13205 1 15 . 1 1 87 87 ILE C C 87 175.740 175.740 174.765 0.975 25768 13206 1 15 . 1 1 87 87 ILE CA C 87 61.160 61.160 60.927 0.233 25768 13207 1 15 . 1 1 87 87 ILE CB C 87 39.260 39.260 39.383 -0.123 25768 13208 1 15 . 1 1 87 87 ILE H H 87 7.800 7.800 8.131 -0.331 25768 13209 1 15 . 1 1 88 88 LYS N N 88 125.820 125.820 121.995 3.825 25768 13210 1 15 . 1 1 88 88 LYS C C 88 175.340 175.340 175.175 0.165 25768 13211 1 15 . 1 1 88 88 LYS CA C 88 56.300 56.300 56.759 -0.459 25768 13212 1 15 . 1 1 88 88 LYS CB C 88 32.900 32.900 33.367 -0.467 25768 13213 1 15 . 1 1 88 88 LYS H H 88 8.250 8.250 8.006 0.244 25768 13214 1 15 . 1 1 89 89 GLN N N 89 121.750 121.750 121.870 -0.120 25768 13215 1 15 . 1 1 89 89 GLN C C 89 175.000 175.000 174.860 0.140 25768 13216 1 15 . 1 1 89 89 GLN CA C 89 55.210 55.210 55.904 -0.694 25768 13217 1 15 . 1 1 89 89 GLN CB C 89 30.570 30.570 30.302 0.268 25768 13218 1 15 . 1 1 89 89 GLN H H 89 8.000 8.000 8.371 -0.371 25768 13219 1 15 . 1 1 90 90 LEU N N 90 126.660 126.660 127.659 -0.999 25768 13220 1 15 . 1 1 90 90 LEU C C 90 174.240 174.240 175.374 -1.134 25768 13221 1 15 . 1 1 90 90 LEU CA C 90 52.720 52.720 52.858 -0.138 25768 13222 1 15 . 1 1 90 90 LEU CB C 90 42.350 42.350 42.592 -0.242 25768 13223 1 15 . 1 1 90 90 LEU H H 90 8.630 8.630 8.360 0.270 25768 13224 1 15 . 1 1 92 92 PRO C C 92 173.900 173.900 176.606 -2.706 25768 13225 1 15 . 1 1 92 92 PRO CA C 92 63.320 63.320 62.169 1.151 25768 13226 1 15 . 1 1 92 92 PRO CB C 92 31.920 31.920 33.547 -1.627 25768 13227 1 15 . 1 1 93 93 THR N N 93 119.770 119.770 117.860 1.910 25768 13228 1 15 . 1 1 93 93 THR C C 93 171.360 171.360 173.263 -1.903 25768 13229 1 15 . 1 1 93 93 THR CA C 93 62.610 62.610 62.084 0.526 25768 13230 1 15 . 1 1 93 93 THR CB C 93 72.680 72.680 70.703 1.977 25768 13231 1 15 . 1 1 93 93 THR H H 93 8.290 8.290 8.131 0.159 25768 13232 1 15 . 1 1 94 94 LEU N N 94 128.880 128.880 126.462 2.418 25768 13233 1 15 . 1 1 94 94 LEU C C 94 175.130 175.130 174.232 0.898 25768 13234 1 15 . 1 1 94 94 LEU CA C 94 53.520 53.520 53.742 -0.222 25768 13235 1 15 . 1 1 94 94 LEU CB C 94 46.140 46.140 44.113 2.027 25768 13236 1 15 . 1 1 94 94 LEU H H 94 8.680 8.680 8.224 0.456 25768 13237 1 15 . 1 1 95 95 LEU N N 95 123.630 123.630 124.395 -0.765 25768 13238 1 15 . 1 1 95 95 LEU C C 95 175.540 175.540 174.806 0.734 25768 13239 1 15 . 1 1 95 95 LEU CA C 95 55.190 55.190 53.948 1.242 25768 13240 1 15 . 1 1 95 95 LEU CB C 95 45.300 45.300 46.051 -0.751 25768 13241 1 15 . 1 1 95 95 LEU H H 95 9.580 9.580 8.126 1.454 25768 13242 1 15 . 1 1 96 96 LEU N N 96 123.150 123.150 124.726 -1.576 25768 13243 1 15 . 1 1 96 96 LEU C C 96 174.960 174.960 175.048 -0.088 25768 13244 1 15 . 1 1 96 96 LEU CA C 96 54.420 54.420 54.603 -0.184 25768 13245 1 15 . 1 1 96 96 LEU CB C 96 44.560 44.560 43.904 0.656 25768 13246 1 15 . 1 1 96 96 LEU H H 96 8.770 8.770 8.553 0.217 25768 13247 1 15 . 1 1 97 97 GLN N N 97 121.290 121.290 124.719 -3.429 25768 13248 1 15 . 1 1 97 97 GLN C C 97 174.380 174.380 173.842 0.538 25768 13249 1 15 . 1 1 97 97 GLN CA C 97 54.740 54.740 54.516 0.224 25768 13250 1 15 . 1 1 97 97 GLN CB C 97 36.600 36.600 31.685 4.915 25768 13251 1 15 . 1 1 97 97 GLN H H 97 9.480 9.480 8.702 0.778 25768 13252 1 15 . 1 1 98 98 TYR N N 98 122.250 122.250 124.033 -1.783 25768 13253 1 15 . 1 1 98 98 TYR C C 98 173.460 173.460 174.138 -0.678 25768 13254 1 15 . 1 1 98 98 TYR CA C 98 55.160 55.160 56.034 -0.874 25768 13255 1 15 . 1 1 98 98 TYR CB C 98 42.420 42.420 43.230 -0.810 25768 13256 1 15 . 1 1 98 98 TYR H H 98 9.010 9.010 9.107 -0.097 25768 13257 1 15 . 1 1 99 99 TYR N N 99 126.860 126.860 123.359 3.501 25768 13258 1 15 . 1 1 99 99 TYR C C 99 175.380 175.380 174.960 0.420 25768 13259 1 15 . 1 1 99 99 TYR CA C 99 54.220 54.220 55.922 -1.702 25768 13260 1 15 . 1 1 99 99 TYR CB C 99 38.890 38.890 38.155 0.735 25768 13261 1 15 . 1 1 99 99 TYR H H 99 8.300 8.300 8.280 0.020 25768 13262 1 15 . 1 1 100 100 PRO C C 100 178.330 178.330 177.241 1.089 25768 13263 1 15 . 1 1 100 100 PRO CA C 100 64.750 64.750 65.397 -0.646 25768 13264 1 15 . 1 1 100 100 PRO CB C 100 32.130 32.130 32.087 0.043 25768 13265 1 15 . 1 1 101 101 MET N N 101 114.520 114.520 117.140 -2.620 25768 13266 1 15 . 1 1 101 101 MET C C 101 178.240 178.240 175.605 2.635 25768 13267 1 15 . 1 1 101 101 MET CA C 101 53.500 53.500 54.232 -0.732 25768 13268 1 15 . 1 1 101 101 MET CB C 101 30.160 30.160 33.138 -2.978 25768 13269 1 15 . 1 1 101 101 MET H H 101 9.390 9.390 8.050 1.340 25768 13270 1 15 . 1 1 102 102 GLY N N 102 117.500 117.500 107.845 9.655 25768 13271 1 15 . 1 1 102 102 GLY C C 102 175.690 175.690 174.372 1.318 25768 13272 1 15 . 1 1 102 102 GLY CA C 102 46.760 46.760 44.970 1.790 25768 13273 1 15 . 1 1 102 102 GLY H H 102 8.640 8.640 7.493 1.147 25768 13274 1 15 . 1 1 103 103 GLY N N 103 111.030 111.030 112.137 -1.107 25768 13275 1 15 . 1 1 103 103 GLY C C 103 174.070 174.070 173.955 0.115 25768 13276 1 15 . 1 1 103 103 GLY CA C 103 46.140 46.140 44.875 1.265 25768 13277 1 15 . 1 1 103 103 GLY H H 103 9.390 9.390 8.679 0.711 25768 13278 1 15 . 1 1 104 104 THR N N 104 109.290 109.290 114.565 -5.275 25768 13279 1 15 . 1 1 104 104 THR C C 104 174.290 174.290 174.342 -0.052 25768 13280 1 15 . 1 1 104 104 THR CA C 104 60.900 60.900 59.965 0.935 25768 13281 1 15 . 1 1 104 104 THR CB C 104 72.070 72.070 70.310 1.760 25768 13282 1 15 . 1 1 104 104 THR H H 104 7.290 7.290 7.821 -0.531 25768 13283 1 15 . 1 1 105 105 ASN C C 105 175.050 175.050 174.850 0.200 25768 13284 1 15 . 1 1 105 105 ASN CA C 105 52.880 52.880 53.321 -0.441 25768 13285 1 15 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.666 -0.406 25768 13286 1 15 . 1 1 106 106 SER N N 106 113.000 113.000 115.493 -2.493 25768 13287 1 15 . 1 1 106 106 SER C C 106 176.000 176.000 174.841 1.159 25768 13288 1 15 . 1 1 106 106 SER CA C 106 58.700 58.700 57.856 0.844 25768 13289 1 15 . 1 1 106 106 SER CB C 106 64.540 64.540 64.952 -0.412 25768 13290 1 15 . 1 1 106 106 SER H H 106 7.450 7.450 7.591 -0.141 25768 13291 1 15 . 1 1 107 107 ALA N N 107 132.220 132.220 126.195 6.025 25768 13292 1 15 . 1 1 107 107 ALA C C 107 176.610 176.610 177.052 -0.442 25768 13293 1 15 . 1 1 107 107 ALA CA C 107 54.380 54.380 53.442 0.938 25768 13294 1 15 . 1 1 107 107 ALA CB C 107 18.690 18.690 19.193 -0.503 25768 13295 1 15 . 1 1 107 107 ALA H H 107 8.870 8.870 8.721 0.149 25768 13296 1 15 . 1 1 108 108 PHE N N 108 116.050 116.050 116.656 -0.606 25768 13297 1 15 . 1 1 108 108 PHE C C 108 174.270 174.270 175.600 -1.330 25768 13298 1 15 . 1 1 108 108 PHE CA C 108 56.140 56.140 56.883 -0.743 25768 13299 1 15 . 1 1 108 108 PHE CB C 108 40.520 40.520 39.791 0.729 25768 13300 1 15 . 1 1 108 108 PHE H H 108 7.550 7.550 7.982 -0.432 25768 13301 1 15 . 1 1 109 109 GLN N N 109 128.260 128.260 125.109 3.151 25768 13302 1 15 . 1 1 109 109 GLN C C 109 172.300 172.300 174.466 -2.166 25768 13303 1 15 . 1 1 109 109 GLN CA C 109 52.310 52.310 52.899 -0.589 25768 13304 1 15 . 1 1 109 109 GLN CB C 109 29.050 29.050 31.005 -1.954 25768 13305 1 15 . 1 1 109 109 GLN H H 109 9.060 9.060 8.573 0.487 25768 13306 1 15 . 1 1 110 110 PRO C C 110 175.020 175.020 175.730 -0.710 25768 13307 1 15 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.999 -1.449 25768 13308 1 15 . 1 1 110 110 PRO CB C 110 33.280 33.280 32.732 0.548 25768 13309 1 15 . 1 1 111 111 TYR N N 111 115.730 115.730 114.326 1.404 25768 13310 1 15 . 1 1 111 111 TYR C C 111 173.850 173.850 173.272 0.578 25768 13311 1 15 . 1 1 111 111 TYR CA C 111 56.470 56.470 57.175 -0.705 25768 13312 1 15 . 1 1 111 111 TYR CB C 111 38.650 38.650 38.791 -0.141 25768 13313 1 15 . 1 1 111 111 TYR H H 111 8.500 8.500 8.082 0.418 25768 13314 1 15 . 1 1 112 112 GLY N N 112 103.570 103.570 106.508 -2.938 25768 13315 1 15 . 1 1 112 112 GLY C C 112 172.020 172.020 172.482 -0.462 25768 13316 1 15 . 1 1 112 112 GLY CA C 112 43.950 43.950 43.015 0.935 25768 13317 1 15 . 1 1 112 112 GLY H H 112 8.110 8.110 8.494 -0.384 25768 13318 1 15 . 1 1 113 113 GLY N N 113 108.510 108.510 106.187 2.323 25768 13319 1 15 . 1 1 113 113 GLY C C 113 171.540 171.540 172.323 -0.783 25768 13320 1 15 . 1 1 113 113 GLY CA C 113 46.120 46.120 44.834 1.286 25768 13321 1 15 . 1 1 113 113 GLY H H 113 9.080 9.080 8.517 0.563 25768 13322 1 15 . 1 1 114 114 LEU N N 114 120.270 120.270 120.363 -0.093 25768 13323 1 15 . 1 1 114 114 LEU C C 114 175.810 175.810 175.618 0.192 25768 13324 1 15 . 1 1 114 114 LEU CA C 114 53.920 53.920 53.392 0.528 25768 13325 1 15 . 1 1 114 114 LEU CB C 114 47.940 47.940 45.936 2.004 25768 13326 1 15 . 1 1 114 114 LEU H H 114 8.620 8.620 8.967 -0.347 25768 13327 1 15 . 1 1 115 115 GLY N N 115 110.620 110.620 109.568 1.052 25768 13328 1 15 . 1 1 115 115 GLY C C 115 171.560 171.560 173.369 -1.809 25768 13329 1 15 . 1 1 115 115 GLY CA C 115 46.940 46.940 43.893 3.047 25768 13330 1 15 . 1 1 115 115 GLY H H 115 9.000 9.000 7.945 1.055 25768 13331 1 15 . 1 1 116 116 VAL N N 116 113.600 113.600 116.680 -3.080 25768 13332 1 15 . 1 1 116 116 VAL C C 116 174.120 174.120 173.068 1.052 25768 13333 1 15 . 1 1 116 116 VAL CA C 116 58.970 58.970 60.700 -1.730 25768 13334 1 15 . 1 1 116 116 VAL CB C 116 36.600 36.600 35.773 0.827 25768 13335 1 15 . 1 1 116 116 VAL H H 116 8.680 8.680 8.611 0.069 25768 13336 1 15 . 1 1 117 117 ASN N N 117 120.020 120.020 120.059 -0.039 25768 13337 1 15 . 1 1 117 117 ASN CA C 117 52.190 52.190 52.902 -0.712 25768 13338 1 15 . 1 1 117 117 ASN CB C 117 42.450 42.450 40.883 1.567 25768 13339 1 15 . 1 1 117 117 ASN H H 117 8.840 8.840 8.338 0.502 25768 13340 1 15 . 1 1 119 119 THR C C 119 174.350 174.350 174.008 0.342 25768 13341 1 15 . 1 1 119 119 THR CA C 119 63.140 63.140 62.897 0.243 25768 13342 1 15 . 1 1 119 119 THR CB C 119 70.170 70.170 68.769 1.401 25768 13343 1 15 . 1 1 120 120 THR N N 120 114.120 114.120 112.159 1.961 25768 13344 1 15 . 1 1 120 120 THR C C 120 174.220 174.220 173.673 0.547 25768 13345 1 15 . 1 1 120 120 THR CA C 120 61.900 61.900 63.127 -1.226 25768 13346 1 15 . 1 1 120 120 THR CB C 120 70.140 70.140 68.322 1.818 25768 13347 1 15 . 1 1 120 120 THR H H 120 7.570 7.570 8.358 -0.788 25768 13348 1 15 . 1 1 121 121 PHE N N 121 121.230 121.230 114.669 6.561 25768 13349 1 15 . 1 1 121 121 PHE C C 121 174.910 174.910 175.624 -0.714 25768 13350 1 15 . 1 1 121 121 PHE CA C 121 58.720 58.720 58.032 0.688 25768 13351 1 15 . 1 1 121 121 PHE CB C 121 40.470 40.470 38.806 1.664 25768 13352 1 15 . 1 1 121 121 PHE H H 121 7.830 7.830 7.865 -0.035 25768 13353 1 15 . 1 1 122 122 PHE C C 122 175.070 175.070 175.321 -0.251 25768 13354 1 15 . 1 1 122 122 PHE CA C 122 57.890 57.890 58.091 -0.201 25768 13355 1 15 . 1 1 122 122 PHE CB C 122 39.870 39.870 40.174 -0.304 25768 13356 1 15 . 1 1 123 123 ASP N N 123 122.170 122.170 121.003 1.167 25768 13357 1 15 . 1 1 123 123 ASP C C 123 176.150 176.150 176.739 -0.589 25768 13358 1 15 . 1 1 123 123 ASP CA C 123 54.530 54.530 54.332 0.198 25768 13359 1 15 . 1 1 123 123 ASP CB C 123 41.830 41.830 42.866 -1.036 25768 13360 1 15 . 1 1 123 123 ASP H H 123 7.950 7.950 8.761 -0.811 25768 13361 1 15 . 1 1 124 124 GLU N N 124 122.690 122.690 123.325 -0.635 25768 13362 1 15 . 1 1 124 124 GLU C C 124 176.630 176.630 177.284 -0.654 25768 13363 1 15 . 1 1 124 124 GLU CA C 124 57.620 57.620 58.063 -0.443 25768 13364 1 15 . 1 1 124 124 GLU CB C 124 30.450 30.450 30.043 0.407 25768 13365 1 15 . 1 1 124 124 GLU H H 124 8.340 8.340 8.883 -0.543 25768 13366 1 15 . 1 1 125 125 ASP N N 125 121.280 121.280 120.917 0.363 25768 13367 1 15 . 1 1 125 125 ASP C C 125 176.940 176.940 177.859 -0.919 25768 13368 1 15 . 1 1 125 125 ASP CA C 125 55.180 55.180 57.092 -1.912 25768 13369 1 15 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.477 0.743 25768 13370 1 15 . 1 1 125 125 ASP H H 125 8.310 8.310 8.481 -0.171 25768 13371 1 15 . 1 1 126 126 LEU N N 126 122.830 122.830 119.536 3.294 25768 13372 1 15 . 1 1 126 126 LEU C C 126 178.020 178.020 178.220 -0.200 25768 13373 1 15 . 1 1 126 126 LEU CA C 126 56.450 56.450 57.783 -1.333 25768 13374 1 15 . 1 1 126 126 LEU CB C 126 42.150 42.150 42.283 -0.133 25768 13375 1 15 . 1 1 126 126 LEU H H 126 8.010 8.010 7.615 0.395 25768 13376 1 15 . 1 1 127 127 ALA N N 127 122.660 122.660 118.131 4.529 25768 13377 1 15 . 1 1 127 127 ALA C C 127 178.600 178.600 177.220 1.380 25768 13378 1 15 . 1 1 127 127 ALA CA C 127 53.780 53.780 53.221 0.559 25768 13379 1 15 . 1 1 127 127 ALA CB C 127 19.000 19.000 19.138 -0.138 25768 13380 1 15 . 1 1 127 127 ALA H H 127 8.100 8.100 7.847 0.253 25768 13381 1 15 . 1 1 128 128 SER N N 128 113.740 113.740 113.131 0.609 25768 13382 1 15 . 1 1 128 128 SER C C 128 175.010 175.010 172.939 2.071 25768 13383 1 15 . 1 1 128 128 SER CA C 128 59.580 59.580 58.908 0.672 25768 13384 1 15 . 1 1 128 128 SER CB C 128 63.800 63.800 62.775 1.025 25768 13385 1 15 . 1 1 128 128 SER H H 128 7.920 7.920 8.063 -0.143 25768 13386 1 15 . 1 1 129 129 ASN N N 129 120.300 120.300 120.217 0.083 25768 13387 1 15 . 1 1 129 129 ASN C C 129 175.590 175.590 175.061 0.529 25768 13388 1 15 . 1 1 129 129 ASN CA C 129 54.180 54.180 53.840 0.340 25768 13389 1 15 . 1 1 129 129 ASN CB C 129 38.900 38.900 38.792 0.108 25768 13390 1 15 . 1 1 129 129 ASN H H 129 8.120 8.120 8.496 -0.376 25768 13391 1 15 . 1 1 130 130 ARG N N 130 120.630 120.630 124.054 -3.424 25768 13392 1 15 . 1 1 130 130 ARG C C 130 176.720 176.720 175.336 1.384 25768 13393 1 15 . 1 1 130 130 ARG CA C 130 57.240 57.240 55.849 1.391 25768 13394 1 15 . 1 1 130 130 ARG CB C 130 30.500 30.500 32.549 -2.049 25768 13395 1 15 . 1 1 130 130 ARG H H 130 8.050 8.050 8.431 -0.381 25768 13396 1 15 . 1 1 131 131 LYS N N 131 121.150 121.150 123.010 -1.860 25768 13397 1 15 . 1 1 131 131 LYS C C 131 176.750 176.750 175.234 1.516 25768 13398 1 15 . 1 1 131 131 LYS CA C 131 57.050 57.050 56.058 0.992 25768 13399 1 15 . 1 1 131 131 LYS CB C 131 32.870 32.870 32.186 0.684 25768 13400 1 15 . 1 1 131 131 LYS H H 131 8.020 8.020 8.596 -0.576 25768 13401 1 15 . 1 1 132 132 ALA N N 132 124.110 124.110 126.384 -2.274 25768 13402 1 15 . 1 1 132 132 ALA C C 132 177.680 177.680 177.844 -0.164 25768 13403 1 15 . 1 1 132 132 ALA CA C 132 53.070 53.070 51.418 1.652 25768 13404 1 15 . 1 1 132 132 ALA CB C 132 19.250 19.250 20.475 -1.225 25768 13405 1 15 . 1 1 132 132 ALA H H 132 8.010 8.010 8.219 -0.209 25768 13406 1 15 . 1 1 133 133 GLN N N 133 118.830 118.830 119.798 -0.968 25768 13407 1 15 . 1 1 133 133 GLN C C 133 176.380 176.380 177.194 -0.814 25768 13408 1 15 . 1 1 133 133 GLN CA C 133 56.400 56.400 57.153 -0.753 25768 13409 1 15 . 1 1 133 133 GLN CB C 133 29.670 29.670 29.278 0.392 25768 13410 1 15 . 1 1 133 133 GLN H H 133 8.070 8.070 8.656 -0.586 25768 13411 1 15 . 1 1 134 134 GLY N N 134 109.400 109.400 108.593 0.807 25768 13412 1 15 . 1 1 134 134 GLY C C 134 174.060 174.060 173.172 0.888 25768 13413 1 15 . 1 1 134 134 GLY CA C 134 45.690 45.690 44.987 0.703 25768 13414 1 15 . 1 1 134 134 GLY H H 134 8.150 8.150 8.372 -0.222 25768 13415 1 15 . 1 1 135 135 PHE N N 135 120.480 120.480 121.590 -1.110 25768 13416 1 15 . 1 1 135 135 PHE C C 135 176.000 176.000 173.974 2.026 25768 13417 1 15 . 1 1 135 135 PHE CA C 135 58.370 58.370 58.313 0.057 25768 13418 1 15 . 1 1 135 135 PHE CB C 135 39.710 39.710 41.359 -1.649 25768 13419 1 15 . 1 1 135 135 PHE H H 135 8.060 8.060 8.120 -0.060 25768 13420 1 15 . 1 1 136 136 SER N N 136 116.740 116.740 121.952 -5.212 25768 13421 1 15 . 1 1 136 136 SER C C 136 174.620 174.620 172.971 1.649 25768 13422 1 15 . 1 1 136 136 SER CA C 136 58.870 58.870 57.491 1.379 25768 13423 1 15 . 1 1 136 136 SER CB C 136 64.200 64.200 64.624 -0.424 25768 13424 1 15 . 1 1 136 136 SER H H 136 8.160 8.160 8.075 0.085 25768 13425 1 15 . 1 1 137 137 SER N N 137 117.650 117.650 121.861 -4.211 25768 13426 1 15 . 1 1 137 137 SER C C 137 174.410 174.410 174.005 0.405 25768 13427 1 15 . 1 1 137 137 SER CA C 137 58.880 58.880 58.258 0.622 25768 13428 1 15 . 1 1 137 137 SER CB C 137 64.140 64.140 63.454 0.686 25768 13429 1 15 . 1 1 137 137 SER H H 137 8.140 8.140 8.508 -0.368 25768 13430 1 15 . 1 1 138 138 MET N N 138 121.980 121.980 127.217 -5.237 25768 13431 1 15 . 1 1 138 138 MET C C 138 175.680 175.680 174.586 1.094 25768 13432 1 15 . 1 1 138 138 MET CA C 138 56.180 56.180 55.263 0.917 25768 13433 1 15 . 1 1 138 138 MET CB C 138 33.240 33.240 33.842 -0.602 25768 13434 1 15 . 1 1 138 138 MET H H 138 8.110 8.110 8.391 -0.281 25768 13435 1 15 . 1 1 139 139 LYS N N 139 122.110 122.110 124.340 -2.230 25768 13436 1 15 . 1 1 139 139 LYS C C 139 176.220 176.220 174.667 1.553 25768 13437 1 15 . 1 1 139 139 LYS CA C 139 56.370 56.370 56.073 0.297 25768 13438 1 15 . 1 1 139 139 LYS CB C 139 33.220 33.220 32.182 1.038 25768 13439 1 15 . 1 1 139 139 LYS H H 139 8.140 8.140 8.486 -0.346 25768 13440 1 15 . 1 1 140 140 LEU N N 140 123.860 123.860 122.817 1.043 25768 13441 1 15 . 1 1 140 140 LEU C C 140 177.100 177.100 176.975 0.125 25768 13442 1 15 . 1 1 140 140 LEU CA C 140 55.710 55.710 53.870 1.840 25768 13443 1 15 . 1 1 140 140 LEU CB C 140 42.460 42.460 44.196 -1.736 25768 13444 1 15 . 1 1 140 140 LEU H H 140 8.140 8.140 8.040 0.100 25768 13445 1 15 . 1 1 141 141 GLN N N 141 120.350 120.350 118.789 1.561 25768 13446 1 15 . 1 1 141 141 GLN C C 141 175.170 175.170 175.757 -0.587 25768 13447 1 15 . 1 1 141 141 GLN CA C 141 56.200 56.200 56.151 0.049 25768 13448 1 15 . 1 1 141 141 GLN CB C 141 29.950 29.950 29.534 0.416 25768 13449 1 15 . 1 1 141 141 GLN H H 141 8.210 8.210 8.394 -0.184 25768 13450 1 15 . 1 1 142 142 ASP N N 142 120.950 120.950 118.792 2.158 25768 13451 1 15 . 1 1 142 142 ASP C C 142 175.840 175.840 175.855 -0.015 25768 13452 1 15 . 1 1 142 142 ASP CA C 142 54.700 54.700 54.571 0.129 25768 13453 1 15 . 1 1 142 142 ASP CB C 142 41.760 41.760 42.409 -0.649 25768 13454 1 15 . 1 1 142 142 ASP H H 142 8.120 8.120 8.315 -0.195 25768 13455 1 15 . 1 1 143 143 SER N N 143 114.880 114.880 114.938 -0.058 25768 13456 1 15 . 1 1 143 143 SER C C 143 173.290 173.290 172.838 0.452 25768 13457 1 15 . 1 1 143 143 SER CA C 143 58.450 58.450 58.851 -0.401 25768 13458 1 15 . 1 1 143 143 SER CB C 143 64.760 64.760 64.725 0.035 25768 13459 1 15 . 1 1 143 143 SER H H 143 7.960 7.960 7.991 -0.031 25768 13460 1 15 . 1 1 144 144 TRP N N 144 123.110 123.110 128.592 -5.482 25768 13461 1 15 . 1 1 144 144 TRP C C 144 175.880 175.880 174.968 0.912 25768 13462 1 15 . 1 1 144 144 TRP CA C 144 56.420 56.420 56.658 -0.238 25768 13463 1 15 . 1 1 144 144 TRP CB C 144 31.160 31.160 31.803 -0.643 25768 13464 1 15 . 1 1 144 144 TRP H H 144 8.080 8.080 8.782 -0.702 25768 13465 1 15 . 1 1 145 145 GLY N N 145 110.410 110.410 112.235 -1.825 25768 13466 1 15 . 1 1 145 145 GLY C C 145 172.870 172.870 173.354 -0.484 25768 13467 1 15 . 1 1 145 145 GLY CA C 145 45.130 45.130 45.361 -0.231 25768 13468 1 15 . 1 1 145 145 GLY H H 145 8.660 8.660 8.802 -0.142 25768 13469 1 15 . 1 1 148 148 GLY C C 148 171.800 171.800 173.542 -1.742 25768 13470 1 15 . 1 1 148 148 GLY CA C 148 44.140 44.140 44.728 -0.588 25768 13471 1 15 . 1 1 149 149 GLU N N 149 123.070 123.070 123.365 -0.295 25768 13472 1 15 . 1 1 149 149 GLU C C 149 174.210 174.210 174.692 -0.482 25768 13473 1 15 . 1 1 149 149 GLU CA C 149 55.120 55.120 55.200 -0.080 25768 13474 1 15 . 1 1 149 149 GLU CB C 149 37.410 37.410 33.273 4.137 25768 13475 1 15 . 1 1 149 149 GLU H H 149 8.550 8.550 8.254 0.296 25768 13476 1 15 . 1 1 150 150 LEU N N 150 126.130 126.130 123.677 2.453 25768 13477 1 15 . 1 1 150 150 LEU C C 150 174.410 174.410 175.060 -0.650 25768 13478 1 15 . 1 1 150 150 LEU CA C 150 54.260 54.260 54.018 0.242 25768 13479 1 15 . 1 1 150 150 LEU CB C 150 47.510 47.510 45.743 1.767 25768 13480 1 15 . 1 1 150 150 LEU H H 150 8.550 8.550 7.917 0.633 25768 13481 1 15 . 1 1 151 151 GLY N N 151 109.500 109.500 111.121 -1.621 25768 13482 1 15 . 1 1 151 151 GLY C C 151 170.610 170.610 171.811 -1.201 25768 13483 1 15 . 1 1 151 151 GLY CA C 151 45.980 45.980 45.754 0.226 25768 13484 1 15 . 1 1 151 151 GLY H H 151 8.090 8.090 7.937 0.153 25768 13485 1 15 . 1 1 152 152 PHE N N 152 110.960 110.960 113.945 -2.985 25768 13486 1 15 . 1 1 152 152 PHE C C 152 171.510 171.510 172.946 -1.436 25768 13487 1 15 . 1 1 152 152 PHE CA C 152 58.170 58.170 56.563 1.607 25768 13488 1 15 . 1 1 152 152 PHE CB C 152 41.690 41.690 41.426 0.264 25768 13489 1 15 . 1 1 152 152 PHE H H 152 8.380 8.380 7.321 1.059 25768 13490 1 15 . 1 1 153 153 ASP N N 153 118.880 118.880 118.466 0.414 25768 13491 1 15 . 1 1 153 153 ASP C C 153 176.520 176.520 174.753 1.767 25768 13492 1 15 . 1 1 153 153 ASP CA C 153 52.940 52.940 52.949 -0.009 25768 13493 1 15 . 1 1 153 153 ASP CB C 153 44.540 44.540 44.791 -0.251 25768 13494 1 15 . 1 1 153 153 ASP H H 153 7.970 7.970 8.616 -0.646 25768 13495 1 15 . 1 1 154 154 TYR N N 154 123.630 123.630 122.341 1.289 25768 13496 1 15 . 1 1 154 154 TYR C C 154 175.610 175.610 173.652 1.958 25768 13497 1 15 . 1 1 154 154 TYR CA C 154 57.310 57.310 57.019 0.291 25768 13498 1 15 . 1 1 154 154 TYR CB C 154 42.040 42.040 40.594 1.446 25768 13499 1 15 . 1 1 154 154 TYR H H 154 9.730 9.730 8.879 0.851 25768 13500 1 15 . 1 1 155 155 MET N N 155 126.190 126.190 126.762 -0.572 25768 13501 1 15 . 1 1 155 155 MET C C 155 174.970 174.970 174.299 0.671 25768 13502 1 15 . 1 1 155 155 MET CA C 155 54.720 54.720 55.182 -0.462 25768 13503 1 15 . 1 1 155 155 MET CB C 155 28.300 28.300 32.454 -4.154 25768 13504 1 15 . 1 1 155 155 MET H H 155 8.600 8.600 8.023 0.577 25768 13505 1 15 . 1 1 156 156 LEU N N 156 125.290 125.290 125.558 -0.268 25768 13506 1 15 . 1 1 156 156 LEU C C 156 177.680 177.680 177.186 0.494 25768 13507 1 15 . 1 1 156 156 LEU CA C 156 56.040 56.040 54.461 1.579 25768 13508 1 15 . 1 1 156 156 LEU CB C 156 43.040 43.040 43.549 -0.509 25768 13509 1 15 . 1 1 156 156 LEU H H 156 9.190 9.190 8.069 1.121 25768 13510 1 15 . 1 1 157 157 ASN N N 157 114.690 114.690 115.704 -1.014 25768 13511 1 15 . 1 1 157 157 ASN C C 157 173.640 173.640 176.639 -2.999 25768 13512 1 15 . 1 1 157 157 ASN CA C 157 52.650 52.650 56.373 -3.723 25768 13513 1 15 . 1 1 157 157 ASN CB C 157 37.270 37.270 36.453 0.817 25768 13514 1 15 . 1 1 157 157 ASN H H 157 8.060 8.060 8.195 -0.135 25768 13515 1 15 . 1 1 158 158 GLU N N 158 114.530 114.530 120.810 -6.280 25768 13516 1 15 . 1 1 158 158 GLU C C 158 176.090 176.090 177.581 -1.491 25768 13517 1 15 . 1 1 158 158 GLU CA C 158 60.010 60.010 58.492 1.518 25768 13518 1 15 . 1 1 158 158 GLU CB C 158 29.730 29.730 29.741 -0.011 25768 13519 1 15 . 1 1 158 158 GLU H H 158 8.560 8.560 8.451 0.109 25768 13520 1 15 . 1 1 159 159 HIS N N 159 110.480 110.480 118.650 -8.170 25768 13521 1 15 . 1 1 159 159 HIS C C 159 173.130 173.130 173.842 -0.712 25768 13522 1 15 . 1 1 159 159 HIS CA C 159 56.770 56.770 54.361 2.409 25768 13523 1 15 . 1 1 159 159 HIS CB C 159 32.630 32.630 29.426 3.204 25768 13524 1 15 . 1 1 159 159 HIS H H 159 8.190 8.190 7.768 0.422 25768 13525 1 15 . 1 1 160 160 ALA N N 160 122.890 122.890 119.726 3.164 25768 13526 1 15 . 1 1 160 160 ALA C C 160 176.200 176.200 174.989 1.211 25768 13527 1 15 . 1 1 160 160 ALA CA C 160 51.730 51.730 53.096 -1.366 25768 13528 1 15 . 1 1 160 160 ALA CB C 160 21.560 21.560 18.822 2.739 25768 13529 1 15 . 1 1 160 160 ALA H H 160 8.400 8.400 7.393 1.007 25768 13530 1 15 . 1 1 161 161 LEU N N 161 116.540 116.540 117.873 -1.333 25768 13531 1 15 . 1 1 161 161 LEU C C 161 174.930 174.930 176.089 -1.159 25768 13532 1 15 . 1 1 161 161 LEU CA C 161 54.280 54.280 53.886 0.394 25768 13533 1 15 . 1 1 161 161 LEU CB C 161 45.640 45.640 44.188 1.452 25768 13534 1 15 . 1 1 161 161 LEU H H 161 8.590 8.590 7.997 0.593 25768 13535 1 15 . 1 1 162 162 PHE N N 162 121.780 121.780 125.135 -3.355 25768 13536 1 15 . 1 1 162 162 PHE C C 162 171.960 171.960 174.797 -2.837 25768 13537 1 15 . 1 1 162 162 PHE CA C 162 56.420 56.420 56.239 0.181 25768 13538 1 15 . 1 1 162 162 PHE CB C 162 43.340 43.340 41.782 1.558 25768 13539 1 15 . 1 1 162 162 PHE H H 162 9.180 9.180 8.605 0.575 25768 13540 1 15 . 1 1 163 163 ASN N N 163 127.850 127.850 124.867 2.983 25768 13541 1 15 . 1 1 163 163 ASN C C 163 171.320 171.320 173.696 -2.376 25768 13542 1 15 . 1 1 163 163 ASN CA C 163 52.340 52.340 52.210 0.130 25768 13543 1 15 . 1 1 163 163 ASN CB C 163 46.410 46.410 40.329 6.081 25768 13544 1 15 . 1 1 163 163 ASN H H 163 7.700 7.700 8.416 -0.716 25768 13545 1 15 . 1 1 164 164 MET N N 164 119.950 119.950 120.655 -0.705 25768 13546 1 15 . 1 1 164 164 MET C C 164 172.830 172.830 173.850 -1.020 25768 13547 1 15 . 1 1 164 164 MET CA C 164 55.180 55.180 54.753 0.427 25768 13548 1 15 . 1 1 164 164 MET CB C 164 37.770 37.770 36.971 0.799 25768 13549 1 15 . 1 1 164 164 MET H H 164 7.070 7.070 8.093 -1.023 25768 13550 1 15 . 1 1 165 165 ALA N N 165 120.600 120.600 127.419 -6.819 25768 13551 1 15 . 1 1 165 165 ALA C C 165 174.240 174.240 174.171 0.069 25768 13552 1 15 . 1 1 165 165 ALA CA C 165 51.630 51.630 50.781 0.849 25768 13553 1 15 . 1 1 165 165 ALA CB C 165 22.330 22.330 22.590 -0.260 25768 13554 1 15 . 1 1 165 165 ALA H H 165 8.290 8.290 8.683 -0.393 25768 13555 1 15 . 1 1 166 166 VAL N N 166 117.900 117.900 120.330 -2.430 25768 13556 1 15 . 1 1 166 166 VAL C C 166 172.950 172.950 173.515 -0.565 25768 13557 1 15 . 1 1 166 166 VAL CA C 166 59.710 59.710 62.225 -2.515 25768 13558 1 15 . 1 1 166 166 VAL CB C 166 35.290 35.290 35.348 -0.058 25768 13559 1 15 . 1 1 166 166 VAL H H 166 8.720 8.720 7.844 0.876 25768 13560 1 15 . 1 1 171 171 ILE C C 171 175.750 175.750 175.514 0.236 25768 13561 1 15 . 1 1 171 171 ILE CA C 171 61.720 61.720 61.424 0.296 25768 13562 1 15 . 1 1 171 171 ILE CB C 171 39.300 39.300 38.851 0.449 25768 13563 1 15 . 1 1 172 172 ASP N N 172 124.070 124.070 121.575 2.495 25768 13564 1 15 . 1 1 172 172 ASP C C 172 176.590 176.590 175.179 1.411 25768 13565 1 15 . 1 1 172 172 ASP CA C 172 54.460 54.460 54.763 -0.303 25768 13566 1 15 . 1 1 172 172 ASP CB C 172 41.410 41.410 40.748 0.662 25768 13567 1 15 . 1 1 172 172 ASP H H 172 8.460 8.460 8.364 0.096 25768 13568 1 15 . 1 1 173 173 THR N N 173 115.570 115.570 117.989 -2.419 25768 13569 1 15 . 1 1 173 173 THR C C 173 175.030 175.030 174.299 0.731 25768 13570 1 15 . 1 1 173 173 THR CA C 173 62.680 62.680 63.459 -0.779 25768 13571 1 15 . 1 1 173 173 THR CB C 173 69.840 69.840 68.208 1.632 25768 13572 1 15 . 1 1 173 173 THR H H 173 8.080 8.080 8.399 -0.319 25768 13573 1 15 . 1 1 174 174 LYS N N 174 122.680 122.680 121.064 1.616 25768 13574 1 15 . 1 1 174 174 LYS C C 174 176.340 176.340 175.984 0.356 25768 13575 1 15 . 1 1 174 174 LYS CA C 174 56.820 56.820 56.940 -0.120 25768 13576 1 15 . 1 1 174 174 LYS CB C 174 32.790 32.790 31.471 1.319 25768 13577 1 15 . 1 1 174 174 LYS H H 174 8.180 8.180 8.464 -0.284 25768 13578 1 15 . 1 1 175 175 ALA N N 175 124.050 124.050 124.881 -0.831 25768 13579 1 15 . 1 1 175 175 ALA C C 175 177.550 177.550 178.142 -0.592 25768 13580 1 15 . 1 1 175 175 ALA CA C 175 52.840 52.840 53.307 -0.467 25768 13581 1 15 . 1 1 175 175 ALA CB C 175 19.580 19.580 19.095 0.485 25768 13582 1 15 . 1 1 175 175 ALA H H 175 8.050 8.050 8.296 -0.246 25768 13583 1 15 . 1 1 176 176 SER N N 176 114.920 114.920 114.197 0.723 25768 13584 1 15 . 1 1 176 176 SER C C 176 174.240 174.240 174.271 -0.031 25768 13585 1 15 . 1 1 176 176 SER CA C 176 58.390 58.390 57.874 0.516 25768 13586 1 15 . 1 1 176 176 SER CB C 176 64.370 64.370 63.555 0.815 25768 13587 1 15 . 1 1 176 176 SER H H 176 8.070 8.070 7.693 0.377 25768 13588 1 15 . 1 1 177 177 ILE N N 177 121.650 121.650 121.775 -0.125 25768 13589 1 15 . 1 1 177 177 ILE C C 177 174.990 174.990 175.355 -0.365 25768 13590 1 15 . 1 1 177 177 ILE CA C 177 61.570 61.570 61.338 0.232 25768 13591 1 15 . 1 1 177 177 ILE CB C 177 39.100 39.100 36.488 2.612 25768 13592 1 15 . 1 1 177 177 ILE H H 177 7.960 7.960 8.238 -0.278 25768 13593 1 15 . 1 1 178 178 ASN N N 178 127.040 127.040 125.889 1.151 25768 13594 1 15 . 1 1 178 178 ASN C C 178 179.160 179.160 175.081 4.079 25768 13595 1 15 . 1 1 178 178 ASN CA C 178 55.100 55.100 53.846 1.254 25768 13596 1 15 . 1 1 178 178 ASN CB C 178 41.300 41.300 39.701 1.599 25768 13597 1 15 . 1 1 178 178 ASN H H 178 7.850 7.850 8.082 -0.232 25768 13598 1 15 . 1 1 180 180 PRO C C 180 177.520 177.520 176.591 0.929 25768 13599 1 15 . 1 1 180 180 PRO CA C 180 63.980 63.980 62.278 1.702 25768 13600 1 15 . 1 1 180 180 PRO CB C 180 32.190 32.190 32.377 -0.187 25768 13601 1 15 . 1 1 181 181 SER N N 181 115.600 115.600 114.593 1.007 25768 13602 1 15 . 1 1 181 181 SER C C 181 174.710 174.710 174.326 0.384 25768 13603 1 15 . 1 1 181 181 SER CA C 181 58.900 58.900 58.389 0.511 25768 13604 1 15 . 1 1 181 181 SER CB C 181 64.070 64.070 63.456 0.614 25768 13605 1 15 . 1 1 181 181 SER H H 181 8.260 8.260 8.430 -0.170 25768 13606 1 15 . 1 1 182 182 ALA N N 182 125.880 125.880 122.481 3.399 25768 13607 1 15 . 1 1 182 182 ALA C C 182 177.560 177.560 176.047 1.513 25768 13608 1 15 . 1 1 182 182 ALA CA C 182 53.090 53.090 52.369 0.721 25768 13609 1 15 . 1 1 182 182 ALA CB C 182 19.310 19.310 18.243 1.067 25768 13610 1 15 . 1 1 182 182 ALA H H 182 8.130 8.130 7.574 0.556 25768 13611 1 15 . 1 1 183 183 LEU N N 183 119.980 119.980 119.981 -0.001 25768 13612 1 15 . 1 1 183 183 LEU C C 183 177.850 177.850 177.896 -0.046 25768 13613 1 15 . 1 1 183 183 LEU CA C 183 55.650 55.650 56.157 -0.507 25768 13614 1 15 . 1 1 183 183 LEU CB C 183 42.530 42.530 42.194 0.336 25768 13615 1 15 . 1 1 183 183 LEU H H 183 7.940 7.940 8.126 -0.186 25768 13616 1 15 . 1 1 184 184 GLY N N 184 109.250 109.250 112.807 -3.557 25768 13617 1 15 . 1 1 184 184 GLY C C 184 174.250 174.250 173.967 0.283 25768 13618 1 15 . 1 1 184 184 GLY CA C 184 45.830 45.830 44.914 0.916 25768 13619 1 15 . 1 1 184 184 GLY H H 184 8.150 8.150 8.608 -0.458 25768 13620 1 15 . 1 1 185 185 VAL N N 185 118.830 118.830 117.138 1.692 25768 13621 1 15 . 1 1 185 185 VAL C C 185 175.890 175.890 175.689 0.201 25768 13622 1 15 . 1 1 185 185 VAL CA C 185 62.740 62.740 61.797 0.943 25768 13623 1 15 . 1 1 185 185 VAL CB C 185 32.770 32.770 32.143 0.627 25768 13624 1 15 . 1 1 185 185 VAL H H 185 7.760 7.760 7.595 0.165 25768 13625 1 15 . 1 1 186 186 ASN N N 186 121.850 121.850 121.129 0.721 25768 13626 1 15 . 1 1 186 186 ASN C C 186 174.970 174.970 174.852 0.118 25768 13627 1 15 . 1 1 186 186 ASN CA C 186 53.590 53.590 53.692 -0.102 25768 13628 1 15 . 1 1 186 186 ASN CB C 186 39.160 39.160 38.334 0.827 25768 13629 1 15 . 1 1 186 186 ASN H H 186 8.380 8.380 8.631 -0.251 25768 13630 1 15 . 1 1 187 187 LYS N N 187 122.120 122.120 121.628 0.492 25768 13631 1 15 . 1 1 187 187 LYS C C 187 176.490 176.490 176.318 0.172 25768 13632 1 15 . 1 1 187 187 LYS CA C 187 56.750 56.750 56.333 0.417 25768 13633 1 15 . 1 1 187 187 LYS CB C 187 33.250 33.250 33.504 -0.254 25768 13634 1 15 . 1 1 187 187 LYS H H 187 8.140 8.140 8.194 -0.054 25768 13635 1 15 . 1 1 188 188 THR N N 188 115.250 115.250 115.544 -0.294 25768 13636 1 15 . 1 1 188 188 THR C C 188 174.250 174.250 174.573 -0.323 25768 13637 1 15 . 1 1 188 188 THR CA C 188 62.360 62.360 61.920 0.440 25768 13638 1 15 . 1 1 188 188 THR CB C 188 70.280 70.280 69.578 0.702 25768 13639 1 15 . 1 1 188 188 THR H H 188 8.100 8.100 8.282 -0.182 25768 13640 1 15 . 1 1 189 189 LYS N N 189 123.780 123.780 128.703 -4.923 25768 13641 1 15 . 1 1 189 189 LYS C C 189 176.090 176.090 176.046 0.044 25768 13642 1 15 . 1 1 189 189 LYS CA C 189 56.590 56.590 56.679 -0.089 25768 13643 1 15 . 1 1 189 189 LYS CB C 189 33.350 33.350 32.078 1.272 25768 13644 1 15 . 1 1 189 189 LYS H H 189 8.110 8.110 8.698 -0.588 25768 13645 1 15 . 1 1 190 190 VAL N N 190 120.920 120.920 120.112 0.808 25768 13646 1 15 . 1 1 190 190 VAL C C 190 175.590 175.590 176.312 -0.722 25768 13647 1 15 . 1 1 190 190 VAL CA C 190 62.400 62.400 62.778 -0.378 25768 13648 1 15 . 1 1 190 190 VAL CB C 190 32.990 32.990 32.694 0.296 25768 13649 1 15 . 1 1 190 190 VAL H H 190 8.040 8.040 8.251 -0.211 25768 13650 1 15 . 1 1 191 191 ASP N N 191 123.790 123.790 120.314 3.476 25768 13651 1 15 . 1 1 191 191 ASP C C 191 175.750 175.750 176.025 -0.275 25768 13652 1 15 . 1 1 191 191 ASP CA C 191 54.650 54.650 54.598 0.052 25768 13653 1 15 . 1 1 191 191 ASP CB C 191 41.450 41.450 41.074 0.376 25768 13654 1 15 . 1 1 191 191 ASP H H 191 8.240 8.240 8.317 -0.077 25768 13655 1 15 . 1 1 192 192 VAL N N 192 118.850 118.850 116.549 2.301 25768 13656 1 15 . 1 1 192 192 VAL C C 192 175.380 175.380 176.099 -0.719 25768 13657 1 15 . 1 1 192 192 VAL CA C 192 62.110 62.110 63.097 -0.987 25768 13658 1 15 . 1 1 192 192 VAL CB C 192 33.290 33.290 32.638 0.652 25768 13659 1 15 . 1 1 192 192 VAL H H 192 7.860 7.860 7.701 0.159 25768 13660 1 15 . 1 1 193 193 ASP N N 193 124.190 124.190 119.729 4.461 25768 13661 1 15 . 1 1 193 193 ASP C C 193 175.630 175.630 176.018 -0.388 25768 13662 1 15 . 1 1 193 193 ASP CA C 193 54.540 54.540 52.830 1.710 25768 13663 1 15 . 1 1 193 193 ASP CB C 193 41.410 41.410 40.146 1.264 25768 13664 1 15 . 1 1 193 193 ASP H H 193 8.310 8.310 8.265 0.045 25768 13665 1 15 . 1 1 194 194 VAL N N 194 119.580 119.580 120.968 -1.388 25768 13666 1 15 . 1 1 194 194 VAL C C 194 174.950 174.950 175.733 -0.783 25768 13667 1 15 . 1 1 194 194 VAL CA C 194 61.770 61.770 63.012 -1.242 25768 13668 1 15 . 1 1 194 194 VAL CB C 194 33.680 33.680 30.430 3.250 25768 13669 1 15 . 1 1 194 194 VAL H H 194 7.890 7.890 7.741 0.149 25768 13670 1 15 . 1 1 195 195 ASP N N 195 125.660 125.660 129.037 -3.377 25768 13671 1 15 . 1 1 195 195 ASP C C 195 174.290 174.290 174.851 -0.561 25768 13672 1 15 . 1 1 195 195 ASP CA C 195 51.940 51.940 52.484 -0.544 25768 13673 1 15 . 1 1 195 195 ASP CB C 195 40.950 40.950 41.104 -0.154 25768 13674 1 15 . 1 1 195 195 ASP H H 195 8.410 8.410 7.759 0.651 25768 13675 1 15 . 1 1 198 198 VAL C C 198 173.940 173.940 173.932 0.008 25768 13676 1 15 . 1 1 198 198 VAL CA C 198 61.270 61.270 60.196 1.074 25768 13677 1 15 . 1 1 198 198 VAL CB C 198 35.910 35.910 33.895 2.015 25768 13678 1 15 . 1 1 199 199 TYR N N 199 123.780 123.780 121.301 2.479 25768 13679 1 15 . 1 1 199 199 TYR C C 199 174.150 174.150 174.249 -0.099 25768 13680 1 15 . 1 1 199 199 TYR CA C 199 56.220 56.220 57.487 -1.267 25768 13681 1 15 . 1 1 199 199 TYR CB C 199 41.660 41.660 41.959 -0.299 25768 13682 1 15 . 1 1 199 199 TYR H H 199 8.540 8.540 8.242 0.298 25768 13683 1 15 . 1 1 200 200 MET N N 200 123.920 123.920 124.187 -0.267 25768 13684 1 15 . 1 1 200 200 MET C C 200 173.810 173.810 174.488 -0.678 25768 13685 1 15 . 1 1 200 200 MET CA C 200 54.710 54.710 54.587 0.123 25768 13686 1 15 . 1 1 200 200 MET CB C 200 37.110 37.110 35.178 1.932 25768 13687 1 15 . 1 1 200 200 MET H H 200 9.130 9.130 8.265 0.865 25768 13688 1 15 . 1 1 201 201 ILE N N 201 123.670 123.670 118.065 5.605 25768 13689 1 15 . 1 1 201 201 ILE C C 201 174.030 174.030 173.563 0.467 25768 13690 1 15 . 1 1 201 201 ILE CA C 201 59.820 59.820 58.808 1.012 25768 13691 1 15 . 1 1 201 201 ILE CB C 201 41.720 41.720 41.986 -0.266 25768 13692 1 15 . 1 1 201 201 ILE H H 201 8.030 8.030 8.109 -0.079 25768 13693 1 15 . 1 1 202 202 GLY N N 202 112.910 112.910 109.037 3.873 25768 13694 1 15 . 1 1 202 202 GLY C C 202 170.280 170.280 171.662 -1.382 25768 13695 1 15 . 1 1 202 202 GLY CA C 202 46.800 46.800 45.375 1.425 25768 13696 1 15 . 1 1 202 202 GLY H H 202 8.580 8.580 7.508 1.072 25768 13697 1 15 . 1 1 203 203 PHE N N 203 116.240 116.240 115.586 0.654 25768 13698 1 15 . 1 1 203 203 PHE C C 203 173.940 173.940 173.853 0.087 25768 13699 1 15 . 1 1 203 203 PHE CA C 203 55.890 55.890 54.481 1.409 25768 13700 1 15 . 1 1 203 203 PHE CB C 203 45.060 45.060 41.997 3.063 25768 13701 1 15 . 1 1 203 203 PHE H H 203 8.620 8.620 8.407 0.213 25768 13702 1 15 . 1 1 204 204 GLY N N 204 105.610 105.610 105.292 0.318 25768 13703 1 15 . 1 1 204 204 GLY C C 204 171.190 171.190 171.732 -0.542 25768 13704 1 15 . 1 1 204 204 GLY CA C 204 46.720 46.720 45.294 1.426 25768 13705 1 15 . 1 1 204 204 GLY H H 204 8.960 8.960 8.673 0.287 25768 13706 1 15 . 1 1 205 205 TYR N N 205 121.160 121.160 119.213 1.947 25768 13707 1 15 . 1 1 205 205 TYR C C 205 173.030 173.030 173.488 -0.458 25768 13708 1 15 . 1 1 205 205 TYR CA C 205 57.190 57.190 57.776 -0.586 25768 13709 1 15 . 1 1 205 205 TYR CB C 205 44.400 44.400 43.249 1.151 25768 13710 1 15 . 1 1 205 205 TYR H H 205 9.380 9.380 9.394 -0.014 25768 13711 1 15 . 1 1 206 206 LYS N N 206 126.970 126.970 124.581 2.389 25768 13712 1 15 . 1 1 206 206 LYS C C 206 174.210 174.210 175.391 -1.181 25768 13713 1 15 . 1 1 206 206 LYS CA C 206 54.770 54.770 56.660 -1.890 25768 13714 1 15 . 1 1 206 206 LYS CB C 206 34.440 34.440 33.499 0.941 25768 13715 1 15 . 1 1 206 206 LYS H H 206 8.380 8.380 8.731 -0.351 25768 13716 1 15 . 1 1 207 207 PHE N N 207 126.330 126.330 126.725 -0.395 25768 13717 1 15 . 1 1 207 207 PHE C C 207 175.020 175.020 173.963 1.057 25768 13718 1 15 . 1 1 207 207 PHE CA C 207 58.170 58.170 57.841 0.329 25768 13719 1 15 . 1 1 207 207 PHE CB C 207 40.920 40.920 41.075 -0.155 25768 13720 1 15 . 1 1 207 207 PHE H H 207 9.290 9.290 8.445 0.845 25768 13721 1 15 . 1 1 208 208 LEU N N 208 122.740 122.740 123.438 -0.698 25768 13722 1 15 . 1 1 208 208 LEU C C 208 176.510 176.510 175.557 0.953 25768 13723 1 15 . 1 1 208 208 LEU CA C 208 54.910 54.910 55.289 -0.379 25768 13724 1 15 . 1 1 208 208 LEU CB C 208 43.830 43.830 44.501 -0.671 25768 13725 1 15 . 1 1 208 208 LEU H H 208 8.310 8.310 8.027 0.283 25768 13726 1 16 . 1 1 2 2 HIS C C 2 175.310 175.310 175.077 0.233 25768 13727 1 16 . 1 1 3 3 LYS N N 3 122.080 122.080 123.136 -1.056 25768 13728 1 16 . 1 1 3 3 LYS C C 3 173.490 173.490 174.722 -1.232 25768 13729 1 16 . 1 1 3 3 LYS CA C 3 55.050 55.050 55.371 -0.321 25768 13730 1 16 . 1 1 3 3 LYS CB C 3 35.380 35.380 35.918 -0.538 25768 13731 1 16 . 1 1 3 3 LYS H H 3 8.620 8.620 8.498 0.122 25768 13732 1 16 . 1 1 4 4 ALA N N 4 120.860 120.860 123.845 -2.985 25768 13733 1 16 . 1 1 4 4 ALA C C 4 178.190 178.190 177.981 0.209 25768 13734 1 16 . 1 1 4 4 ALA CA C 4 53.480 53.480 52.178 1.302 25768 13735 1 16 . 1 1 4 4 ALA CB C 4 18.140 18.140 17.864 0.276 25768 13736 1 16 . 1 1 4 4 ALA H H 4 8.580 8.580 8.284 0.296 25768 13737 1 16 . 1 1 5 5 GLY N N 5 112.890 112.890 113.266 -0.376 25768 13738 1 16 . 1 1 5 5 GLY C C 5 173.830 173.830 173.907 -0.077 25768 13739 1 16 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.684 0.196 25768 13740 1 16 . 1 1 5 5 GLY H H 5 9.210 9.210 8.551 0.659 25768 13741 1 16 . 1 1 6 6 ASP N N 6 121.590 121.590 122.091 -0.501 25768 13742 1 16 . 1 1 6 6 ASP C C 6 174.380 174.380 175.380 -1.000 25768 13743 1 16 . 1 1 6 6 ASP CA C 6 55.790 55.790 55.087 0.703 25768 13744 1 16 . 1 1 6 6 ASP CB C 6 41.760 41.760 41.773 -0.013 25768 13745 1 16 . 1 1 6 6 ASP H H 6 7.620 7.620 7.708 -0.088 25768 13746 1 16 . 1 1 7 7 PHE N N 7 120.860 120.860 122.114 -1.254 25768 13747 1 16 . 1 1 7 7 PHE C C 7 174.050 174.050 175.493 -1.443 25768 13748 1 16 . 1 1 7 7 PHE CA C 7 56.110 56.110 57.850 -1.740 25768 13749 1 16 . 1 1 7 7 PHE CB C 7 42.550 42.550 40.657 1.893 25768 13750 1 16 . 1 1 7 7 PHE H H 7 8.250 8.250 8.813 -0.563 25768 13751 1 16 . 1 1 8 8 ILE N N 8 127.950 127.950 120.929 7.021 25768 13752 1 16 . 1 1 8 8 ILE C C 8 174.000 174.000 174.253 -0.253 25768 13753 1 16 . 1 1 8 8 ILE CA C 8 61.160 61.160 60.630 0.530 25768 13754 1 16 . 1 1 8 8 ILE CB C 8 42.660 42.660 42.225 0.435 25768 13755 1 16 . 1 1 8 8 ILE H H 8 9.230 9.230 8.168 1.062 25768 13756 1 16 . 1 1 9 9 ILE N N 9 125.380 125.380 126.104 -0.724 25768 13757 1 16 . 1 1 9 9 ILE C C 9 173.630 173.630 174.360 -0.730 25768 13758 1 16 . 1 1 9 9 ILE CA C 9 59.600 59.600 60.180 -0.580 25768 13759 1 16 . 1 1 9 9 ILE CB C 9 41.180 41.180 39.717 1.463 25768 13760 1 16 . 1 1 9 9 ILE H H 9 8.580 8.580 8.584 -0.004 25768 13761 1 16 . 1 1 10 10 ARG N N 10 124.950 124.950 125.861 -0.911 25768 13762 1 16 . 1 1 10 10 ARG C C 10 175.030 175.030 175.107 -0.077 25768 13763 1 16 . 1 1 10 10 ARG CA C 10 53.920 53.920 53.930 -0.010 25768 13764 1 16 . 1 1 10 10 ARG CB C 10 31.880 31.880 34.012 -2.132 25768 13765 1 16 . 1 1 10 10 ARG H H 10 9.230 9.230 8.915 0.315 25768 13766 1 16 . 1 1 11 11 GLY N N 11 105.650 105.650 109.299 -3.649 25768 13767 1 16 . 1 1 11 11 GLY C C 11 172.090 172.090 172.804 -0.714 25768 13768 1 16 . 1 1 11 11 GLY CA C 11 44.460 44.460 43.615 0.845 25768 13769 1 16 . 1 1 11 11 GLY H H 11 8.780 8.780 8.745 0.035 25768 13770 1 16 . 1 1 12 12 GLY N N 12 107.800 107.800 107.712 0.088 25768 13771 1 16 . 1 1 12 12 GLY C C 12 171.460 171.460 172.200 -0.740 25768 13772 1 16 . 1 1 12 12 GLY CA C 12 46.630 46.630 43.728 2.901 25768 13773 1 16 . 1 1 12 12 GLY H H 12 8.510 8.510 8.665 -0.155 25768 13774 1 16 . 1 1 13 13 PHE N N 13 119.900 119.900 124.519 -4.619 25768 13775 1 16 . 1 1 13 13 PHE C C 13 174.190 174.190 173.244 0.946 25768 13776 1 16 . 1 1 13 13 PHE CA C 13 56.340 56.340 57.386 -1.046 25768 13777 1 16 . 1 1 13 13 PHE CB C 13 41.090 41.090 43.123 -2.033 25768 13778 1 16 . 1 1 13 13 PHE H H 13 8.610 8.610 8.241 0.369 25768 13779 1 16 . 1 1 14 14 ALA N N 14 128.030 128.030 129.859 -1.829 25768 13780 1 16 . 1 1 14 14 ALA C C 14 176.560 176.560 176.769 -0.209 25768 13781 1 16 . 1 1 14 14 ALA CA C 14 49.940 49.940 50.491 -0.551 25768 13782 1 16 . 1 1 14 14 ALA CB C 14 20.360 20.360 21.887 -1.526 25768 13783 1 16 . 1 1 14 14 ALA H H 14 9.220 9.220 8.747 0.473 25768 13784 1 16 . 1 1 15 15 THR N N 15 118.620 118.620 115.138 3.482 25768 13785 1 16 . 1 1 15 15 THR CA C 15 61.440 61.440 61.092 0.348 25768 13786 1 16 . 1 1 15 15 THR CB C 15 71.370 71.370 71.323 0.047 25768 13787 1 16 . 1 1 15 15 THR H H 15 9.220 9.220 8.220 1.000 25768 13788 1 16 . 1 1 18 18 PRO C C 18 176.690 176.690 176.744 -0.054 25768 13789 1 16 . 1 1 18 18 PRO CA C 18 63.610 63.610 63.991 -0.381 25768 13790 1 16 . 1 1 18 18 PRO CB C 18 32.440 32.440 32.187 0.253 25768 13791 1 16 . 1 1 19 19 ASP N N 19 120.320 120.320 118.515 1.805 25768 13792 1 16 . 1 1 19 19 ASP C C 19 175.950 175.950 175.687 0.263 25768 13793 1 16 . 1 1 19 19 ASP CA C 19 54.710 54.710 53.827 0.883 25768 13794 1 16 . 1 1 19 19 ASP CB C 19 41.450 41.450 42.236 -0.786 25768 13795 1 16 . 1 1 19 19 ASP H H 19 8.330 8.330 7.696 0.634 25768 13796 1 16 . 1 1 20 20 ASP N N 20 121.990 121.990 119.781 2.209 25768 13797 1 16 . 1 1 20 20 ASP C C 20 176.760 176.760 176.251 0.509 25768 13798 1 16 . 1 1 20 20 ASP CA C 20 54.470 54.470 54.664 -0.194 25768 13799 1 16 . 1 1 20 20 ASP CB C 20 41.310 41.310 41.015 0.295 25768 13800 1 16 . 1 1 20 20 ASP H H 20 8.240 8.240 8.514 -0.274 25768 13801 1 16 . 1 1 21 21 SER N N 21 117.050 117.050 112.809 4.241 25768 13802 1 16 . 1 1 21 21 SER C C 21 175.170 175.170 173.230 1.940 25768 13803 1 16 . 1 1 21 21 SER CA C 21 59.490 59.490 58.694 0.796 25768 13804 1 16 . 1 1 21 21 SER CB C 21 64.080 64.080 63.596 0.485 25768 13805 1 16 . 1 1 21 21 SER H H 21 8.360 8.360 8.133 0.227 25768 13806 1 16 . 1 1 22 22 SER N N 22 117.820 117.820 116.206 1.614 25768 13807 1 16 . 1 1 22 22 SER C C 22 174.940 174.940 172.757 2.183 25768 13808 1 16 . 1 1 22 22 SER CA C 22 59.160 59.160 57.912 1.248 25768 13809 1 16 . 1 1 22 22 SER CB C 22 64.110 64.110 64.479 -0.369 25768 13810 1 16 . 1 1 22 22 SER H H 22 8.310 8.310 8.115 0.195 25768 13811 1 16 . 1 1 23 23 SER N N 23 117.660 117.660 118.866 -1.206 25768 13812 1 16 . 1 1 23 23 SER C C 23 174.340 174.340 174.002 0.338 25768 13813 1 16 . 1 1 23 23 SER CA C 23 59.050 59.050 58.209 0.841 25768 13814 1 16 . 1 1 23 23 SER CB C 23 64.210 64.210 63.081 1.129 25768 13815 1 16 . 1 1 23 23 SER H H 23 8.120 8.120 8.630 -0.510 25768 13816 1 16 . 1 1 24 24 ASP N N 24 122.590 122.590 125.035 -2.445 25768 13817 1 16 . 1 1 24 24 ASP C C 24 176.250 176.250 175.945 0.305 25768 13818 1 16 . 1 1 24 24 ASP CA C 24 54.910 54.910 54.553 0.357 25768 13819 1 16 . 1 1 24 24 ASP CB C 24 41.270 41.270 41.508 -0.238 25768 13820 1 16 . 1 1 24 24 ASP H H 24 8.230 8.230 8.669 -0.439 25768 13821 1 16 . 1 1 25 25 ILE N N 25 120.650 120.650 121.667 -1.017 25768 13822 1 16 . 1 1 25 25 ILE C C 25 176.190 176.190 175.619 0.571 25768 13823 1 16 . 1 1 25 25 ILE CA C 25 61.880 61.880 60.879 1.001 25768 13824 1 16 . 1 1 25 25 ILE CB C 25 38.730 38.730 38.976 -0.246 25768 13825 1 16 . 1 1 25 25 ILE H H 25 7.860 7.860 7.958 -0.098 25768 13826 1 16 . 1 1 26 26 LYS N N 26 124.420 124.420 128.337 -3.917 25768 13827 1 16 . 1 1 26 26 LYS C C 26 176.640 176.640 175.829 0.811 25768 13828 1 16 . 1 1 26 26 LYS CA C 26 56.520 56.520 56.417 0.103 25768 13829 1 16 . 1 1 26 26 LYS CB C 26 32.890 32.890 32.329 0.561 25768 13830 1 16 . 1 1 26 26 LYS H H 26 8.140 8.140 8.553 -0.413 25768 13831 1 16 . 1 1 27 27 LEU N N 27 123.120 123.120 123.706 -0.586 25768 13832 1 16 . 1 1 27 27 LEU C C 27 177.110 177.110 176.322 0.788 25768 13833 1 16 . 1 1 27 27 LEU CA C 27 55.590 55.590 55.062 0.528 25768 13834 1 16 . 1 1 27 27 LEU CB C 27 42.500 42.500 42.195 0.305 25768 13835 1 16 . 1 1 27 27 LEU H H 27 8.080 8.080 8.832 -0.752 25768 13836 1 16 . 1 1 28 28 ASP N N 28 120.850 120.850 119.438 1.412 25768 13837 1 16 . 1 1 28 28 ASP C C 28 176.960 176.960 175.848 1.112 25768 13838 1 16 . 1 1 28 28 ASP CA C 28 54.800 54.800 54.775 0.025 25768 13839 1 16 . 1 1 28 28 ASP CB C 28 41.380 41.380 41.001 0.379 25768 13840 1 16 . 1 1 28 28 ASP H H 28 8.180 8.180 8.013 0.167 25768 13841 1 16 . 1 1 29 29 GLY N N 29 109.800 109.800 108.744 1.056 25768 13842 1 16 . 1 1 29 29 GLY C C 29 174.370 174.370 174.346 0.024 25768 13843 1 16 . 1 1 29 29 GLY CA C 29 46.150 46.150 44.309 1.841 25768 13844 1 16 . 1 1 29 29 GLY H H 29 8.230 8.230 7.995 0.235 25768 13845 1 16 . 1 1 30 30 ALA N N 30 123.880 123.880 124.508 -0.628 25768 13846 1 16 . 1 1 30 30 ALA C C 30 178.040 178.040 177.892 0.148 25768 13847 1 16 . 1 1 30 30 ALA CA C 30 53.140 53.140 53.698 -0.558 25768 13848 1 16 . 1 1 30 30 ALA CB C 30 19.350 19.350 19.234 0.116 25768 13849 1 16 . 1 1 30 30 ALA H H 30 8.040 8.040 8.271 -0.231 25768 13850 1 16 . 1 1 31 31 LYS N N 31 119.800 119.800 115.659 4.141 25768 13851 1 16 . 1 1 31 31 LYS C C 31 176.770 176.770 177.537 -0.767 25768 13852 1 16 . 1 1 31 31 LYS CA C 31 56.870 56.870 56.219 0.651 25768 13853 1 16 . 1 1 31 31 LYS CB C 31 32.980 32.980 33.449 -0.469 25768 13854 1 16 . 1 1 31 31 LYS H H 31 8.060 8.060 8.048 0.012 25768 13855 1 16 . 1 1 32 32 GLN N N 32 120.930 120.930 117.563 3.367 25768 13856 1 16 . 1 1 32 32 GLN C C 32 176.000 176.000 176.347 -0.347 25768 13857 1 16 . 1 1 32 32 GLN CA C 32 56.280 56.280 58.140 -1.860 25768 13858 1 16 . 1 1 32 32 GLN CB C 32 29.580 29.580 27.825 1.755 25768 13859 1 16 . 1 1 32 32 GLN H H 32 8.170 8.170 8.404 -0.234 25768 13860 1 16 . 1 1 33 33 ARG N N 33 122.370 122.370 118.996 3.374 25768 13861 1 16 . 1 1 33 33 ARG C C 33 176.820 176.820 175.481 1.339 25768 13862 1 16 . 1 1 33 33 ARG CA C 33 56.680 56.680 55.459 1.221 25768 13863 1 16 . 1 1 33 33 ARG CB C 33 31.040 31.040 32.714 -1.674 25768 13864 1 16 . 1 1 33 33 ARG H H 33 8.270 8.270 8.232 0.038 25768 13865 1 16 . 1 1 34 34 GLY N N 34 110.210 110.210 109.993 0.217 25768 13866 1 16 . 1 1 34 34 GLY C C 34 174.280 174.280 173.969 0.311 25768 13867 1 16 . 1 1 34 34 GLY CA C 34 45.770 45.770 44.936 0.834 25768 13868 1 16 . 1 1 34 34 GLY H H 34 8.360 8.360 8.487 -0.127 25768 13869 1 16 . 1 1 35 35 THR N N 35 114.100 114.100 118.502 -4.402 25768 13870 1 16 . 1 1 35 35 THR C C 35 174.550 174.550 174.891 -0.341 25768 13871 1 16 . 1 1 35 35 THR CA C 35 62.140 62.140 62.508 -0.367 25768 13872 1 16 . 1 1 35 35 THR CB C 35 70.330 70.330 68.986 1.344 25768 13873 1 16 . 1 1 35 35 THR H H 35 7.970 7.970 7.982 -0.012 25768 13874 1 16 . 1 1 36 36 LYS N N 36 123.850 123.850 126.946 -3.096 25768 13875 1 16 . 1 1 36 36 LYS C C 36 176.040 176.040 176.513 -0.473 25768 13876 1 16 . 1 1 36 36 LYS CA C 36 56.600 56.600 56.133 0.467 25768 13877 1 16 . 1 1 36 36 LYS CB C 36 33.280 33.280 32.631 0.649 25768 13878 1 16 . 1 1 36 36 LYS H H 36 8.230 8.230 8.725 -0.495 25768 13879 1 16 . 1 1 37 37 ALA N N 37 125.650 125.650 123.245 2.405 25768 13880 1 16 . 1 1 37 37 ALA C C 37 177.570 177.570 177.099 0.471 25768 13881 1 16 . 1 1 37 37 ALA CA C 37 52.860 52.860 52.811 0.049 25768 13882 1 16 . 1 1 37 37 ALA CB C 37 19.610 19.610 17.476 2.134 25768 13883 1 16 . 1 1 37 37 ALA H H 37 8.290 8.290 8.348 -0.058 25768 13884 1 16 . 1 1 38 38 THR N N 38 113.350 113.350 110.381 2.969 25768 13885 1 16 . 1 1 38 38 THR C C 38 174.540 174.540 173.672 0.868 25768 13886 1 16 . 1 1 38 38 THR CA C 38 62.010 62.010 62.717 -0.707 25768 13887 1 16 . 1 1 38 38 THR CB C 38 70.350 70.350 67.936 2.414 25768 13888 1 16 . 1 1 38 38 THR H H 38 7.970 7.970 7.932 0.038 25768 13889 1 16 . 1 1 39 39 VAL N N 39 120.790 120.790 123.921 -3.131 25768 13890 1 16 . 1 1 39 39 VAL C C 39 175.620 175.620 175.682 -0.062 25768 13891 1 16 . 1 1 39 39 VAL CA C 39 62.470 62.470 62.457 0.013 25768 13892 1 16 . 1 1 39 39 VAL CB C 39 32.940 32.940 33.228 -0.289 25768 13893 1 16 . 1 1 39 39 VAL H H 39 8.020 8.020 8.536 -0.516 25768 13894 1 16 . 1 1 40 40 ASP N N 40 123.690 123.690 119.555 4.135 25768 13895 1 16 . 1 1 40 40 ASP C C 40 176.190 176.190 175.718 0.472 25768 13896 1 16 . 1 1 40 40 ASP CA C 40 54.780 54.780 55.363 -0.583 25768 13897 1 16 . 1 1 40 40 ASP CB C 40 41.590 41.590 40.866 0.724 25768 13898 1 16 . 1 1 40 40 ASP H H 40 8.310 8.310 8.345 -0.035 25768 13899 1 16 . 1 1 41 41 SER N N 41 115.470 115.470 114.674 0.796 25768 13900 1 16 . 1 1 41 41 SER C C 41 174.170 174.170 174.958 -0.788 25768 13901 1 16 . 1 1 41 41 SER CA C 41 59.000 59.000 59.947 -0.947 25768 13902 1 16 . 1 1 41 41 SER CB C 41 64.420 64.420 63.644 0.776 25768 13903 1 16 . 1 1 41 41 SER H H 41 8.130 8.130 8.579 -0.449 25768 13904 1 16 . 1 1 42 42 ASP N N 42 122.430 122.430 123.773 -1.343 25768 13905 1 16 . 1 1 42 42 ASP C C 42 175.740 175.740 175.397 0.343 25768 13906 1 16 . 1 1 42 42 ASP CA C 42 54.780 54.780 53.667 1.113 25768 13907 1 16 . 1 1 42 42 ASP CB C 42 41.620 41.620 39.708 1.913 25768 13908 1 16 . 1 1 42 42 ASP H H 42 8.410 8.410 8.423 -0.013 25768 13909 1 16 . 1 1 43 43 THR N N 43 117.580 117.580 112.863 4.717 25768 13910 1 16 . 1 1 43 43 THR C C 43 173.630 173.630 174.289 -0.659 25768 13911 1 16 . 1 1 43 43 THR CA C 43 63.120 63.120 61.711 1.409 25768 13912 1 16 . 1 1 43 43 THR CB C 43 70.650 70.650 69.975 0.675 25768 13913 1 16 . 1 1 43 43 THR H H 43 8.010 8.010 7.450 0.560 25768 13914 1 16 . 1 1 44 44 GLN N N 44 125.420 125.420 120.701 4.719 25768 13915 1 16 . 1 1 44 44 GLN C C 44 174.080 174.080 174.587 -0.507 25768 13916 1 16 . 1 1 44 44 GLN CA C 44 55.110 55.110 54.977 0.133 25768 13917 1 16 . 1 1 44 44 GLN CB C 44 31.570 31.570 30.331 1.239 25768 13918 1 16 . 1 1 44 44 GLN H H 44 9.260 9.260 8.387 0.873 25768 13919 1 16 . 1 1 45 45 LEU N N 45 124.190 124.190 126.549 -2.359 25768 13920 1 16 . 1 1 45 45 LEU C C 45 175.970 175.970 176.564 -0.594 25768 13921 1 16 . 1 1 45 45 LEU CA C 45 54.690 54.690 54.780 -0.090 25768 13922 1 16 . 1 1 45 45 LEU CB C 45 42.270 42.270 42.677 -0.407 25768 13923 1 16 . 1 1 45 45 LEU H H 45 8.550 8.550 8.481 0.069 25768 13924 1 16 . 1 1 46 46 GLY N N 46 113.310 113.310 112.189 1.121 25768 13925 1 16 . 1 1 46 46 GLY C C 46 171.180 171.180 172.234 -1.054 25768 13926 1 16 . 1 1 46 46 GLY CA C 46 44.400 44.400 43.991 0.409 25768 13927 1 16 . 1 1 46 46 GLY H H 46 8.810 8.810 7.977 0.833 25768 13928 1 16 . 1 1 47 47 LEU N N 47 123.890 123.890 125.232 -1.342 25768 13929 1 16 . 1 1 47 47 LEU C C 47 175.400 175.400 175.530 -0.130 25768 13930 1 16 . 1 1 47 47 LEU CA C 47 53.750 53.750 54.449 -0.699 25768 13931 1 16 . 1 1 47 47 LEU CB C 47 46.800 46.800 44.825 1.974 25768 13932 1 16 . 1 1 47 47 LEU H H 47 8.590 8.590 8.892 -0.302 25768 13933 1 16 . 1 1 48 48 THR N N 48 111.210 111.210 117.364 -6.154 25768 13934 1 16 . 1 1 48 48 THR C C 48 172.520 172.520 173.146 -0.626 25768 13935 1 16 . 1 1 48 48 THR CA C 48 58.950 58.950 60.917 -1.967 25768 13936 1 16 . 1 1 48 48 THR CB C 48 72.360 72.360 71.259 1.101 25768 13937 1 16 . 1 1 48 48 THR H H 48 8.620 8.620 8.383 0.237 25768 13938 1 16 . 1 1 49 49 PHE N N 49 118.810 118.810 125.982 -7.172 25768 13939 1 16 . 1 1 49 49 PHE C C 49 174.700 174.700 175.060 -0.360 25768 13940 1 16 . 1 1 49 49 PHE CA C 49 55.080 55.080 55.972 -0.892 25768 13941 1 16 . 1 1 49 49 PHE CB C 49 42.360 42.360 40.589 1.771 25768 13942 1 16 . 1 1 49 49 PHE H H 49 8.410 8.410 8.549 -0.139 25768 13943 1 16 . 1 1 50 50 THR N N 50 121.230 121.230 116.346 4.884 25768 13944 1 16 . 1 1 50 50 THR C C 50 173.250 173.250 173.368 -0.118 25768 13945 1 16 . 1 1 50 50 THR CA C 50 62.740 62.740 60.894 1.847 25768 13946 1 16 . 1 1 50 50 THR CB C 50 73.740 73.740 69.789 3.951 25768 13947 1 16 . 1 1 50 50 THR H H 50 9.330 9.330 8.343 0.987 25768 13948 1 16 . 1 1 51 51 TYR N N 51 126.010 126.010 124.981 1.029 25768 13949 1 16 . 1 1 51 51 TYR C C 51 174.850 174.850 175.777 -0.927 25768 13950 1 16 . 1 1 51 51 TYR CA C 51 56.240 56.240 56.066 0.174 25768 13951 1 16 . 1 1 51 51 TYR CB C 51 41.630 41.630 38.899 2.731 25768 13952 1 16 . 1 1 51 51 TYR H H 51 9.150 9.150 9.127 0.023 25768 13953 1 16 . 1 1 52 52 MET N N 52 127.390 127.390 122.894 4.496 25768 13954 1 16 . 1 1 52 52 MET C C 52 174.490 174.490 175.051 -0.561 25768 13955 1 16 . 1 1 52 52 MET CA C 52 52.450 52.450 57.254 -4.804 25768 13956 1 16 . 1 1 52 52 MET CB C 52 28.590 28.590 33.426 -4.836 25768 13957 1 16 . 1 1 52 52 MET H H 52 7.950 7.950 8.310 -0.360 25768 13958 1 16 . 1 1 53 53 PHE N N 53 123.830 123.830 125.193 -1.363 25768 13959 1 16 . 1 1 53 53 PHE C C 53 173.720 173.720 173.982 -0.262 25768 13960 1 16 . 1 1 53 53 PHE CA C 53 57.110 57.110 56.938 0.172 25768 13961 1 16 . 1 1 53 53 PHE CB C 53 39.420 39.420 41.121 -1.702 25768 13962 1 16 . 1 1 53 53 PHE H H 53 7.720 7.720 8.402 -0.682 25768 13963 1 16 . 1 1 54 54 ALA N N 54 125.650 125.650 128.151 -2.501 25768 13964 1 16 . 1 1 54 54 ALA C C 54 175.020 175.020 175.890 -0.870 25768 13965 1 16 . 1 1 54 54 ALA CA C 54 50.740 50.740 53.101 -2.361 25768 13966 1 16 . 1 1 54 54 ALA CB C 54 22.700 22.700 19.136 3.564 25768 13967 1 16 . 1 1 54 54 ALA H H 54 8.360 8.360 8.353 0.007 25768 13968 1 16 . 1 1 55 55 ASP N N 55 118.790 118.790 118.982 -0.192 25768 13969 1 16 . 1 1 55 55 ASP C C 55 174.780 174.780 175.579 -0.799 25768 13970 1 16 . 1 1 55 55 ASP CA C 55 58.590 58.590 53.874 4.716 25768 13971 1 16 . 1 1 55 55 ASP CB C 55 40.430 40.430 39.374 1.056 25768 13972 1 16 . 1 1 55 55 ASP H H 55 8.590 8.590 8.616 -0.026 25768 13973 1 16 . 1 1 56 56 LYS N N 56 106.200 106.200 116.723 -10.523 25768 13974 1 16 . 1 1 56 56 LYS C C 56 174.940 174.940 174.796 0.144 25768 13975 1 16 . 1 1 56 56 LYS CA C 56 55.260 55.260 57.112 -1.852 25768 13976 1 16 . 1 1 56 56 LYS CB C 56 34.510 34.510 34.901 -0.391 25768 13977 1 16 . 1 1 56 56 LYS H H 56 7.260 7.260 7.427 -0.167 25768 13978 1 16 . 1 1 57 57 TRP N N 57 115.680 115.680 120.932 -5.252 25768 13979 1 16 . 1 1 57 57 TRP C C 57 173.940 173.940 175.539 -1.599 25768 13980 1 16 . 1 1 57 57 TRP CA C 57 55.410 55.410 56.874 -1.464 25768 13981 1 16 . 1 1 57 57 TRP CB C 57 34.470 34.470 31.435 3.035 25768 13982 1 16 . 1 1 57 57 TRP H H 57 6.570 6.570 8.278 -1.708 25768 13983 1 16 . 1 1 58 58 GLY N N 58 107.610 107.610 108.133 -0.523 25768 13984 1 16 . 1 1 58 58 GLY C C 58 172.730 172.730 171.913 0.817 25768 13985 1 16 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.661 -0.611 25768 13986 1 16 . 1 1 58 58 GLY H H 58 9.260 9.260 8.226 1.034 25768 13987 1 16 . 1 1 59 59 VAL N N 59 118.130 118.130 119.468 -1.338 25768 13988 1 16 . 1 1 59 59 VAL C C 59 173.000 173.000 173.896 -0.896 25768 13989 1 16 . 1 1 59 59 VAL CA C 59 59.950 59.950 59.332 0.618 25768 13990 1 16 . 1 1 59 59 VAL CB C 59 35.170 35.170 34.153 1.017 25768 13991 1 16 . 1 1 59 59 VAL H H 59 9.030 9.030 7.905 1.125 25768 13992 1 16 . 1 1 60 60 GLU N N 60 127.900 127.900 122.508 5.392 25768 13993 1 16 . 1 1 60 60 GLU C C 60 174.470 174.470 175.191 -0.721 25768 13994 1 16 . 1 1 60 60 GLU CA C 60 52.940 52.940 54.065 -1.125 25768 13995 1 16 . 1 1 60 60 GLU CB C 60 35.100 35.100 33.657 1.443 25768 13996 1 16 . 1 1 60 60 GLU H H 60 9.440 9.440 9.031 0.409 25768 13997 1 16 . 1 1 61 61 LEU N N 61 127.410 127.410 120.583 6.827 25768 13998 1 16 . 1 1 61 61 LEU C C 61 174.950 174.950 175.339 -0.389 25768 13999 1 16 . 1 1 61 61 LEU CA C 61 53.390 53.390 54.298 -0.908 25768 14000 1 16 . 1 1 61 61 LEU CB C 61 45.980 45.980 43.748 2.232 25768 14001 1 16 . 1 1 61 61 LEU H H 61 8.740 8.740 8.132 0.608 25768 14002 1 16 . 1 1 62 62 VAL N N 62 125.750 125.750 116.800 8.950 25768 14003 1 16 . 1 1 62 62 VAL C C 62 173.960 173.960 174.710 -0.750 25768 14004 1 16 . 1 1 62 62 VAL CA C 62 61.350 61.350 58.982 2.368 25768 14005 1 16 . 1 1 62 62 VAL CB C 62 34.740 34.740 35.182 -0.442 25768 14006 1 16 . 1 1 62 62 VAL H H 62 8.790 8.790 7.827 0.963 25768 14007 1 16 . 1 1 63 63 ALA N N 63 127.230 127.230 122.359 4.871 25768 14008 1 16 . 1 1 63 63 ALA C C 63 173.930 173.930 174.817 -0.887 25768 14009 1 16 . 1 1 63 63 ALA CA C 63 51.140 51.140 52.340 -1.200 25768 14010 1 16 . 1 1 63 63 ALA CB C 63 22.500 22.500 20.902 1.598 25768 14011 1 16 . 1 1 63 63 ALA H H 63 8.740 8.740 8.009 0.731 25768 14012 1 16 . 1 1 64 64 ALA N N 64 120.410 120.410 126.008 -5.598 25768 14013 1 16 . 1 1 64 64 ALA C C 64 176.770 176.770 177.055 -0.285 25768 14014 1 16 . 1 1 64 64 ALA CA C 64 51.420 51.420 50.421 0.999 25768 14015 1 16 . 1 1 64 64 ALA CB C 64 22.590 22.590 20.780 1.810 25768 14016 1 16 . 1 1 64 64 ALA H H 64 8.290 8.290 8.450 -0.160 25768 14017 1 16 . 1 1 65 65 THR N N 65 116.130 116.130 117.701 -1.571 25768 14018 1 16 . 1 1 65 65 THR C C 65 171.220 171.220 172.799 -1.579 25768 14019 1 16 . 1 1 65 65 THR CA C 65 58.860 58.860 60.169 -1.309 25768 14020 1 16 . 1 1 65 65 THR CB C 65 72.020 72.020 68.202 3.818 25768 14021 1 16 . 1 1 65 65 THR H H 65 8.760 8.760 8.053 0.707 25768 14022 1 16 . 1 1 66 66 PRO C C 66 176.720 176.720 176.145 0.575 25768 14023 1 16 . 1 1 66 66 PRO CA C 66 63.610 63.610 62.994 0.616 25768 14024 1 16 . 1 1 66 66 PRO CB C 66 32.550 32.550 32.230 0.320 25768 14025 1 16 . 1 1 67 67 PHE N N 67 120.360 120.360 113.261 7.099 25768 14026 1 16 . 1 1 67 67 PHE C C 67 175.480 175.480 174.157 1.323 25768 14027 1 16 . 1 1 67 67 PHE CA C 67 58.840 58.840 57.103 1.737 25768 14028 1 16 . 1 1 67 67 PHE CB C 67 40.170 40.170 38.915 1.255 25768 14029 1 16 . 1 1 67 67 PHE H H 67 8.590 8.590 7.547 1.043 25768 14030 1 16 . 1 1 68 68 ASN N N 68 119.030 119.030 119.597 -0.567 25768 14031 1 16 . 1 1 68 68 ASN C C 68 174.740 174.740 175.495 -0.755 25768 14032 1 16 . 1 1 68 68 ASN CA C 68 53.430 53.430 52.716 0.714 25768 14033 1 16 . 1 1 68 68 ASN CB C 68 39.420 39.420 39.397 0.023 25768 14034 1 16 . 1 1 68 68 ASN H H 68 8.340 8.340 7.887 0.453 25768 14035 1 16 . 1 1 69 69 HIS N N 69 119.590 119.590 119.311 0.279 25768 14036 1 16 . 1 1 69 69 HIS C C 69 174.370 174.370 176.214 -1.844 25768 14037 1 16 . 1 1 69 69 HIS CA C 69 55.950 55.950 58.069 -2.119 25768 14038 1 16 . 1 1 69 69 HIS CB C 69 29.960 29.960 30.268 -0.308 25768 14039 1 16 . 1 1 69 69 HIS H H 69 8.350 8.350 8.916 -0.566 25768 14040 1 16 . 1 1 70 70 GLN N N 70 121.980 121.980 116.481 5.499 25768 14041 1 16 . 1 1 70 70 GLN C C 70 175.740 175.740 175.858 -0.118 25768 14042 1 16 . 1 1 70 70 GLN CA C 70 56.340 56.340 58.201 -1.861 25768 14043 1 16 . 1 1 70 70 GLN CB C 70 29.660 29.660 28.226 1.434 25768 14044 1 16 . 1 1 70 70 GLN H H 70 8.350 8.350 8.567 -0.217 25768 14045 1 16 . 1 1 71 71 VAL N N 71 120.530 120.530 120.665 -0.135 25768 14046 1 16 . 1 1 71 71 VAL C C 71 175.500 175.500 173.920 1.580 25768 14047 1 16 . 1 1 71 71 VAL CA C 71 62.540 62.540 62.267 0.272 25768 14048 1 16 . 1 1 71 71 VAL CB C 71 33.090 33.090 32.079 1.011 25768 14049 1 16 . 1 1 71 71 VAL H H 71 8.020 8.020 8.117 -0.097 25768 14050 1 16 . 1 1 72 72 ASP N N 72 123.910 123.910 123.605 0.305 25768 14051 1 16 . 1 1 72 72 ASP C C 72 176.300 176.300 175.636 0.664 25768 14052 1 16 . 1 1 72 72 ASP CA C 72 54.340 54.340 54.260 0.080 25768 14053 1 16 . 1 1 72 72 ASP CB C 72 41.480 41.480 41.085 0.395 25768 14054 1 16 . 1 1 72 72 ASP H H 72 8.280 8.280 8.460 -0.180 25768 14055 1 16 . 1 1 73 73 VAL N N 73 120.580 120.580 119.147 1.433 25768 14056 1 16 . 1 1 73 73 VAL C C 73 176.350 176.350 175.687 0.663 25768 14057 1 16 . 1 1 73 73 VAL CA C 73 62.970 62.970 62.676 0.294 25768 14058 1 16 . 1 1 73 73 VAL CB C 73 32.550 32.550 32.355 0.195 25768 14059 1 16 . 1 1 73 73 VAL H H 73 7.960 7.960 7.780 0.180 25768 14060 1 16 . 1 1 74 74 LYS N N 74 123.620 123.620 123.113 0.507 25768 14061 1 16 . 1 1 74 74 LYS C C 74 177.130 177.130 176.339 0.791 25768 14062 1 16 . 1 1 74 74 LYS CA C 74 57.060 57.060 56.953 0.107 25768 14063 1 16 . 1 1 74 74 LYS CB C 74 32.860 32.860 31.079 1.781 25768 14064 1 16 . 1 1 74 74 LYS H H 74 8.230 8.230 8.417 -0.187 25768 14065 1 16 . 1 1 75 75 GLY N N 75 109.370 109.370 110.296 -0.926 25768 14066 1 16 . 1 1 75 75 GLY C C 75 174.030 174.030 174.057 -0.027 25768 14067 1 16 . 1 1 75 75 GLY CA C 75 45.800 45.800 44.636 1.164 25768 14068 1 16 . 1 1 75 75 GLY H H 75 8.160 8.160 8.204 -0.044 25768 14069 1 16 . 1 1 76 76 LEU N N 76 121.660 121.660 121.899 -0.239 25768 14070 1 16 . 1 1 76 76 LEU C C 76 177.410 177.410 177.476 -0.066 25768 14071 1 16 . 1 1 76 76 LEU CA C 76 55.410 55.410 55.717 -0.307 25768 14072 1 16 . 1 1 76 76 LEU CB C 76 42.790 42.790 41.881 0.909 25768 14073 1 16 . 1 1 76 76 LEU H H 76 8.030 8.030 8.026 0.004 25768 14074 1 16 . 1 1 77 77 GLY N N 77 109.330 109.330 113.277 -3.947 25768 14075 1 16 . 1 1 77 77 GLY C C 77 171.800 171.800 172.271 -0.471 25768 14076 1 16 . 1 1 77 77 GLY CA C 77 44.990 44.990 44.094 0.896 25768 14077 1 16 . 1 1 77 77 GLY H H 77 8.100 8.100 8.211 -0.111 25768 14078 1 16 . 1 1 78 78 PRO C C 78 177.740 177.740 176.615 1.125 25768 14079 1 16 . 1 1 78 78 PRO CA C 78 63.890 63.890 63.414 0.476 25768 14080 1 16 . 1 1 78 78 PRO CB C 78 32.170 32.170 31.918 0.252 25768 14081 1 16 . 1 1 79 79 GLY N N 79 109.530 109.530 110.472 -0.942 25768 14082 1 16 . 1 1 79 79 GLY C C 79 174.460 174.460 173.798 0.662 25768 14083 1 16 . 1 1 79 79 GLY CA C 79 45.780 45.780 45.233 0.547 25768 14084 1 16 . 1 1 79 79 GLY H H 79 8.410 8.410 8.344 0.066 25768 14085 1 16 . 1 1 80 80 LEU N N 80 121.880 121.880 119.846 2.034 25768 14086 1 16 . 1 1 80 80 LEU C C 80 177.100 177.100 176.005 1.095 25768 14087 1 16 . 1 1 80 80 LEU CA C 80 55.720 55.720 56.039 -0.319 25768 14088 1 16 . 1 1 80 80 LEU CB C 80 42.580 42.580 43.038 -0.458 25768 14089 1 16 . 1 1 80 80 LEU H H 80 8.010 8.010 7.539 0.471 25768 14090 1 16 . 1 1 81 81 ASP N N 81 119.990 119.990 120.455 -0.465 25768 14091 1 16 . 1 1 81 81 ASP C C 81 176.880 176.880 175.536 1.344 25768 14092 1 16 . 1 1 81 81 ASP CA C 81 54.770 54.770 54.884 -0.114 25768 14093 1 16 . 1 1 81 81 ASP CB C 81 41.390 41.390 40.334 1.056 25768 14094 1 16 . 1 1 81 81 ASP H H 81 8.220 8.220 8.294 -0.074 25768 14095 1 16 . 1 1 82 82 GLY N N 82 109.270 109.270 107.273 1.997 25768 14096 1 16 . 1 1 82 82 GLY C C 82 174.190 174.190 173.081 1.109 25768 14097 1 16 . 1 1 82 82 GLY CA C 82 45.990 45.990 44.666 1.323 25768 14098 1 16 . 1 1 82 82 GLY H H 82 8.170 8.170 7.791 0.379 25768 14099 1 16 . 1 1 83 83 LYS N N 83 121.000 121.000 121.432 -0.432 25768 14100 1 16 . 1 1 83 83 LYS C C 83 176.610 176.610 176.343 0.267 25768 14101 1 16 . 1 1 83 83 LYS CA C 83 56.620 56.620 55.607 1.013 25768 14102 1 16 . 1 1 83 83 LYS CB C 83 33.020 33.020 33.498 -0.478 25768 14103 1 16 . 1 1 83 83 LYS H H 83 7.970 7.970 8.314 -0.344 25768 14104 1 16 . 1 1 84 84 LEU N N 84 123.120 123.120 121.994 1.126 25768 14105 1 16 . 1 1 84 84 LEU C C 84 176.920 176.920 175.605 1.315 25768 14106 1 16 . 1 1 84 84 LEU CA C 84 55.550 55.550 54.403 1.147 25768 14107 1 16 . 1 1 84 84 LEU CB C 84 42.430 42.430 44.142 -1.712 25768 14108 1 16 . 1 1 84 84 LEU H H 84 8.130 8.130 8.655 -0.525 25768 14109 1 16 . 1 1 85 85 ALA N N 85 123.930 123.930 122.677 1.253 25768 14110 1 16 . 1 1 85 85 ALA C C 85 177.060 177.060 176.071 0.989 25768 14111 1 16 . 1 1 85 85 ALA CA C 85 52.790 52.790 51.565 1.225 25768 14112 1 16 . 1 1 85 85 ALA CB C 85 19.670 19.670 20.601 -0.931 25768 14113 1 16 . 1 1 85 85 ALA H H 85 8.040 8.040 8.205 -0.165 25768 14114 1 16 . 1 1 86 86 ASP N N 86 119.760 119.760 120.233 -0.473 25768 14115 1 16 . 1 1 86 86 ASP C C 86 175.820 175.820 176.590 -0.770 25768 14116 1 16 . 1 1 86 86 ASP CA C 86 54.520 54.520 54.480 0.040 25768 14117 1 16 . 1 1 86 86 ASP CB C 86 41.390 41.390 41.455 -0.065 25768 14118 1 16 . 1 1 86 86 ASP H H 86 8.110 8.110 8.862 -0.752 25768 14119 1 16 . 1 1 87 87 ILE N N 87 120.620 120.620 116.699 3.921 25768 14120 1 16 . 1 1 87 87 ILE C C 87 175.740 175.740 174.122 1.618 25768 14121 1 16 . 1 1 87 87 ILE CA C 87 61.160 61.160 60.581 0.579 25768 14122 1 16 . 1 1 87 87 ILE CB C 87 39.260 39.260 40.083 -0.823 25768 14123 1 16 . 1 1 87 87 ILE H H 87 7.800 7.800 7.579 0.221 25768 14124 1 16 . 1 1 88 88 LYS N N 88 125.820 125.820 122.477 3.343 25768 14125 1 16 . 1 1 88 88 LYS C C 88 175.340 175.340 175.213 0.127 25768 14126 1 16 . 1 1 88 88 LYS CA C 88 56.300 56.300 55.322 0.978 25768 14127 1 16 . 1 1 88 88 LYS CB C 88 32.900 32.900 34.372 -1.472 25768 14128 1 16 . 1 1 88 88 LYS H H 88 8.250 8.250 8.275 -0.025 25768 14129 1 16 . 1 1 89 89 GLN N N 89 121.750 121.750 122.327 -0.577 25768 14130 1 16 . 1 1 89 89 GLN C C 89 175.000 175.000 174.635 0.365 25768 14131 1 16 . 1 1 89 89 GLN CA C 89 55.210 55.210 56.109 -0.899 25768 14132 1 16 . 1 1 89 89 GLN CB C 89 30.570 30.570 30.055 0.515 25768 14133 1 16 . 1 1 89 89 GLN H H 89 8.000 8.000 8.516 -0.516 25768 14134 1 16 . 1 1 90 90 LEU N N 90 126.660 126.660 125.606 1.054 25768 14135 1 16 . 1 1 90 90 LEU C C 90 174.240 174.240 175.155 -0.915 25768 14136 1 16 . 1 1 90 90 LEU CA C 90 52.720 52.720 52.650 0.070 25768 14137 1 16 . 1 1 90 90 LEU CB C 90 42.350 42.350 42.745 -0.396 25768 14138 1 16 . 1 1 90 90 LEU H H 90 8.630 8.630 8.257 0.373 25768 14139 1 16 . 1 1 92 92 PRO C C 92 173.900 173.900 176.491 -2.591 25768 14140 1 16 . 1 1 92 92 PRO CA C 92 63.320 63.320 62.253 1.067 25768 14141 1 16 . 1 1 92 92 PRO CB C 92 31.920 31.920 32.664 -0.744 25768 14142 1 16 . 1 1 93 93 THR N N 93 119.770 119.770 115.273 4.497 25768 14143 1 16 . 1 1 93 93 THR C C 93 171.360 171.360 173.181 -1.821 25768 14144 1 16 . 1 1 93 93 THR CA C 93 62.610 62.610 60.968 1.643 25768 14145 1 16 . 1 1 93 93 THR CB C 93 72.680 72.680 71.000 1.680 25768 14146 1 16 . 1 1 93 93 THR H H 93 8.290 8.290 8.163 0.127 25768 14147 1 16 . 1 1 94 94 LEU N N 94 128.880 128.880 126.817 2.063 25768 14148 1 16 . 1 1 94 94 LEU C C 94 175.130 175.130 174.937 0.193 25768 14149 1 16 . 1 1 94 94 LEU CA C 94 53.520 53.520 54.110 -0.590 25768 14150 1 16 . 1 1 94 94 LEU CB C 94 46.140 46.140 44.445 1.695 25768 14151 1 16 . 1 1 94 94 LEU H H 94 8.680 8.680 8.590 0.090 25768 14152 1 16 . 1 1 95 95 LEU N N 95 123.630 123.630 122.086 1.544 25768 14153 1 16 . 1 1 95 95 LEU C C 95 175.540 175.540 174.795 0.745 25768 14154 1 16 . 1 1 95 95 LEU CA C 95 55.190 55.190 53.693 1.497 25768 14155 1 16 . 1 1 95 95 LEU CB C 95 45.300 45.300 44.416 0.884 25768 14156 1 16 . 1 1 95 95 LEU H H 95 9.580 9.580 8.438 1.142 25768 14157 1 16 . 1 1 96 96 LEU N N 96 123.150 123.150 125.597 -2.447 25768 14158 1 16 . 1 1 96 96 LEU C C 96 174.960 174.960 175.645 -0.685 25768 14159 1 16 . 1 1 96 96 LEU CA C 96 54.420 54.420 55.240 -0.820 25768 14160 1 16 . 1 1 96 96 LEU CB C 96 44.560 44.560 42.316 2.244 25768 14161 1 16 . 1 1 96 96 LEU H H 96 8.770 8.770 8.572 0.198 25768 14162 1 16 . 1 1 97 97 GLN N N 97 121.290 121.290 121.231 0.059 25768 14163 1 16 . 1 1 97 97 GLN C C 97 174.380 174.380 173.488 0.892 25768 14164 1 16 . 1 1 97 97 GLN CA C 97 54.740 54.740 54.418 0.322 25768 14165 1 16 . 1 1 97 97 GLN CB C 97 36.600 36.600 33.342 3.258 25768 14166 1 16 . 1 1 97 97 GLN H H 97 9.480 9.480 8.433 1.047 25768 14167 1 16 . 1 1 98 98 TYR N N 98 122.250 122.250 122.429 -0.179 25768 14168 1 16 . 1 1 98 98 TYR C C 98 173.460 173.460 173.830 -0.370 25768 14169 1 16 . 1 1 98 98 TYR CA C 98 55.160 55.160 56.337 -1.177 25768 14170 1 16 . 1 1 98 98 TYR CB C 98 42.420 42.420 42.995 -0.576 25768 14171 1 16 . 1 1 98 98 TYR H H 98 9.010 9.010 8.122 0.888 25768 14172 1 16 . 1 1 99 99 TYR N N 99 126.860 126.860 123.107 3.753 25768 14173 1 16 . 1 1 99 99 TYR C C 99 175.380 175.380 175.386 -0.006 25768 14174 1 16 . 1 1 99 99 TYR CA C 99 54.220 54.220 55.143 -0.923 25768 14175 1 16 . 1 1 99 99 TYR CB C 99 38.890 38.890 37.663 1.227 25768 14176 1 16 . 1 1 99 99 TYR H H 99 8.300 8.300 7.912 0.388 25768 14177 1 16 . 1 1 100 100 PRO C C 100 178.330 178.330 177.061 1.269 25768 14178 1 16 . 1 1 100 100 PRO CA C 100 64.750 64.750 65.183 -0.433 25768 14179 1 16 . 1 1 100 100 PRO CB C 100 32.130 32.130 32.305 -0.175 25768 14180 1 16 . 1 1 101 101 MET N N 101 114.520 114.520 118.038 -3.518 25768 14181 1 16 . 1 1 101 101 MET C C 101 178.240 178.240 175.113 3.127 25768 14182 1 16 . 1 1 101 101 MET CA C 101 53.500 53.500 54.470 -0.970 25768 14183 1 16 . 1 1 101 101 MET CB C 101 30.160 30.160 33.550 -3.390 25768 14184 1 16 . 1 1 101 101 MET H H 101 9.390 9.390 8.355 1.035 25768 14185 1 16 . 1 1 102 102 GLY N N 102 117.500 117.500 108.128 9.372 25768 14186 1 16 . 1 1 102 102 GLY C C 102 175.690 175.690 174.301 1.389 25768 14187 1 16 . 1 1 102 102 GLY CA C 102 46.760 46.760 44.652 2.108 25768 14188 1 16 . 1 1 102 102 GLY H H 102 8.640 8.640 7.644 0.996 25768 14189 1 16 . 1 1 103 103 GLY N N 103 111.030 111.030 112.912 -1.882 25768 14190 1 16 . 1 1 103 103 GLY C C 103 174.070 174.070 173.999 0.071 25768 14191 1 16 . 1 1 103 103 GLY CA C 103 46.140 46.140 45.517 0.623 25768 14192 1 16 . 1 1 103 103 GLY H H 103 9.390 9.390 7.860 1.530 25768 14193 1 16 . 1 1 104 104 THR N N 104 109.290 109.290 112.368 -3.078 25768 14194 1 16 . 1 1 104 104 THR C C 104 174.290 174.290 173.531 0.759 25768 14195 1 16 . 1 1 104 104 THR CA C 104 60.900 60.900 60.633 0.268 25768 14196 1 16 . 1 1 104 104 THR CB C 104 72.070 72.070 71.135 0.935 25768 14197 1 16 . 1 1 104 104 THR H H 104 7.290 7.290 7.992 -0.702 25768 14198 1 16 . 1 1 105 105 ASN C C 105 175.050 175.050 174.652 0.398 25768 14199 1 16 . 1 1 105 105 ASN CA C 105 52.880 52.880 53.155 -0.275 25768 14200 1 16 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.962 -0.702 25768 14201 1 16 . 1 1 106 106 SER N N 106 113.000 113.000 117.023 -4.023 25768 14202 1 16 . 1 1 106 106 SER C C 106 176.000 176.000 174.795 1.205 25768 14203 1 16 . 1 1 106 106 SER CA C 106 58.700 58.700 58.479 0.221 25768 14204 1 16 . 1 1 106 106 SER CB C 106 64.540 64.540 64.484 0.056 25768 14205 1 16 . 1 1 106 106 SER H H 106 7.450 7.450 7.640 -0.190 25768 14206 1 16 . 1 1 107 107 ALA N N 107 132.220 132.220 127.789 4.431 25768 14207 1 16 . 1 1 107 107 ALA C C 107 176.610 176.610 177.903 -1.293 25768 14208 1 16 . 1 1 107 107 ALA CA C 107 54.380 54.380 53.761 0.619 25768 14209 1 16 . 1 1 107 107 ALA CB C 107 18.690 18.690 19.090 -0.400 25768 14210 1 16 . 1 1 107 107 ALA H H 107 8.870 8.870 8.592 0.278 25768 14211 1 16 . 1 1 108 108 PHE N N 108 116.050 116.050 117.843 -1.793 25768 14212 1 16 . 1 1 108 108 PHE C C 108 174.270 174.270 175.497 -1.227 25768 14213 1 16 . 1 1 108 108 PHE CA C 108 56.140 56.140 58.068 -1.928 25768 14214 1 16 . 1 1 108 108 PHE CB C 108 40.520 40.520 40.621 -0.101 25768 14215 1 16 . 1 1 108 108 PHE H H 108 7.550 7.550 8.026 -0.476 25768 14216 1 16 . 1 1 109 109 GLN N N 109 128.260 128.260 122.769 5.491 25768 14217 1 16 . 1 1 109 109 GLN C C 109 172.300 172.300 173.583 -1.283 25768 14218 1 16 . 1 1 109 109 GLN CA C 109 52.310 52.310 52.758 -0.448 25768 14219 1 16 . 1 1 109 109 GLN CB C 109 29.050 29.050 30.152 -1.102 25768 14220 1 16 . 1 1 109 109 GLN H H 109 9.060 9.060 8.336 0.724 25768 14221 1 16 . 1 1 110 110 PRO C C 110 175.020 175.020 175.685 -0.665 25768 14222 1 16 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.151 -0.601 25768 14223 1 16 . 1 1 110 110 PRO CB C 110 33.280 33.280 31.529 1.751 25768 14224 1 16 . 1 1 111 111 TYR N N 111 115.730 115.730 119.923 -4.193 25768 14225 1 16 . 1 1 111 111 TYR C C 111 173.850 173.850 174.035 -0.185 25768 14226 1 16 . 1 1 111 111 TYR CA C 111 56.470 56.470 55.144 1.326 25768 14227 1 16 . 1 1 111 111 TYR CB C 111 38.650 38.650 40.891 -2.241 25768 14228 1 16 . 1 1 111 111 TYR H H 111 8.500 8.500 8.434 0.066 25768 14229 1 16 . 1 1 112 112 GLY N N 112 103.570 103.570 106.736 -3.166 25768 14230 1 16 . 1 1 112 112 GLY C C 112 172.020 172.020 172.679 -0.659 25768 14231 1 16 . 1 1 112 112 GLY CA C 112 43.950 43.950 44.513 -0.563 25768 14232 1 16 . 1 1 112 112 GLY H H 112 8.110 8.110 8.964 -0.854 25768 14233 1 16 . 1 1 113 113 GLY N N 113 108.510 108.510 109.883 -1.373 25768 14234 1 16 . 1 1 113 113 GLY C C 113 171.540 171.540 172.356 -0.816 25768 14235 1 16 . 1 1 113 113 GLY CA C 113 46.120 46.120 44.877 1.243 25768 14236 1 16 . 1 1 113 113 GLY H H 113 9.080 9.080 8.249 0.831 25768 14237 1 16 . 1 1 114 114 LEU N N 114 120.270 120.270 120.420 -0.150 25768 14238 1 16 . 1 1 114 114 LEU C C 114 175.810 175.810 175.287 0.523 25768 14239 1 16 . 1 1 114 114 LEU CA C 114 53.920 53.920 54.389 -0.469 25768 14240 1 16 . 1 1 114 114 LEU CB C 114 47.940 47.940 46.495 1.444 25768 14241 1 16 . 1 1 114 114 LEU H H 114 8.620 8.620 7.803 0.817 25768 14242 1 16 . 1 1 115 115 GLY N N 115 110.620 110.620 110.889 -0.269 25768 14243 1 16 . 1 1 115 115 GLY C C 115 171.560 171.560 172.051 -0.491 25768 14244 1 16 . 1 1 115 115 GLY CA C 115 46.940 46.940 43.690 3.250 25768 14245 1 16 . 1 1 115 115 GLY H H 115 9.000 9.000 8.726 0.274 25768 14246 1 16 . 1 1 116 116 VAL N N 116 113.600 113.600 118.137 -4.537 25768 14247 1 16 . 1 1 116 116 VAL C C 116 174.120 174.120 173.874 0.246 25768 14248 1 16 . 1 1 116 116 VAL CA C 116 58.970 58.970 61.144 -2.174 25768 14249 1 16 . 1 1 116 116 VAL CB C 116 36.600 36.600 35.718 0.882 25768 14250 1 16 . 1 1 116 116 VAL H H 116 8.680 8.680 7.700 0.980 25768 14251 1 16 . 1 1 117 117 ASN N N 117 120.020 120.020 125.113 -5.093 25768 14252 1 16 . 1 1 117 117 ASN CA C 117 52.190 52.190 52.880 -0.691 25768 14253 1 16 . 1 1 117 117 ASN CB C 117 42.450 42.450 41.141 1.310 25768 14254 1 16 . 1 1 117 117 ASN H H 117 8.840 8.840 8.431 0.409 25768 14255 1 16 . 1 1 119 119 THR C C 119 174.350 174.350 175.498 -1.148 25768 14256 1 16 . 1 1 119 119 THR CA C 119 63.140 63.140 60.731 2.409 25768 14257 1 16 . 1 1 119 119 THR CB C 119 70.170 70.170 71.716 -1.546 25768 14258 1 16 . 1 1 120 120 THR N N 120 114.120 114.120 118.320 -4.200 25768 14259 1 16 . 1 1 120 120 THR C C 120 174.220 174.220 175.513 -1.293 25768 14260 1 16 . 1 1 120 120 THR CA C 120 61.900 61.900 64.462 -2.562 25768 14261 1 16 . 1 1 120 120 THR CB C 120 70.140 70.140 69.121 1.019 25768 14262 1 16 . 1 1 120 120 THR H H 120 7.570 7.570 8.501 -0.931 25768 14263 1 16 . 1 1 121 121 PHE N N 121 121.230 121.230 120.922 0.308 25768 14264 1 16 . 1 1 121 121 PHE C C 121 174.910 174.910 176.959 -2.049 25768 14265 1 16 . 1 1 121 121 PHE CA C 121 58.720 58.720 58.669 0.051 25768 14266 1 16 . 1 1 121 121 PHE CB C 121 40.470 40.470 39.027 1.443 25768 14267 1 16 . 1 1 121 121 PHE H H 121 7.830 7.830 8.085 -0.255 25768 14268 1 16 . 1 1 122 122 PHE C C 122 175.070 175.070 175.160 -0.090 25768 14269 1 16 . 1 1 122 122 PHE CA C 122 57.890 57.890 59.001 -1.111 25768 14270 1 16 . 1 1 122 122 PHE CB C 122 39.870 39.870 39.536 0.334 25768 14271 1 16 . 1 1 123 123 ASP N N 123 122.170 122.170 121.979 0.191 25768 14272 1 16 . 1 1 123 123 ASP C C 123 176.150 176.150 175.065 1.085 25768 14273 1 16 . 1 1 123 123 ASP CA C 123 54.530 54.530 55.218 -0.688 25768 14274 1 16 . 1 1 123 123 ASP CB C 123 41.830 41.830 40.565 1.265 25768 14275 1 16 . 1 1 123 123 ASP H H 123 7.950 7.950 8.567 -0.617 25768 14276 1 16 . 1 1 124 124 GLU N N 124 122.690 122.690 120.138 2.552 25768 14277 1 16 . 1 1 124 124 GLU C C 124 176.630 176.630 177.432 -0.802 25768 14278 1 16 . 1 1 124 124 GLU CA C 124 57.620 57.620 57.332 0.288 25768 14279 1 16 . 1 1 124 124 GLU CB C 124 30.450 30.450 30.253 0.197 25768 14280 1 16 . 1 1 124 124 GLU H H 124 8.340 8.340 8.299 0.041 25768 14281 1 16 . 1 1 125 125 ASP N N 125 121.280 121.280 118.965 2.315 25768 14282 1 16 . 1 1 125 125 ASP C C 125 176.940 176.940 177.675 -0.735 25768 14283 1 16 . 1 1 125 125 ASP CA C 125 55.180 55.180 56.127 -0.946 25768 14284 1 16 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.136 1.083 25768 14285 1 16 . 1 1 125 125 ASP H H 125 8.310 8.310 8.540 -0.230 25768 14286 1 16 . 1 1 126 126 LEU N N 126 122.830 122.830 119.061 3.769 25768 14287 1 16 . 1 1 126 126 LEU C C 126 178.020 178.020 177.661 0.359 25768 14288 1 16 . 1 1 126 126 LEU CA C 126 56.450 56.450 56.703 -0.253 25768 14289 1 16 . 1 1 126 126 LEU CB C 126 42.150 42.150 42.119 0.031 25768 14290 1 16 . 1 1 126 126 LEU H H 126 8.010 8.010 7.770 0.240 25768 14291 1 16 . 1 1 127 127 ALA N N 127 122.660 122.660 119.196 3.464 25768 14292 1 16 . 1 1 127 127 ALA C C 127 178.600 178.600 178.068 0.532 25768 14293 1 16 . 1 1 127 127 ALA CA C 127 53.780 53.780 53.822 -0.042 25768 14294 1 16 . 1 1 127 127 ALA CB C 127 19.000 19.000 19.468 -0.468 25768 14295 1 16 . 1 1 127 127 ALA H H 127 8.100 8.100 7.714 0.386 25768 14296 1 16 . 1 1 128 128 SER N N 128 113.740 113.740 113.294 0.446 25768 14297 1 16 . 1 1 128 128 SER C C 128 175.010 175.010 174.017 0.993 25768 14298 1 16 . 1 1 128 128 SER CA C 128 59.580 59.580 60.772 -1.192 25768 14299 1 16 . 1 1 128 128 SER CB C 128 63.800 63.800 62.644 1.156 25768 14300 1 16 . 1 1 128 128 SER H H 128 7.920 7.920 7.925 -0.005 25768 14301 1 16 . 1 1 129 129 ASN N N 129 120.300 120.300 119.313 0.987 25768 14302 1 16 . 1 1 129 129 ASN C C 129 175.590 175.590 173.564 2.026 25768 14303 1 16 . 1 1 129 129 ASN CA C 129 54.180 54.180 52.877 1.304 25768 14304 1 16 . 1 1 129 129 ASN CB C 129 38.900 38.900 40.336 -1.436 25768 14305 1 16 . 1 1 129 129 ASN H H 129 8.120 8.120 8.436 -0.316 25768 14306 1 16 . 1 1 130 130 ARG N N 130 120.630 120.630 121.559 -0.929 25768 14307 1 16 . 1 1 130 130 ARG C C 130 176.720 176.720 175.838 0.882 25768 14308 1 16 . 1 1 130 130 ARG CA C 130 57.240 57.240 55.497 1.743 25768 14309 1 16 . 1 1 130 130 ARG CB C 130 30.500 30.500 31.333 -0.833 25768 14310 1 16 . 1 1 130 130 ARG H H 130 8.050 8.050 8.386 -0.336 25768 14311 1 16 . 1 1 131 131 LYS N N 131 121.150 121.150 121.243 -0.093 25768 14312 1 16 . 1 1 131 131 LYS C C 131 176.750 176.750 175.080 1.670 25768 14313 1 16 . 1 1 131 131 LYS CA C 131 57.050 57.050 56.551 0.499 25768 14314 1 16 . 1 1 131 131 LYS CB C 131 32.870 32.870 33.741 -0.871 25768 14315 1 16 . 1 1 131 131 LYS H H 131 8.020 8.020 8.471 -0.451 25768 14316 1 16 . 1 1 132 132 ALA N N 132 124.110 124.110 125.385 -1.275 25768 14317 1 16 . 1 1 132 132 ALA C C 132 177.680 177.680 176.174 1.506 25768 14318 1 16 . 1 1 132 132 ALA CA C 132 53.070 53.070 53.042 0.028 25768 14319 1 16 . 1 1 132 132 ALA CB C 132 19.250 19.250 17.982 1.268 25768 14320 1 16 . 1 1 132 132 ALA H H 132 8.010 8.010 8.625 -0.615 25768 14321 1 16 . 1 1 133 133 GLN N N 133 118.830 118.830 118.130 0.700 25768 14322 1 16 . 1 1 133 133 GLN C C 133 176.380 176.380 175.598 0.782 25768 14323 1 16 . 1 1 133 133 GLN CA C 133 56.400 56.400 55.489 0.911 25768 14324 1 16 . 1 1 133 133 GLN CB C 133 29.670 29.670 29.789 -0.119 25768 14325 1 16 . 1 1 133 133 GLN H H 133 8.070 8.070 8.083 -0.013 25768 14326 1 16 . 1 1 134 134 GLY N N 134 109.400 109.400 110.077 -0.677 25768 14327 1 16 . 1 1 134 134 GLY C C 134 174.060 174.060 173.463 0.597 25768 14328 1 16 . 1 1 134 134 GLY CA C 134 45.690 45.690 45.473 0.217 25768 14329 1 16 . 1 1 134 134 GLY H H 134 8.150 8.150 8.457 -0.307 25768 14330 1 16 . 1 1 135 135 PHE N N 135 120.480 120.480 120.314 0.166 25768 14331 1 16 . 1 1 135 135 PHE C C 135 176.000 176.000 175.643 0.357 25768 14332 1 16 . 1 1 135 135 PHE CA C 135 58.370 58.370 57.773 0.597 25768 14333 1 16 . 1 1 135 135 PHE CB C 135 39.710 39.710 40.050 -0.340 25768 14334 1 16 . 1 1 135 135 PHE H H 135 8.060 8.060 8.231 -0.171 25768 14335 1 16 . 1 1 136 136 SER N N 136 116.740 116.740 115.067 1.673 25768 14336 1 16 . 1 1 136 136 SER C C 136 174.620 174.620 174.933 -0.313 25768 14337 1 16 . 1 1 136 136 SER CA C 136 58.870 58.870 57.805 1.065 25768 14338 1 16 . 1 1 136 136 SER CB C 136 64.200 64.200 63.684 0.515 25768 14339 1 16 . 1 1 136 136 SER H H 136 8.160 8.160 7.799 0.361 25768 14340 1 16 . 1 1 137 137 SER N N 137 117.650 117.650 118.932 -1.282 25768 14341 1 16 . 1 1 137 137 SER C C 137 174.410 174.410 174.188 0.222 25768 14342 1 16 . 1 1 137 137 SER CA C 137 58.880 58.880 57.763 1.117 25768 14343 1 16 . 1 1 137 137 SER CB C 137 64.140 64.140 63.905 0.235 25768 14344 1 16 . 1 1 137 137 SER H H 137 8.140 8.140 8.077 0.063 25768 14345 1 16 . 1 1 138 138 MET N N 138 121.980 121.980 122.334 -0.354 25768 14346 1 16 . 1 1 138 138 MET C C 138 175.680 175.680 176.090 -0.410 25768 14347 1 16 . 1 1 138 138 MET CA C 138 56.180 56.180 56.311 -0.131 25768 14348 1 16 . 1 1 138 138 MET CB C 138 33.240 33.240 33.178 0.062 25768 14349 1 16 . 1 1 138 138 MET H H 138 8.110 8.110 8.505 -0.395 25768 14350 1 16 . 1 1 139 139 LYS N N 139 122.110 122.110 120.999 1.111 25768 14351 1 16 . 1 1 139 139 LYS C C 139 176.220 176.220 174.617 1.603 25768 14352 1 16 . 1 1 139 139 LYS CA C 139 56.370 56.370 55.399 0.971 25768 14353 1 16 . 1 1 139 139 LYS CB C 139 33.220 33.220 35.288 -2.068 25768 14354 1 16 . 1 1 139 139 LYS H H 139 8.140 8.140 8.632 -0.492 25768 14355 1 16 . 1 1 140 140 LEU N N 140 123.860 123.860 122.330 1.530 25768 14356 1 16 . 1 1 140 140 LEU C C 140 177.100 177.100 175.638 1.462 25768 14357 1 16 . 1 1 140 140 LEU CA C 140 55.710 55.710 55.076 0.634 25768 14358 1 16 . 1 1 140 140 LEU CB C 140 42.460 42.460 42.765 -0.305 25768 14359 1 16 . 1 1 140 140 LEU H H 140 8.140 8.140 8.184 -0.044 25768 14360 1 16 . 1 1 141 141 GLN N N 141 120.350 120.350 120.593 -0.243 25768 14361 1 16 . 1 1 141 141 GLN C C 141 175.170 175.170 175.173 -0.003 25768 14362 1 16 . 1 1 141 141 GLN CA C 141 56.200 56.200 55.818 0.382 25768 14363 1 16 . 1 1 141 141 GLN CB C 141 29.950 29.950 29.337 0.613 25768 14364 1 16 . 1 1 141 141 GLN H H 141 8.210 8.210 8.457 -0.247 25768 14365 1 16 . 1 1 142 142 ASP N N 142 120.950 120.950 123.879 -2.929 25768 14366 1 16 . 1 1 142 142 ASP C C 142 175.840 175.840 176.333 -0.493 25768 14367 1 16 . 1 1 142 142 ASP CA C 142 54.700 54.700 54.103 0.597 25768 14368 1 16 . 1 1 142 142 ASP CB C 142 41.760 41.760 41.019 0.741 25768 14369 1 16 . 1 1 142 142 ASP H H 142 8.120 8.120 8.766 -0.646 25768 14370 1 16 . 1 1 143 143 SER N N 143 114.880 114.880 114.692 0.188 25768 14371 1 16 . 1 1 143 143 SER C C 143 173.290 173.290 174.098 -0.808 25768 14372 1 16 . 1 1 143 143 SER CA C 143 58.450 58.450 57.915 0.535 25768 14373 1 16 . 1 1 143 143 SER CB C 143 64.760 64.760 63.374 1.386 25768 14374 1 16 . 1 1 143 143 SER H H 143 7.960 7.960 7.985 -0.025 25768 14375 1 16 . 1 1 144 144 TRP N N 144 123.110 123.110 122.959 0.151 25768 14376 1 16 . 1 1 144 144 TRP C C 144 175.880 175.880 176.783 -0.903 25768 14377 1 16 . 1 1 144 144 TRP CA C 144 56.420 56.420 58.554 -2.134 25768 14378 1 16 . 1 1 144 144 TRP CB C 144 31.160 31.160 29.964 1.196 25768 14379 1 16 . 1 1 144 144 TRP H H 144 8.080 8.080 7.721 0.359 25768 14380 1 16 . 1 1 145 145 GLY N N 145 110.410 110.410 113.411 -3.001 25768 14381 1 16 . 1 1 145 145 GLY C C 145 172.870 172.870 173.249 -0.379 25768 14382 1 16 . 1 1 145 145 GLY CA C 145 45.130 45.130 44.247 0.883 25768 14383 1 16 . 1 1 145 145 GLY H H 145 8.660 8.660 8.111 0.549 25768 14384 1 16 . 1 1 148 148 GLY C C 148 171.800 171.800 173.484 -1.684 25768 14385 1 16 . 1 1 148 148 GLY CA C 148 44.140 44.140 44.455 -0.315 25768 14386 1 16 . 1 1 149 149 GLU N N 149 123.070 123.070 121.761 1.309 25768 14387 1 16 . 1 1 149 149 GLU C C 149 174.210 174.210 174.959 -0.749 25768 14388 1 16 . 1 1 149 149 GLU CA C 149 55.120 55.120 56.032 -0.913 25768 14389 1 16 . 1 1 149 149 GLU CB C 149 37.410 37.410 32.489 4.921 25768 14390 1 16 . 1 1 149 149 GLU H H 149 8.550 8.550 8.089 0.461 25768 14391 1 16 . 1 1 150 150 LEU N N 150 126.130 126.130 127.002 -0.872 25768 14392 1 16 . 1 1 150 150 LEU C C 150 174.410 174.410 175.623 -1.213 25768 14393 1 16 . 1 1 150 150 LEU CA C 150 54.260 54.260 53.801 0.459 25768 14394 1 16 . 1 1 150 150 LEU CB C 150 47.510 47.510 46.057 1.453 25768 14395 1 16 . 1 1 150 150 LEU H H 150 8.550 8.550 8.590 -0.040 25768 14396 1 16 . 1 1 151 151 GLY N N 151 109.500 109.500 107.169 2.331 25768 14397 1 16 . 1 1 151 151 GLY C C 151 170.610 170.610 171.755 -1.145 25768 14398 1 16 . 1 1 151 151 GLY CA C 151 45.980 45.980 45.305 0.675 25768 14399 1 16 . 1 1 151 151 GLY H H 151 8.090 8.090 7.892 0.198 25768 14400 1 16 . 1 1 152 152 PHE N N 152 110.960 110.960 116.828 -5.868 25768 14401 1 16 . 1 1 152 152 PHE C C 152 171.510 171.510 174.087 -2.577 25768 14402 1 16 . 1 1 152 152 PHE CA C 152 58.170 58.170 56.048 2.122 25768 14403 1 16 . 1 1 152 152 PHE CB C 152 41.690 41.690 43.250 -1.560 25768 14404 1 16 . 1 1 152 152 PHE H H 152 8.380 8.380 8.084 0.296 25768 14405 1 16 . 1 1 153 153 ASP N N 153 118.880 118.880 119.601 -0.721 25768 14406 1 16 . 1 1 153 153 ASP C C 153 176.520 176.520 174.819 1.701 25768 14407 1 16 . 1 1 153 153 ASP CA C 153 52.940 52.940 54.075 -1.135 25768 14408 1 16 . 1 1 153 153 ASP CB C 153 44.540 44.540 43.808 0.732 25768 14409 1 16 . 1 1 153 153 ASP H H 153 7.970 7.970 8.605 -0.635 25768 14410 1 16 . 1 1 154 154 TYR N N 154 123.630 123.630 124.749 -1.119 25768 14411 1 16 . 1 1 154 154 TYR C C 154 175.610 175.610 173.458 2.152 25768 14412 1 16 . 1 1 154 154 TYR CA C 154 57.310 57.310 57.041 0.269 25768 14413 1 16 . 1 1 154 154 TYR CB C 154 42.040 42.040 41.314 0.726 25768 14414 1 16 . 1 1 154 154 TYR H H 154 9.730 9.730 9.650 0.080 25768 14415 1 16 . 1 1 155 155 MET N N 155 126.190 126.190 123.340 2.850 25768 14416 1 16 . 1 1 155 155 MET C C 155 174.970 174.970 174.701 0.269 25768 14417 1 16 . 1 1 155 155 MET CA C 155 54.720 54.720 55.056 -0.336 25768 14418 1 16 . 1 1 155 155 MET CB C 155 28.300 28.300 33.425 -5.125 25768 14419 1 16 . 1 1 155 155 MET H H 155 8.600 8.600 8.155 0.445 25768 14420 1 16 . 1 1 156 156 LEU N N 156 125.290 125.290 122.393 2.897 25768 14421 1 16 . 1 1 156 156 LEU C C 156 177.680 177.680 177.200 0.480 25768 14422 1 16 . 1 1 156 156 LEU CA C 156 56.040 56.040 54.419 1.621 25768 14423 1 16 . 1 1 156 156 LEU CB C 156 43.040 43.040 42.946 0.094 25768 14424 1 16 . 1 1 156 156 LEU H H 156 9.190 9.190 8.899 0.291 25768 14425 1 16 . 1 1 157 157 ASN N N 157 114.690 114.690 116.756 -2.066 25768 14426 1 16 . 1 1 157 157 ASN C C 157 173.640 173.640 177.634 -3.994 25768 14427 1 16 . 1 1 157 157 ASN CA C 157 52.650 52.650 56.405 -3.755 25768 14428 1 16 . 1 1 157 157 ASN CB C 157 37.270 37.270 36.356 0.914 25768 14429 1 16 . 1 1 157 157 ASN H H 157 8.060 8.060 8.179 -0.119 25768 14430 1 16 . 1 1 158 158 GLU N N 158 114.530 114.530 121.702 -7.172 25768 14431 1 16 . 1 1 158 158 GLU C C 158 176.090 176.090 176.629 -0.539 25768 14432 1 16 . 1 1 158 158 GLU CA C 158 60.010 60.010 57.949 2.061 25768 14433 1 16 . 1 1 158 158 GLU CB C 158 29.730 29.730 29.788 -0.058 25768 14434 1 16 . 1 1 158 158 GLU H H 158 8.560 8.560 8.236 0.324 25768 14435 1 16 . 1 1 159 159 HIS N N 159 110.480 110.480 116.040 -5.560 25768 14436 1 16 . 1 1 159 159 HIS C C 159 173.130 173.130 174.136 -1.006 25768 14437 1 16 . 1 1 159 159 HIS CA C 159 56.770 56.770 54.997 1.773 25768 14438 1 16 . 1 1 159 159 HIS CB C 159 32.630 32.630 28.784 3.846 25768 14439 1 16 . 1 1 159 159 HIS H H 159 8.190 8.190 7.294 0.896 25768 14440 1 16 . 1 1 160 160 ALA N N 160 122.890 122.890 120.516 2.374 25768 14441 1 16 . 1 1 160 160 ALA C C 160 176.200 176.200 175.390 0.810 25768 14442 1 16 . 1 1 160 160 ALA CA C 160 51.730 51.730 53.600 -1.870 25768 14443 1 16 . 1 1 160 160 ALA CB C 160 21.560 21.560 18.637 2.923 25768 14444 1 16 . 1 1 160 160 ALA H H 160 8.400 8.400 7.792 0.608 25768 14445 1 16 . 1 1 161 161 LEU N N 161 116.540 116.540 118.435 -1.895 25768 14446 1 16 . 1 1 161 161 LEU C C 161 174.930 174.930 175.969 -1.039 25768 14447 1 16 . 1 1 161 161 LEU CA C 161 54.280 54.280 54.732 -0.452 25768 14448 1 16 . 1 1 161 161 LEU CB C 161 45.640 45.640 44.058 1.582 25768 14449 1 16 . 1 1 161 161 LEU H H 161 8.590 8.590 8.653 -0.063 25768 14450 1 16 . 1 1 162 162 PHE N N 162 121.780 121.780 124.205 -2.425 25768 14451 1 16 . 1 1 162 162 PHE C C 162 171.960 171.960 174.761 -2.801 25768 14452 1 16 . 1 1 162 162 PHE CA C 162 56.420 56.420 56.356 0.063 25768 14453 1 16 . 1 1 162 162 PHE CB C 162 43.340 43.340 41.689 1.651 25768 14454 1 16 . 1 1 162 162 PHE H H 162 9.180 9.180 9.799 -0.619 25768 14455 1 16 . 1 1 163 163 ASN N N 163 127.850 127.850 121.264 6.586 25768 14456 1 16 . 1 1 163 163 ASN C C 163 171.320 171.320 174.381 -3.061 25768 14457 1 16 . 1 1 163 163 ASN CA C 163 52.340 52.340 52.444 -0.104 25768 14458 1 16 . 1 1 163 163 ASN CB C 163 46.410 46.410 42.856 3.554 25768 14459 1 16 . 1 1 163 163 ASN H H 163 7.700 7.700 8.533 -0.833 25768 14460 1 16 . 1 1 164 164 MET N N 164 119.950 119.950 118.509 1.441 25768 14461 1 16 . 1 1 164 164 MET C C 164 172.830 172.830 174.534 -1.704 25768 14462 1 16 . 1 1 164 164 MET CA C 164 55.180 55.180 54.499 0.681 25768 14463 1 16 . 1 1 164 164 MET CB C 164 37.770 37.770 36.229 1.541 25768 14464 1 16 . 1 1 164 164 MET H H 164 7.070 7.070 8.862 -1.792 25768 14465 1 16 . 1 1 165 165 ALA N N 165 120.600 120.600 122.302 -1.702 25768 14466 1 16 . 1 1 165 165 ALA C C 165 174.240 174.240 174.631 -0.391 25768 14467 1 16 . 1 1 165 165 ALA CA C 165 51.630 51.630 51.533 0.097 25768 14468 1 16 . 1 1 165 165 ALA CB C 165 22.330 22.330 22.783 -0.453 25768 14469 1 16 . 1 1 165 165 ALA H H 165 8.290 8.290 9.272 -0.982 25768 14470 1 16 . 1 1 166 166 VAL N N 166 117.900 117.900 119.866 -1.966 25768 14471 1 16 . 1 1 166 166 VAL C C 166 172.950 172.950 173.475 -0.525 25768 14472 1 16 . 1 1 166 166 VAL CA C 166 59.710 59.710 60.707 -0.997 25768 14473 1 16 . 1 1 166 166 VAL CB C 166 35.290 35.290 36.156 -0.866 25768 14474 1 16 . 1 1 166 166 VAL H H 166 8.720 8.720 9.113 -0.393 25768 14475 1 16 . 1 1 171 171 ILE C C 171 175.750 175.750 176.098 -0.348 25768 14476 1 16 . 1 1 171 171 ILE CA C 171 61.720 61.720 60.643 1.077 25768 14477 1 16 . 1 1 171 171 ILE CB C 171 39.300 39.300 38.333 0.967 25768 14478 1 16 . 1 1 172 172 ASP N N 172 124.070 124.070 127.281 -3.211 25768 14479 1 16 . 1 1 172 172 ASP C C 172 176.590 176.590 175.520 1.070 25768 14480 1 16 . 1 1 172 172 ASP CA C 172 54.460 54.460 53.891 0.569 25768 14481 1 16 . 1 1 172 172 ASP CB C 172 41.410 41.410 42.238 -0.828 25768 14482 1 16 . 1 1 172 172 ASP H H 172 8.460 8.460 8.588 -0.128 25768 14483 1 16 . 1 1 173 173 THR N N 173 115.570 115.570 117.161 -1.591 25768 14484 1 16 . 1 1 173 173 THR C C 173 175.030 175.030 174.671 0.359 25768 14485 1 16 . 1 1 173 173 THR CA C 173 62.680 62.680 62.895 -0.215 25768 14486 1 16 . 1 1 173 173 THR CB C 173 69.840 69.840 69.802 0.038 25768 14487 1 16 . 1 1 173 173 THR H H 173 8.080 8.080 8.679 -0.599 25768 14488 1 16 . 1 1 174 174 LYS N N 174 122.680 122.680 123.038 -0.358 25768 14489 1 16 . 1 1 174 174 LYS C C 174 176.340 176.340 176.500 -0.160 25768 14490 1 16 . 1 1 174 174 LYS CA C 174 56.820 56.820 55.836 0.984 25768 14491 1 16 . 1 1 174 174 LYS CB C 174 32.790 32.790 31.907 0.883 25768 14492 1 16 . 1 1 174 174 LYS H H 174 8.180 8.180 7.909 0.271 25768 14493 1 16 . 1 1 175 175 ALA N N 175 124.050 124.050 125.009 -0.959 25768 14494 1 16 . 1 1 175 175 ALA C C 175 177.550 177.550 177.772 -0.222 25768 14495 1 16 . 1 1 175 175 ALA CA C 175 52.840 52.840 53.444 -0.604 25768 14496 1 16 . 1 1 175 175 ALA CB C 175 19.580 19.580 17.202 2.378 25768 14497 1 16 . 1 1 175 175 ALA H H 175 8.050 8.050 8.567 -0.517 25768 14498 1 16 . 1 1 176 176 SER N N 176 114.920 114.920 114.820 0.100 25768 14499 1 16 . 1 1 176 176 SER C C 176 174.240 174.240 173.452 0.788 25768 14500 1 16 . 1 1 176 176 SER CA C 176 58.390 58.390 59.331 -0.941 25768 14501 1 16 . 1 1 176 176 SER CB C 176 64.370 64.370 61.718 2.652 25768 14502 1 16 . 1 1 176 176 SER H H 176 8.070 8.070 8.518 -0.448 25768 14503 1 16 . 1 1 177 177 ILE N N 177 121.650 121.650 119.848 1.802 25768 14504 1 16 . 1 1 177 177 ILE C C 177 174.990 174.990 173.966 1.024 25768 14505 1 16 . 1 1 177 177 ILE CA C 177 61.570 61.570 60.785 0.785 25768 14506 1 16 . 1 1 177 177 ILE CB C 177 39.100 39.100 40.746 -1.646 25768 14507 1 16 . 1 1 177 177 ILE H H 177 7.960 7.960 7.677 0.283 25768 14508 1 16 . 1 1 178 178 ASN N N 178 127.040 127.040 124.986 2.054 25768 14509 1 16 . 1 1 178 178 ASN C C 178 179.160 179.160 174.791 4.369 25768 14510 1 16 . 1 1 178 178 ASN CA C 178 55.100 55.100 53.169 1.931 25768 14511 1 16 . 1 1 178 178 ASN CB C 178 41.300 41.300 38.957 2.343 25768 14512 1 16 . 1 1 178 178 ASN H H 178 7.850 7.850 8.538 -0.688 25768 14513 1 16 . 1 1 180 180 PRO C C 180 177.520 177.520 176.767 0.753 25768 14514 1 16 . 1 1 180 180 PRO CA C 180 63.980 63.980 63.835 0.145 25768 14515 1 16 . 1 1 180 180 PRO CB C 180 32.190 32.190 31.231 0.959 25768 14516 1 16 . 1 1 181 181 SER N N 181 115.600 115.600 120.488 -4.888 25768 14517 1 16 . 1 1 181 181 SER C C 181 174.710 174.710 174.189 0.521 25768 14518 1 16 . 1 1 181 181 SER CA C 181 58.900 58.900 60.597 -1.697 25768 14519 1 16 . 1 1 181 181 SER CB C 181 64.070 64.070 62.776 1.294 25768 14520 1 16 . 1 1 181 181 SER H H 181 8.260 8.260 8.657 -0.397 25768 14521 1 16 . 1 1 182 182 ALA N N 182 125.880 125.880 123.731 2.149 25768 14522 1 16 . 1 1 182 182 ALA C C 182 177.560 177.560 176.893 0.667 25768 14523 1 16 . 1 1 182 182 ALA CA C 182 53.090 53.090 52.936 0.154 25768 14524 1 16 . 1 1 182 182 ALA CB C 182 19.310 19.310 17.429 1.881 25768 14525 1 16 . 1 1 182 182 ALA H H 182 8.130 8.130 8.051 0.079 25768 14526 1 16 . 1 1 183 183 LEU N N 183 119.980 119.980 119.525 0.455 25768 14527 1 16 . 1 1 183 183 LEU C C 183 177.850 177.850 177.986 -0.136 25768 14528 1 16 . 1 1 183 183 LEU CA C 183 55.650 55.650 55.539 0.111 25768 14529 1 16 . 1 1 183 183 LEU CB C 183 42.530 42.530 41.033 1.497 25768 14530 1 16 . 1 1 183 183 LEU H H 183 7.940 7.940 8.310 -0.370 25768 14531 1 16 . 1 1 184 184 GLY N N 184 109.250 109.250 114.310 -5.060 25768 14532 1 16 . 1 1 184 184 GLY C C 184 174.250 174.250 173.748 0.502 25768 14533 1 16 . 1 1 184 184 GLY CA C 184 45.830 45.830 45.442 0.388 25768 14534 1 16 . 1 1 184 184 GLY H H 184 8.150 8.150 9.037 -0.887 25768 14535 1 16 . 1 1 185 185 VAL N N 185 118.830 118.830 120.348 -1.518 25768 14536 1 16 . 1 1 185 185 VAL C C 185 175.890 175.890 174.231 1.659 25768 14537 1 16 . 1 1 185 185 VAL CA C 185 62.740 62.740 61.736 1.004 25768 14538 1 16 . 1 1 185 185 VAL CB C 185 32.770 32.770 33.859 -1.089 25768 14539 1 16 . 1 1 185 185 VAL H H 185 7.760 7.760 7.690 0.070 25768 14540 1 16 . 1 1 186 186 ASN N N 186 121.850 121.850 126.637 -4.787 25768 14541 1 16 . 1 1 186 186 ASN C C 186 174.970 174.970 174.301 0.669 25768 14542 1 16 . 1 1 186 186 ASN CA C 186 53.590 53.590 53.163 0.427 25768 14543 1 16 . 1 1 186 186 ASN CB C 186 39.160 39.160 39.229 -0.069 25768 14544 1 16 . 1 1 186 186 ASN H H 186 8.380 8.380 8.410 -0.030 25768 14545 1 16 . 1 1 187 187 LYS N N 187 122.120 122.120 124.563 -2.443 25768 14546 1 16 . 1 1 187 187 LYS C C 187 176.490 176.490 175.590 0.900 25768 14547 1 16 . 1 1 187 187 LYS CA C 187 56.750 56.750 57.396 -0.646 25768 14548 1 16 . 1 1 187 187 LYS CB C 187 33.250 33.250 32.939 0.311 25768 14549 1 16 . 1 1 187 187 LYS H H 187 8.140 8.140 8.574 -0.434 25768 14550 1 16 . 1 1 188 188 THR N N 188 115.250 115.250 118.032 -2.782 25768 14551 1 16 . 1 1 188 188 THR C C 188 174.250 174.250 174.611 -0.361 25768 14552 1 16 . 1 1 188 188 THR CA C 188 62.360 62.360 62.706 -0.346 25768 14553 1 16 . 1 1 188 188 THR CB C 188 70.280 70.280 68.896 1.384 25768 14554 1 16 . 1 1 188 188 THR H H 188 8.100 8.100 8.532 -0.432 25768 14555 1 16 . 1 1 189 189 LYS N N 189 123.780 123.780 120.166 3.614 25768 14556 1 16 . 1 1 189 189 LYS C C 189 176.090 176.090 176.682 -0.592 25768 14557 1 16 . 1 1 189 189 LYS CA C 189 56.590 56.590 56.405 0.185 25768 14558 1 16 . 1 1 189 189 LYS CB C 189 33.350 33.350 33.248 0.102 25768 14559 1 16 . 1 1 189 189 LYS H H 189 8.110 8.110 7.987 0.123 25768 14560 1 16 . 1 1 190 190 VAL N N 190 120.920 120.920 119.732 1.188 25768 14561 1 16 . 1 1 190 190 VAL C C 190 175.590 175.590 175.607 -0.017 25768 14562 1 16 . 1 1 190 190 VAL CA C 190 62.400 62.400 62.702 -0.302 25768 14563 1 16 . 1 1 190 190 VAL CB C 190 32.990 32.990 32.003 0.987 25768 14564 1 16 . 1 1 190 190 VAL H H 190 8.040 8.040 7.680 0.360 25768 14565 1 16 . 1 1 191 191 ASP N N 191 123.790 123.790 127.430 -3.640 25768 14566 1 16 . 1 1 191 191 ASP C C 191 175.750 175.750 176.097 -0.347 25768 14567 1 16 . 1 1 191 191 ASP CA C 191 54.650 54.650 55.507 -0.857 25768 14568 1 16 . 1 1 191 191 ASP CB C 191 41.450 41.450 41.364 0.086 25768 14569 1 16 . 1 1 191 191 ASP H H 191 8.240 8.240 8.600 -0.360 25768 14570 1 16 . 1 1 192 192 VAL N N 192 118.850 118.850 117.261 1.589 25768 14571 1 16 . 1 1 192 192 VAL C C 192 175.380 175.380 175.309 0.071 25768 14572 1 16 . 1 1 192 192 VAL CA C 192 62.110 62.110 62.796 -0.686 25768 14573 1 16 . 1 1 192 192 VAL CB C 192 33.290 33.290 31.180 2.110 25768 14574 1 16 . 1 1 192 192 VAL H H 192 7.860 7.860 7.756 0.104 25768 14575 1 16 . 1 1 193 193 ASP N N 193 124.190 124.190 120.798 3.392 25768 14576 1 16 . 1 1 193 193 ASP C C 193 175.630 175.630 175.363 0.267 25768 14577 1 16 . 1 1 193 193 ASP CA C 193 54.540 54.540 54.778 -0.238 25768 14578 1 16 . 1 1 193 193 ASP CB C 193 41.410 41.410 40.878 0.532 25768 14579 1 16 . 1 1 193 193 ASP H H 193 8.310 8.310 8.533 -0.223 25768 14580 1 16 . 1 1 194 194 VAL N N 194 119.580 119.580 115.249 4.331 25768 14581 1 16 . 1 1 194 194 VAL C C 194 174.950 174.950 175.342 -0.392 25768 14582 1 16 . 1 1 194 194 VAL CA C 194 61.770 61.770 63.653 -1.883 25768 14583 1 16 . 1 1 194 194 VAL CB C 194 33.680 33.680 30.116 3.564 25768 14584 1 16 . 1 1 194 194 VAL H H 194 7.890 7.890 7.792 0.098 25768 14585 1 16 . 1 1 195 195 ASP N N 195 125.660 125.660 128.377 -2.717 25768 14586 1 16 . 1 1 195 195 ASP C C 195 174.290 174.290 174.859 -0.569 25768 14587 1 16 . 1 1 195 195 ASP CA C 195 51.940 51.940 51.548 0.392 25768 14588 1 16 . 1 1 195 195 ASP CB C 195 40.950 40.950 41.849 -0.899 25768 14589 1 16 . 1 1 195 195 ASP H H 195 8.410 8.410 8.304 0.106 25768 14590 1 16 . 1 1 198 198 VAL C C 198 173.940 173.940 175.001 -1.061 25768 14591 1 16 . 1 1 198 198 VAL CA C 198 61.270 61.270 61.176 0.094 25768 14592 1 16 . 1 1 198 198 VAL CB C 198 35.910 35.910 31.980 3.930 25768 14593 1 16 . 1 1 199 199 TYR N N 199 123.780 123.780 124.764 -0.984 25768 14594 1 16 . 1 1 199 199 TYR C C 199 174.150 174.150 174.014 0.136 25768 14595 1 16 . 1 1 199 199 TYR CA C 199 56.220 56.220 57.370 -1.150 25768 14596 1 16 . 1 1 199 199 TYR CB C 199 41.660 41.660 43.148 -1.488 25768 14597 1 16 . 1 1 199 199 TYR H H 199 8.540 8.540 8.140 0.400 25768 14598 1 16 . 1 1 200 200 MET N N 200 123.920 123.920 122.069 1.851 25768 14599 1 16 . 1 1 200 200 MET C C 200 173.810 173.810 174.227 -0.417 25768 14600 1 16 . 1 1 200 200 MET CA C 200 54.710 54.710 55.048 -0.338 25768 14601 1 16 . 1 1 200 200 MET CB C 200 37.110 37.110 34.831 2.279 25768 14602 1 16 . 1 1 200 200 MET H H 200 9.130 9.130 8.582 0.548 25768 14603 1 16 . 1 1 201 201 ILE N N 201 123.670 123.670 125.827 -2.157 25768 14604 1 16 . 1 1 201 201 ILE C C 201 174.030 174.030 173.962 0.068 25768 14605 1 16 . 1 1 201 201 ILE CA C 201 59.820 59.820 58.829 0.991 25768 14606 1 16 . 1 1 201 201 ILE CB C 201 41.720 41.720 42.492 -0.772 25768 14607 1 16 . 1 1 201 201 ILE H H 201 8.030 8.030 8.738 -0.708 25768 14608 1 16 . 1 1 202 202 GLY N N 202 112.910 112.910 113.953 -1.043 25768 14609 1 16 . 1 1 202 202 GLY C C 202 170.280 170.280 172.351 -2.071 25768 14610 1 16 . 1 1 202 202 GLY CA C 202 46.800 46.800 44.923 1.877 25768 14611 1 16 . 1 1 202 202 GLY H H 202 8.580 8.580 8.397 0.183 25768 14612 1 16 . 1 1 203 203 PHE N N 203 116.240 116.240 114.142 2.098 25768 14613 1 16 . 1 1 203 203 PHE C C 203 173.940 173.940 173.474 0.466 25768 14614 1 16 . 1 1 203 203 PHE CA C 203 55.890 55.890 55.928 -0.039 25768 14615 1 16 . 1 1 203 203 PHE CB C 203 45.060 45.060 40.401 4.660 25768 14616 1 16 . 1 1 203 203 PHE H H 203 8.620 8.620 7.631 0.989 25768 14617 1 16 . 1 1 204 204 GLY N N 204 105.610 105.610 105.816 -0.206 25768 14618 1 16 . 1 1 204 204 GLY C C 204 171.190 171.190 171.323 -0.133 25768 14619 1 16 . 1 1 204 204 GLY CA C 204 46.720 46.720 46.117 0.603 25768 14620 1 16 . 1 1 204 204 GLY H H 204 8.960 8.960 8.751 0.209 25768 14621 1 16 . 1 1 205 205 TYR N N 205 121.160 121.160 118.414 2.746 25768 14622 1 16 . 1 1 205 205 TYR C C 205 173.030 173.030 174.031 -1.001 25768 14623 1 16 . 1 1 205 205 TYR CA C 205 57.190 57.190 56.439 0.751 25768 14624 1 16 . 1 1 205 205 TYR CB C 205 44.400 44.400 43.898 0.502 25768 14625 1 16 . 1 1 205 205 TYR H H 205 9.380 9.380 8.346 1.034 25768 14626 1 16 . 1 1 206 206 LYS N N 206 126.970 126.970 122.533 4.437 25768 14627 1 16 . 1 1 206 206 LYS C C 206 174.210 174.210 175.190 -0.980 25768 14628 1 16 . 1 1 206 206 LYS CA C 206 54.770 54.770 55.733 -0.963 25768 14629 1 16 . 1 1 206 206 LYS CB C 206 34.440 34.440 32.742 1.698 25768 14630 1 16 . 1 1 206 206 LYS H H 206 8.380 8.380 8.082 0.298 25768 14631 1 16 . 1 1 207 207 PHE N N 207 126.330 126.330 125.753 0.577 25768 14632 1 16 . 1 1 207 207 PHE C C 207 175.020 175.020 174.357 0.663 25768 14633 1 16 . 1 1 207 207 PHE CA C 207 58.170 58.170 58.764 -0.594 25768 14634 1 16 . 1 1 207 207 PHE CB C 207 40.920 40.920 40.507 0.413 25768 14635 1 16 . 1 1 207 207 PHE H H 207 9.290 9.290 8.392 0.898 25768 14636 1 16 . 1 1 208 208 LEU N N 208 122.740 122.740 123.628 -0.888 25768 14637 1 16 . 1 1 208 208 LEU C C 208 176.510 176.510 175.505 1.005 25768 14638 1 16 . 1 1 208 208 LEU CA C 208 54.910 54.910 54.377 0.533 25768 14639 1 16 . 1 1 208 208 LEU CB C 208 43.830 43.830 44.442 -0.612 25768 14640 1 16 . 1 1 208 208 LEU H H 208 8.310 8.310 7.895 0.415 25768 14641 1 17 . 1 1 2 2 HIS C C 2 175.310 175.310 173.513 1.797 25768 14642 1 17 . 1 1 3 3 LYS N N 3 122.080 122.080 123.202 -1.122 25768 14643 1 17 . 1 1 3 3 LYS C C 3 173.490 173.490 174.538 -1.048 25768 14644 1 17 . 1 1 3 3 LYS CA C 3 55.050 55.050 55.474 -0.424 25768 14645 1 17 . 1 1 3 3 LYS CB C 3 35.380 35.380 35.639 -0.259 25768 14646 1 17 . 1 1 3 3 LYS H H 3 8.620 8.620 8.606 0.014 25768 14647 1 17 . 1 1 4 4 ALA N N 4 120.860 120.860 122.943 -2.083 25768 14648 1 17 . 1 1 4 4 ALA C C 4 178.190 178.190 178.110 0.080 25768 14649 1 17 . 1 1 4 4 ALA CA C 4 53.480 53.480 53.033 0.447 25768 14650 1 17 . 1 1 4 4 ALA CB C 4 18.140 18.140 17.759 0.381 25768 14651 1 17 . 1 1 4 4 ALA H H 4 8.580 8.580 8.243 0.337 25768 14652 1 17 . 1 1 5 5 GLY N N 5 112.890 112.890 112.359 0.531 25768 14653 1 17 . 1 1 5 5 GLY C C 5 173.830 173.830 173.922 -0.092 25768 14654 1 17 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.620 0.260 25768 14655 1 17 . 1 1 5 5 GLY H H 5 9.210 9.210 8.428 0.782 25768 14656 1 17 . 1 1 6 6 ASP N N 6 121.590 121.590 120.784 0.806 25768 14657 1 17 . 1 1 6 6 ASP C C 6 174.380 174.380 174.601 -0.221 25768 14658 1 17 . 1 1 6 6 ASP CA C 6 55.790 55.790 55.144 0.646 25768 14659 1 17 . 1 1 6 6 ASP CB C 6 41.760 41.760 41.490 0.270 25768 14660 1 17 . 1 1 6 6 ASP H H 6 7.620 7.620 7.592 0.028 25768 14661 1 17 . 1 1 7 7 PHE N N 7 120.860 120.860 120.684 0.176 25768 14662 1 17 . 1 1 7 7 PHE C C 7 174.050 174.050 175.199 -1.149 25768 14663 1 17 . 1 1 7 7 PHE CA C 7 56.110 56.110 58.362 -2.252 25768 14664 1 17 . 1 1 7 7 PHE CB C 7 42.550 42.550 40.206 2.344 25768 14665 1 17 . 1 1 7 7 PHE H H 7 8.250 8.250 8.594 -0.344 25768 14666 1 17 . 1 1 8 8 ILE N N 8 127.950 127.950 122.766 5.184 25768 14667 1 17 . 1 1 8 8 ILE C C 8 174.000 174.000 174.415 -0.415 25768 14668 1 17 . 1 1 8 8 ILE CA C 8 61.160 61.160 60.283 0.877 25768 14669 1 17 . 1 1 8 8 ILE CB C 8 42.660 42.660 42.208 0.452 25768 14670 1 17 . 1 1 8 8 ILE H H 8 9.230 9.230 8.170 1.060 25768 14671 1 17 . 1 1 9 9 ILE N N 9 125.380 125.380 119.529 5.851 25768 14672 1 17 . 1 1 9 9 ILE C C 9 173.630 173.630 174.292 -0.662 25768 14673 1 17 . 1 1 9 9 ILE CA C 9 59.600 59.600 59.447 0.153 25768 14674 1 17 . 1 1 9 9 ILE CB C 9 41.180 41.180 40.882 0.298 25768 14675 1 17 . 1 1 9 9 ILE H H 9 8.580 8.580 8.635 -0.055 25768 14676 1 17 . 1 1 10 10 ARG N N 10 124.950 124.950 122.581 2.369 25768 14677 1 17 . 1 1 10 10 ARG C C 10 175.030 175.030 174.559 0.471 25768 14678 1 17 . 1 1 10 10 ARG CA C 10 53.920 53.920 54.593 -0.673 25768 14679 1 17 . 1 1 10 10 ARG CB C 10 31.880 31.880 34.820 -2.940 25768 14680 1 17 . 1 1 10 10 ARG H H 10 9.230 9.230 8.815 0.415 25768 14681 1 17 . 1 1 11 11 GLY N N 11 105.650 105.650 109.398 -3.748 25768 14682 1 17 . 1 1 11 11 GLY C C 11 172.090 172.090 171.967 0.123 25768 14683 1 17 . 1 1 11 11 GLY CA C 11 44.460 44.460 43.688 0.771 25768 14684 1 17 . 1 1 11 11 GLY H H 11 8.780 8.780 8.784 -0.004 25768 14685 1 17 . 1 1 12 12 GLY N N 12 107.800 107.800 107.594 0.206 25768 14686 1 17 . 1 1 12 12 GLY C C 12 171.460 171.460 171.357 0.103 25768 14687 1 17 . 1 1 12 12 GLY CA C 12 46.630 46.630 45.127 1.503 25768 14688 1 17 . 1 1 12 12 GLY H H 12 8.510 8.510 8.449 0.061 25768 14689 1 17 . 1 1 13 13 PHE N N 13 119.900 119.900 117.669 2.231 25768 14690 1 17 . 1 1 13 13 PHE C C 13 174.190 174.190 173.882 0.308 25768 14691 1 17 . 1 1 13 13 PHE CA C 13 56.340 56.340 56.742 -0.402 25768 14692 1 17 . 1 1 13 13 PHE CB C 13 41.090 41.090 44.232 -3.142 25768 14693 1 17 . 1 1 13 13 PHE H H 13 8.610 8.610 7.961 0.649 25768 14694 1 17 . 1 1 14 14 ALA N N 14 128.030 128.030 123.612 4.418 25768 14695 1 17 . 1 1 14 14 ALA C C 14 176.560 176.560 176.454 0.106 25768 14696 1 17 . 1 1 14 14 ALA CA C 14 49.940 49.940 50.868 -0.928 25768 14697 1 17 . 1 1 14 14 ALA CB C 14 20.360 20.360 21.421 -1.061 25768 14698 1 17 . 1 1 14 14 ALA H H 14 9.220 9.220 8.944 0.276 25768 14699 1 17 . 1 1 15 15 THR N N 15 118.620 118.620 119.514 -0.894 25768 14700 1 17 . 1 1 15 15 THR CA C 15 61.440 61.440 63.431 -1.991 25768 14701 1 17 . 1 1 15 15 THR CB C 15 71.370 71.370 69.809 1.561 25768 14702 1 17 . 1 1 15 15 THR H H 15 9.220 9.220 8.132 1.088 25768 14703 1 17 . 1 1 18 18 PRO C C 18 176.690 176.690 175.214 1.476 25768 14704 1 17 . 1 1 18 18 PRO CA C 18 63.610 63.610 63.111 0.499 25768 14705 1 17 . 1 1 18 18 PRO CB C 18 32.440 32.440 30.676 1.764 25768 14706 1 17 . 1 1 19 19 ASP N N 19 120.320 120.320 120.817 -0.497 25768 14707 1 17 . 1 1 19 19 ASP C C 19 175.950 175.950 176.614 -0.664 25768 14708 1 17 . 1 1 19 19 ASP CA C 19 54.710 54.710 55.514 -0.805 25768 14709 1 17 . 1 1 19 19 ASP CB C 19 41.450 41.450 43.183 -1.733 25768 14710 1 17 . 1 1 19 19 ASP H H 19 8.330 8.330 8.362 -0.032 25768 14711 1 17 . 1 1 20 20 ASP N N 20 121.990 121.990 119.690 2.300 25768 14712 1 17 . 1 1 20 20 ASP C C 20 176.760 176.760 176.973 -0.213 25768 14713 1 17 . 1 1 20 20 ASP CA C 20 54.470 54.470 55.663 -1.193 25768 14714 1 17 . 1 1 20 20 ASP CB C 20 41.310 41.310 41.462 -0.152 25768 14715 1 17 . 1 1 20 20 ASP H H 20 8.240 8.240 8.021 0.219 25768 14716 1 17 . 1 1 21 21 SER N N 21 117.050 117.050 114.910 2.140 25768 14717 1 17 . 1 1 21 21 SER C C 21 175.170 175.170 173.952 1.218 25768 14718 1 17 . 1 1 21 21 SER CA C 21 59.490 59.490 59.220 0.270 25768 14719 1 17 . 1 1 21 21 SER CB C 21 64.080 64.080 61.358 2.722 25768 14720 1 17 . 1 1 21 21 SER H H 21 8.360 8.360 8.126 0.234 25768 14721 1 17 . 1 1 22 22 SER N N 22 117.820 117.820 118.859 -1.039 25768 14722 1 17 . 1 1 22 22 SER C C 22 174.940 174.940 174.716 0.224 25768 14723 1 17 . 1 1 22 22 SER CA C 22 59.160 59.160 58.749 0.411 25768 14724 1 17 . 1 1 22 22 SER CB C 22 64.110 64.110 64.282 -0.172 25768 14725 1 17 . 1 1 22 22 SER H H 22 8.310 8.310 8.286 0.024 25768 14726 1 17 . 1 1 23 23 SER N N 23 117.660 117.660 119.142 -1.482 25768 14727 1 17 . 1 1 23 23 SER C C 23 174.340 174.340 172.926 1.414 25768 14728 1 17 . 1 1 23 23 SER CA C 23 59.050 59.050 57.635 1.415 25768 14729 1 17 . 1 1 23 23 SER CB C 23 64.210 64.210 63.892 0.319 25768 14730 1 17 . 1 1 23 23 SER H H 23 8.120 8.120 8.061 0.059 25768 14731 1 17 . 1 1 24 24 ASP N N 24 122.590 122.590 128.172 -5.582 25768 14732 1 17 . 1 1 24 24 ASP C C 24 176.250 176.250 175.338 0.912 25768 14733 1 17 . 1 1 24 24 ASP CA C 24 54.910 54.910 54.596 0.314 25768 14734 1 17 . 1 1 24 24 ASP CB C 24 41.270 41.270 39.630 1.640 25768 14735 1 17 . 1 1 24 24 ASP H H 24 8.230 8.230 8.767 -0.537 25768 14736 1 17 . 1 1 25 25 ILE N N 25 120.650 120.650 118.424 2.226 25768 14737 1 17 . 1 1 25 25 ILE C C 25 176.190 176.190 174.975 1.215 25768 14738 1 17 . 1 1 25 25 ILE CA C 25 61.880 61.880 59.567 2.313 25768 14739 1 17 . 1 1 25 25 ILE CB C 25 38.730 38.730 39.574 -0.844 25768 14740 1 17 . 1 1 25 25 ILE H H 25 7.860 7.860 7.715 0.145 25768 14741 1 17 . 1 1 26 26 LYS N N 26 124.420 124.420 121.814 2.606 25768 14742 1 17 . 1 1 26 26 LYS C C 26 176.640 176.640 175.249 1.391 25768 14743 1 17 . 1 1 26 26 LYS CA C 26 56.520 56.520 55.939 0.581 25768 14744 1 17 . 1 1 26 26 LYS CB C 26 32.890 32.890 31.668 1.222 25768 14745 1 17 . 1 1 26 26 LYS H H 26 8.140 8.140 8.338 -0.198 25768 14746 1 17 . 1 1 27 27 LEU N N 27 123.120 123.120 120.187 2.933 25768 14747 1 17 . 1 1 27 27 LEU C C 27 177.110 177.110 175.689 1.421 25768 14748 1 17 . 1 1 27 27 LEU CA C 27 55.590 55.590 55.116 0.474 25768 14749 1 17 . 1 1 27 27 LEU CB C 27 42.500 42.500 43.729 -1.229 25768 14750 1 17 . 1 1 27 27 LEU H H 27 8.080 8.080 7.744 0.336 25768 14751 1 17 . 1 1 28 28 ASP N N 28 120.850 120.850 124.768 -3.918 25768 14752 1 17 . 1 1 28 28 ASP C C 28 176.960 176.960 176.707 0.253 25768 14753 1 17 . 1 1 28 28 ASP CA C 28 54.800 54.800 54.658 0.142 25768 14754 1 17 . 1 1 28 28 ASP CB C 28 41.380 41.380 42.024 -0.644 25768 14755 1 17 . 1 1 28 28 ASP H H 28 8.180 8.180 8.243 -0.063 25768 14756 1 17 . 1 1 29 29 GLY N N 29 109.800 109.800 109.056 0.744 25768 14757 1 17 . 1 1 29 29 GLY C C 29 174.370 174.370 173.674 0.696 25768 14758 1 17 . 1 1 29 29 GLY CA C 29 46.150 46.150 44.639 1.511 25768 14759 1 17 . 1 1 29 29 GLY H H 29 8.230 8.230 8.525 -0.295 25768 14760 1 17 . 1 1 30 30 ALA N N 30 123.880 123.880 120.604 3.276 25768 14761 1 17 . 1 1 30 30 ALA C C 30 178.040 178.040 176.237 1.803 25768 14762 1 17 . 1 1 30 30 ALA CA C 30 53.140 53.140 52.658 0.482 25768 14763 1 17 . 1 1 30 30 ALA CB C 30 19.350 19.350 17.914 1.436 25768 14764 1 17 . 1 1 30 30 ALA H H 30 8.040 8.040 8.185 -0.145 25768 14765 1 17 . 1 1 31 31 LYS N N 31 119.800 119.800 121.397 -1.597 25768 14766 1 17 . 1 1 31 31 LYS C C 31 176.770 176.770 176.856 -0.086 25768 14767 1 17 . 1 1 31 31 LYS CA C 31 56.870 56.870 56.281 0.589 25768 14768 1 17 . 1 1 31 31 LYS CB C 31 32.980 32.980 33.000 -0.020 25768 14769 1 17 . 1 1 31 31 LYS H H 31 8.060 8.060 8.349 -0.289 25768 14770 1 17 . 1 1 32 32 GLN N N 32 120.930 120.930 121.579 -0.649 25768 14771 1 17 . 1 1 32 32 GLN C C 32 176.000 176.000 175.464 0.536 25768 14772 1 17 . 1 1 32 32 GLN CA C 32 56.280 56.280 56.423 -0.143 25768 14773 1 17 . 1 1 32 32 GLN CB C 32 29.580 29.580 29.437 0.143 25768 14774 1 17 . 1 1 32 32 GLN H H 32 8.170 8.170 8.052 0.118 25768 14775 1 17 . 1 1 33 33 ARG N N 33 122.370 122.370 121.076 1.294 25768 14776 1 17 . 1 1 33 33 ARG C C 33 176.820 176.820 176.051 0.769 25768 14777 1 17 . 1 1 33 33 ARG CA C 33 56.680 56.680 55.422 1.258 25768 14778 1 17 . 1 1 33 33 ARG CB C 33 31.040 31.040 32.104 -1.064 25768 14779 1 17 . 1 1 33 33 ARG H H 33 8.270 8.270 8.633 -0.363 25768 14780 1 17 . 1 1 34 34 GLY N N 34 110.210 110.210 108.184 2.026 25768 14781 1 17 . 1 1 34 34 GLY C C 34 174.280 174.280 173.603 0.677 25768 14782 1 17 . 1 1 34 34 GLY CA C 34 45.770 45.770 44.619 1.151 25768 14783 1 17 . 1 1 34 34 GLY H H 34 8.360 8.360 8.133 0.227 25768 14784 1 17 . 1 1 35 35 THR N N 35 114.100 114.100 111.532 2.568 25768 14785 1 17 . 1 1 35 35 THR C C 35 174.550 174.550 174.227 0.323 25768 14786 1 17 . 1 1 35 35 THR CA C 35 62.140 62.140 61.583 0.557 25768 14787 1 17 . 1 1 35 35 THR CB C 35 70.330 70.330 68.935 1.395 25768 14788 1 17 . 1 1 35 35 THR H H 35 7.970 7.970 8.081 -0.111 25768 14789 1 17 . 1 1 36 36 LYS N N 36 123.850 123.850 121.683 2.167 25768 14790 1 17 . 1 1 36 36 LYS C C 36 176.040 176.040 175.837 0.203 25768 14791 1 17 . 1 1 36 36 LYS CA C 36 56.600 56.600 55.952 0.648 25768 14792 1 17 . 1 1 36 36 LYS CB C 36 33.280 33.280 33.497 -0.217 25768 14793 1 17 . 1 1 36 36 LYS H H 36 8.230 8.230 7.805 0.425 25768 14794 1 17 . 1 1 37 37 ALA N N 37 125.650 125.650 127.593 -1.943 25768 14795 1 17 . 1 1 37 37 ALA C C 37 177.570 177.570 177.100 0.470 25768 14796 1 17 . 1 1 37 37 ALA CA C 37 52.860 52.860 52.532 0.328 25768 14797 1 17 . 1 1 37 37 ALA CB C 37 19.610 19.610 19.412 0.198 25768 14798 1 17 . 1 1 37 37 ALA H H 37 8.290 8.290 8.631 -0.341 25768 14799 1 17 . 1 1 38 38 THR N N 38 113.350 113.350 111.072 2.278 25768 14800 1 17 . 1 1 38 38 THR C C 38 174.540 174.540 174.152 0.388 25768 14801 1 17 . 1 1 38 38 THR CA C 38 62.010 62.010 62.536 -0.527 25768 14802 1 17 . 1 1 38 38 THR CB C 38 70.350 70.350 69.341 1.009 25768 14803 1 17 . 1 1 38 38 THR H H 38 7.970 7.970 7.612 0.358 25768 14804 1 17 . 1 1 39 39 VAL N N 39 120.790 120.790 115.140 5.650 25768 14805 1 17 . 1 1 39 39 VAL C C 39 175.620 175.620 175.017 0.603 25768 14806 1 17 . 1 1 39 39 VAL CA C 39 62.470 62.470 62.480 -0.010 25768 14807 1 17 . 1 1 39 39 VAL CB C 39 32.940 32.940 32.739 0.201 25768 14808 1 17 . 1 1 39 39 VAL H H 39 8.020 8.020 8.039 -0.019 25768 14809 1 17 . 1 1 40 40 ASP N N 40 123.690 123.690 122.144 1.546 25768 14810 1 17 . 1 1 40 40 ASP C C 40 176.190 176.190 175.822 0.368 25768 14811 1 17 . 1 1 40 40 ASP CA C 40 54.780 54.780 53.883 0.897 25768 14812 1 17 . 1 1 40 40 ASP CB C 40 41.590 41.590 41.130 0.459 25768 14813 1 17 . 1 1 40 40 ASP H H 40 8.310 8.310 8.276 0.034 25768 14814 1 17 . 1 1 41 41 SER N N 41 115.470 115.470 118.161 -2.691 25768 14815 1 17 . 1 1 41 41 SER C C 41 174.170 174.170 174.190 -0.020 25768 14816 1 17 . 1 1 41 41 SER CA C 41 59.000 59.000 59.416 -0.416 25768 14817 1 17 . 1 1 41 41 SER CB C 41 64.420 64.420 64.397 0.022 25768 14818 1 17 . 1 1 41 41 SER H H 41 8.130 8.130 8.641 -0.511 25768 14819 1 17 . 1 1 42 42 ASP N N 42 122.430 122.430 122.138 0.292 25768 14820 1 17 . 1 1 42 42 ASP C C 42 175.740 175.740 175.228 0.512 25768 14821 1 17 . 1 1 42 42 ASP CA C 42 54.780 54.780 53.926 0.854 25768 14822 1 17 . 1 1 42 42 ASP CB C 42 41.620 41.620 41.566 0.054 25768 14823 1 17 . 1 1 42 42 ASP H H 42 8.410 8.410 8.170 0.240 25768 14824 1 17 . 1 1 43 43 THR N N 43 117.580 117.580 116.433 1.147 25768 14825 1 17 . 1 1 43 43 THR C C 43 173.630 173.630 173.102 0.528 25768 14826 1 17 . 1 1 43 43 THR CA C 43 63.120 63.120 60.984 2.136 25768 14827 1 17 . 1 1 43 43 THR CB C 43 70.650 70.650 70.389 0.260 25768 14828 1 17 . 1 1 43 43 THR H H 43 8.010 8.010 8.436 -0.426 25768 14829 1 17 . 1 1 44 44 GLN N N 44 125.420 125.420 123.777 1.643 25768 14830 1 17 . 1 1 44 44 GLN C C 44 174.080 174.080 174.129 -0.049 25768 14831 1 17 . 1 1 44 44 GLN CA C 44 55.110 55.110 54.731 0.379 25768 14832 1 17 . 1 1 44 44 GLN CB C 44 31.570 31.570 30.901 0.669 25768 14833 1 17 . 1 1 44 44 GLN H H 44 9.260 9.260 8.498 0.762 25768 14834 1 17 . 1 1 45 45 LEU N N 45 124.190 124.190 124.629 -0.439 25768 14835 1 17 . 1 1 45 45 LEU C C 45 175.970 175.970 176.802 -0.832 25768 14836 1 17 . 1 1 45 45 LEU CA C 45 54.690 54.690 55.812 -1.122 25768 14837 1 17 . 1 1 45 45 LEU CB C 45 42.270 42.270 42.569 -0.299 25768 14838 1 17 . 1 1 45 45 LEU H H 45 8.550 8.550 8.419 0.131 25768 14839 1 17 . 1 1 46 46 GLY N N 46 113.310 113.310 111.865 1.445 25768 14840 1 17 . 1 1 46 46 GLY C C 46 171.180 171.180 172.272 -1.092 25768 14841 1 17 . 1 1 46 46 GLY CA C 46 44.400 44.400 43.909 0.491 25768 14842 1 17 . 1 1 46 46 GLY H H 46 8.810 8.810 7.851 0.959 25768 14843 1 17 . 1 1 47 47 LEU N N 47 123.890 123.890 128.472 -4.582 25768 14844 1 17 . 1 1 47 47 LEU C C 47 175.400 175.400 174.721 0.679 25768 14845 1 17 . 1 1 47 47 LEU CA C 47 53.750 53.750 53.710 0.040 25768 14846 1 17 . 1 1 47 47 LEU CB C 47 46.800 46.800 44.853 1.947 25768 14847 1 17 . 1 1 47 47 LEU H H 47 8.590 8.590 7.640 0.950 25768 14848 1 17 . 1 1 48 48 THR N N 48 111.210 111.210 116.899 -5.689 25768 14849 1 17 . 1 1 48 48 THR C C 48 172.520 172.520 173.015 -0.495 25768 14850 1 17 . 1 1 48 48 THR CA C 48 58.950 58.950 60.419 -1.469 25768 14851 1 17 . 1 1 48 48 THR CB C 48 72.360 72.360 71.529 0.831 25768 14852 1 17 . 1 1 48 48 THR H H 48 8.620 8.620 9.029 -0.409 25768 14853 1 17 . 1 1 49 49 PHE N N 49 118.810 118.810 125.328 -6.518 25768 14854 1 17 . 1 1 49 49 PHE C C 49 174.700 174.700 175.596 -0.896 25768 14855 1 17 . 1 1 49 49 PHE CA C 49 55.080 55.080 56.561 -1.481 25768 14856 1 17 . 1 1 49 49 PHE CB C 49 42.360 42.360 42.433 -0.073 25768 14857 1 17 . 1 1 49 49 PHE H H 49 8.410 8.410 8.471 -0.061 25768 14858 1 17 . 1 1 50 50 THR N N 50 121.230 121.230 120.015 1.215 25768 14859 1 17 . 1 1 50 50 THR C C 50 173.250 173.250 173.648 -0.398 25768 14860 1 17 . 1 1 50 50 THR CA C 50 62.740 62.740 60.957 1.783 25768 14861 1 17 . 1 1 50 50 THR CB C 50 73.740 73.740 70.320 3.420 25768 14862 1 17 . 1 1 50 50 THR H H 50 9.330 9.330 8.486 0.844 25768 14863 1 17 . 1 1 51 51 TYR N N 51 126.010 126.010 125.915 0.095 25768 14864 1 17 . 1 1 51 51 TYR C C 51 174.850 174.850 175.409 -0.559 25768 14865 1 17 . 1 1 51 51 TYR CA C 51 56.240 56.240 56.338 -0.098 25768 14866 1 17 . 1 1 51 51 TYR CB C 51 41.630 41.630 39.383 2.247 25768 14867 1 17 . 1 1 51 51 TYR H H 51 9.150 9.150 9.472 -0.322 25768 14868 1 17 . 1 1 52 52 MET N N 52 127.390 127.390 123.485 3.905 25768 14869 1 17 . 1 1 52 52 MET C C 52 174.490 174.490 174.604 -0.114 25768 14870 1 17 . 1 1 52 52 MET CA C 52 52.450 52.450 56.689 -4.239 25768 14871 1 17 . 1 1 52 52 MET CB C 52 28.590 28.590 33.573 -4.983 25768 14872 1 17 . 1 1 52 52 MET H H 52 7.950 7.950 8.168 -0.218 25768 14873 1 17 . 1 1 53 53 PHE N N 53 123.830 123.830 126.779 -2.949 25768 14874 1 17 . 1 1 53 53 PHE C C 53 173.720 173.720 173.491 0.229 25768 14875 1 17 . 1 1 53 53 PHE CA C 53 57.110 57.110 56.796 0.314 25768 14876 1 17 . 1 1 53 53 PHE CB C 53 39.420 39.420 41.240 -1.820 25768 14877 1 17 . 1 1 53 53 PHE H H 53 7.720 7.720 8.557 -0.837 25768 14878 1 17 . 1 1 54 54 ALA N N 54 125.650 125.650 129.317 -3.667 25768 14879 1 17 . 1 1 54 54 ALA C C 54 175.020 175.020 175.986 -0.966 25768 14880 1 17 . 1 1 54 54 ALA CA C 54 50.740 50.740 52.782 -2.042 25768 14881 1 17 . 1 1 54 54 ALA CB C 54 22.700 22.700 18.480 4.220 25768 14882 1 17 . 1 1 54 54 ALA H H 54 8.360 8.360 8.071 0.289 25768 14883 1 17 . 1 1 55 55 ASP N N 55 118.790 118.790 121.285 -2.495 25768 14884 1 17 . 1 1 55 55 ASP C C 55 174.780 174.780 175.839 -1.059 25768 14885 1 17 . 1 1 55 55 ASP CA C 55 58.590 58.590 55.052 3.538 25768 14886 1 17 . 1 1 55 55 ASP CB C 55 40.430 40.430 40.740 -0.310 25768 14887 1 17 . 1 1 55 55 ASP H H 55 8.590 8.590 8.541 0.049 25768 14888 1 17 . 1 1 56 56 LYS N N 56 106.200 106.200 118.374 -12.174 25768 14889 1 17 . 1 1 56 56 LYS C C 56 174.940 174.940 175.379 -0.439 25768 14890 1 17 . 1 1 56 56 LYS CA C 56 55.260 55.260 56.788 -1.528 25768 14891 1 17 . 1 1 56 56 LYS CB C 56 34.510 34.510 35.273 -0.763 25768 14892 1 17 . 1 1 56 56 LYS H H 56 7.260 7.260 7.618 -0.358 25768 14893 1 17 . 1 1 57 57 TRP N N 57 115.680 115.680 121.948 -6.268 25768 14894 1 17 . 1 1 57 57 TRP C C 57 173.940 173.940 175.518 -1.578 25768 14895 1 17 . 1 1 57 57 TRP CA C 57 55.410 55.410 57.711 -2.300 25768 14896 1 17 . 1 1 57 57 TRP CB C 57 34.470 34.470 31.937 2.533 25768 14897 1 17 . 1 1 57 57 TRP H H 57 6.570 6.570 8.367 -1.797 25768 14898 1 17 . 1 1 58 58 GLY N N 58 107.610 107.610 110.259 -2.649 25768 14899 1 17 . 1 1 58 58 GLY C C 58 172.730 172.730 172.234 0.496 25768 14900 1 17 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.640 -0.590 25768 14901 1 17 . 1 1 58 58 GLY H H 58 9.260 9.260 8.056 1.204 25768 14902 1 17 . 1 1 59 59 VAL N N 59 118.130 118.130 117.523 0.607 25768 14903 1 17 . 1 1 59 59 VAL C C 59 173.000 173.000 174.116 -1.116 25768 14904 1 17 . 1 1 59 59 VAL CA C 59 59.950 59.950 59.754 0.196 25768 14905 1 17 . 1 1 59 59 VAL CB C 59 35.170 35.170 33.857 1.313 25768 14906 1 17 . 1 1 59 59 VAL H H 59 9.030 9.030 7.965 1.065 25768 14907 1 17 . 1 1 60 60 GLU N N 60 127.900 127.900 124.331 3.569 25768 14908 1 17 . 1 1 60 60 GLU C C 60 174.470 174.470 174.505 -0.035 25768 14909 1 17 . 1 1 60 60 GLU CA C 60 52.940 52.940 54.246 -1.306 25768 14910 1 17 . 1 1 60 60 GLU CB C 60 35.100 35.100 34.216 0.884 25768 14911 1 17 . 1 1 60 60 GLU H H 60 9.440 9.440 8.435 1.005 25768 14912 1 17 . 1 1 61 61 LEU N N 61 127.410 127.410 126.167 1.243 25768 14913 1 17 . 1 1 61 61 LEU C C 61 174.950 174.950 175.376 -0.426 25768 14914 1 17 . 1 1 61 61 LEU CA C 61 53.390 53.390 54.070 -0.680 25768 14915 1 17 . 1 1 61 61 LEU CB C 61 45.980 45.980 44.939 1.041 25768 14916 1 17 . 1 1 61 61 LEU H H 61 8.740 8.740 8.827 -0.087 25768 14917 1 17 . 1 1 62 62 VAL N N 62 125.750 125.750 120.951 4.799 25768 14918 1 17 . 1 1 62 62 VAL C C 62 173.960 173.960 173.646 0.314 25768 14919 1 17 . 1 1 62 62 VAL CA C 62 61.350 61.350 59.680 1.670 25768 14920 1 17 . 1 1 62 62 VAL CB C 62 34.740 34.740 35.480 -0.740 25768 14921 1 17 . 1 1 62 62 VAL H H 62 8.790 8.790 8.257 0.533 25768 14922 1 17 . 1 1 63 63 ALA N N 63 127.230 127.230 127.518 -0.288 25768 14923 1 17 . 1 1 63 63 ALA C C 63 173.930 173.930 174.852 -0.922 25768 14924 1 17 . 1 1 63 63 ALA CA C 63 51.140 51.140 51.657 -0.517 25768 14925 1 17 . 1 1 63 63 ALA CB C 63 22.500 22.500 21.951 0.549 25768 14926 1 17 . 1 1 63 63 ALA H H 63 8.740 8.740 8.239 0.501 25768 14927 1 17 . 1 1 64 64 ALA N N 64 120.410 120.410 122.576 -2.166 25768 14928 1 17 . 1 1 64 64 ALA C C 64 176.770 176.770 176.070 0.700 25768 14929 1 17 . 1 1 64 64 ALA CA C 64 51.420 51.420 51.689 -0.269 25768 14930 1 17 . 1 1 64 64 ALA CB C 64 22.590 22.590 22.736 -0.146 25768 14931 1 17 . 1 1 64 64 ALA H H 64 8.290 8.290 8.352 -0.062 25768 14932 1 17 . 1 1 65 65 THR N N 65 116.130 116.130 112.331 3.799 25768 14933 1 17 . 1 1 65 65 THR C C 65 171.220 171.220 172.115 -0.895 25768 14934 1 17 . 1 1 65 65 THR CA C 65 58.860 58.860 59.014 -0.154 25768 14935 1 17 . 1 1 65 65 THR CB C 65 72.020 72.020 69.206 2.814 25768 14936 1 17 . 1 1 65 65 THR H H 65 8.760 8.760 8.186 0.574 25768 14937 1 17 . 1 1 66 66 PRO C C 66 176.720 176.720 175.727 0.993 25768 14938 1 17 . 1 1 66 66 PRO CA C 66 63.610 63.610 63.199 0.411 25768 14939 1 17 . 1 1 66 66 PRO CB C 66 32.550 32.550 31.498 1.052 25768 14940 1 17 . 1 1 67 67 PHE N N 67 120.360 120.360 124.621 -4.261 25768 14941 1 17 . 1 1 67 67 PHE C C 67 175.480 175.480 174.388 1.092 25768 14942 1 17 . 1 1 67 67 PHE CA C 67 58.840 58.840 57.326 1.514 25768 14943 1 17 . 1 1 67 67 PHE CB C 67 40.170 40.170 41.937 -1.767 25768 14944 1 17 . 1 1 67 67 PHE H H 67 8.590 8.590 8.011 0.579 25768 14945 1 17 . 1 1 68 68 ASN N N 68 119.030 119.030 121.952 -2.922 25768 14946 1 17 . 1 1 68 68 ASN C C 68 174.740 174.740 174.586 0.154 25768 14947 1 17 . 1 1 68 68 ASN CA C 68 53.430 53.430 53.295 0.135 25768 14948 1 17 . 1 1 68 68 ASN CB C 68 39.420 39.420 39.349 0.071 25768 14949 1 17 . 1 1 68 68 ASN H H 68 8.340 8.340 8.445 -0.105 25768 14950 1 17 . 1 1 69 69 HIS N N 69 119.590 119.590 120.937 -1.347 25768 14951 1 17 . 1 1 69 69 HIS C C 69 174.370 174.370 174.286 0.084 25768 14952 1 17 . 1 1 69 69 HIS CA C 69 55.950 55.950 56.822 -0.872 25768 14953 1 17 . 1 1 69 69 HIS CB C 69 29.960 29.960 28.141 1.819 25768 14954 1 17 . 1 1 69 69 HIS H H 69 8.350 8.350 8.126 0.224 25768 14955 1 17 . 1 1 70 70 GLN N N 70 121.980 121.980 123.727 -1.747 25768 14956 1 17 . 1 1 70 70 GLN C C 70 175.740 175.740 175.086 0.654 25768 14957 1 17 . 1 1 70 70 GLN CA C 70 56.340 56.340 55.126 1.214 25768 14958 1 17 . 1 1 70 70 GLN CB C 70 29.660 29.660 31.299 -1.639 25768 14959 1 17 . 1 1 70 70 GLN H H 70 8.350 8.350 8.321 0.029 25768 14960 1 17 . 1 1 71 71 VAL N N 71 120.530 120.530 124.244 -3.714 25768 14961 1 17 . 1 1 71 71 VAL C C 71 175.500 175.500 175.074 0.426 25768 14962 1 17 . 1 1 71 71 VAL CA C 71 62.540 62.540 62.906 -0.366 25768 14963 1 17 . 1 1 71 71 VAL CB C 71 33.090 33.090 31.704 1.386 25768 14964 1 17 . 1 1 71 71 VAL H H 71 8.020 8.020 8.643 -0.623 25768 14965 1 17 . 1 1 72 72 ASP N N 72 123.910 123.910 125.427 -1.517 25768 14966 1 17 . 1 1 72 72 ASP C C 72 176.300 176.300 176.272 0.028 25768 14967 1 17 . 1 1 72 72 ASP CA C 72 54.340 54.340 54.776 -0.436 25768 14968 1 17 . 1 1 72 72 ASP CB C 72 41.480 41.480 41.755 -0.275 25768 14969 1 17 . 1 1 72 72 ASP H H 72 8.280 8.280 8.391 -0.111 25768 14970 1 17 . 1 1 73 73 VAL N N 73 120.580 120.580 115.492 5.088 25768 14971 1 17 . 1 1 73 73 VAL C C 73 176.350 176.350 174.705 1.645 25768 14972 1 17 . 1 1 73 73 VAL CA C 73 62.970 62.970 61.966 1.004 25768 14973 1 17 . 1 1 73 73 VAL CB C 73 32.550 32.550 33.008 -0.459 25768 14974 1 17 . 1 1 73 73 VAL H H 73 7.960 7.960 7.677 0.283 25768 14975 1 17 . 1 1 74 74 LYS N N 74 123.620 123.620 123.022 0.598 25768 14976 1 17 . 1 1 74 74 LYS C C 74 177.130 177.130 177.192 -0.062 25768 14977 1 17 . 1 1 74 74 LYS CA C 74 57.060 57.060 56.713 0.347 25768 14978 1 17 . 1 1 74 74 LYS CB C 74 32.860 32.860 31.967 0.893 25768 14979 1 17 . 1 1 74 74 LYS H H 74 8.230 8.230 8.236 -0.006 25768 14980 1 17 . 1 1 75 75 GLY N N 75 109.370 109.370 112.628 -3.258 25768 14981 1 17 . 1 1 75 75 GLY C C 75 174.030 174.030 173.946 0.084 25768 14982 1 17 . 1 1 75 75 GLY CA C 75 45.800 45.800 45.626 0.174 25768 14983 1 17 . 1 1 75 75 GLY H H 75 8.160 8.160 8.502 -0.342 25768 14984 1 17 . 1 1 76 76 LEU N N 76 121.660 121.660 120.273 1.387 25768 14985 1 17 . 1 1 76 76 LEU C C 76 177.410 177.410 175.927 1.483 25768 14986 1 17 . 1 1 76 76 LEU CA C 76 55.410 55.410 54.891 0.519 25768 14987 1 17 . 1 1 76 76 LEU CB C 76 42.790 42.790 42.881 -0.091 25768 14988 1 17 . 1 1 76 76 LEU H H 76 8.030 8.030 7.858 0.172 25768 14989 1 17 . 1 1 77 77 GLY N N 77 109.330 109.330 109.770 -0.440 25768 14990 1 17 . 1 1 77 77 GLY C C 77 171.800 171.800 171.923 -0.123 25768 14991 1 17 . 1 1 77 77 GLY CA C 77 44.990 44.990 43.962 1.028 25768 14992 1 17 . 1 1 77 77 GLY H H 77 8.100 8.100 8.160 -0.060 25768 14993 1 17 . 1 1 78 78 PRO C C 78 177.740 177.740 176.562 1.178 25768 14994 1 17 . 1 1 78 78 PRO CA C 78 63.890 63.890 62.353 1.537 25768 14995 1 17 . 1 1 78 78 PRO CB C 78 32.170 32.170 32.494 -0.324 25768 14996 1 17 . 1 1 79 79 GLY N N 79 109.530 109.530 107.029 2.501 25768 14997 1 17 . 1 1 79 79 GLY C C 79 174.460 174.460 174.062 0.398 25768 14998 1 17 . 1 1 79 79 GLY CA C 79 45.780 45.780 44.638 1.142 25768 14999 1 17 . 1 1 79 79 GLY H H 79 8.410 8.410 8.550 -0.140 25768 15000 1 17 . 1 1 80 80 LEU N N 80 121.880 121.880 121.790 0.090 25768 15001 1 17 . 1 1 80 80 LEU C C 80 177.100 177.100 176.783 0.317 25768 15002 1 17 . 1 1 80 80 LEU CA C 80 55.720 55.720 54.710 1.010 25768 15003 1 17 . 1 1 80 80 LEU CB C 80 42.580 42.580 42.735 -0.155 25768 15004 1 17 . 1 1 80 80 LEU H H 80 8.010 8.010 7.874 0.136 25768 15005 1 17 . 1 1 81 81 ASP N N 81 119.990 119.990 119.111 0.879 25768 15006 1 17 . 1 1 81 81 ASP C C 81 176.880 176.880 175.963 0.917 25768 15007 1 17 . 1 1 81 81 ASP CA C 81 54.770 54.770 53.548 1.222 25768 15008 1 17 . 1 1 81 81 ASP CB C 81 41.390 41.390 42.392 -1.002 25768 15009 1 17 . 1 1 81 81 ASP H H 81 8.220 8.220 8.327 -0.107 25768 15010 1 17 . 1 1 82 82 GLY N N 82 109.270 109.270 108.453 0.817 25768 15011 1 17 . 1 1 82 82 GLY C C 82 174.190 174.190 173.714 0.476 25768 15012 1 17 . 1 1 82 82 GLY CA C 82 45.990 45.990 44.756 1.234 25768 15013 1 17 . 1 1 82 82 GLY H H 82 8.170 8.170 8.425 -0.255 25768 15014 1 17 . 1 1 83 83 LYS N N 83 121.000 121.000 121.003 -0.003 25768 15015 1 17 . 1 1 83 83 LYS C C 83 176.610 176.610 175.345 1.265 25768 15016 1 17 . 1 1 83 83 LYS CA C 83 56.620 56.620 56.117 0.502 25768 15017 1 17 . 1 1 83 83 LYS CB C 83 33.020 33.020 32.971 0.049 25768 15018 1 17 . 1 1 83 83 LYS H H 83 7.970 7.970 8.043 -0.073 25768 15019 1 17 . 1 1 84 84 LEU N N 84 123.120 123.120 121.768 1.352 25768 15020 1 17 . 1 1 84 84 LEU C C 84 176.920 176.920 175.225 1.695 25768 15021 1 17 . 1 1 84 84 LEU CA C 84 55.550 55.550 54.553 0.997 25768 15022 1 17 . 1 1 84 84 LEU CB C 84 42.430 42.430 41.292 1.138 25768 15023 1 17 . 1 1 84 84 LEU H H 84 8.130 8.130 8.411 -0.281 25768 15024 1 17 . 1 1 85 85 ALA N N 85 123.930 123.930 125.268 -1.338 25768 15025 1 17 . 1 1 85 85 ALA C C 85 177.060 177.060 177.365 -0.305 25768 15026 1 17 . 1 1 85 85 ALA CA C 85 52.790 52.790 51.946 0.844 25768 15027 1 17 . 1 1 85 85 ALA CB C 85 19.670 19.670 20.912 -1.242 25768 15028 1 17 . 1 1 85 85 ALA H H 85 8.040 8.040 8.041 -0.001 25768 15029 1 17 . 1 1 86 86 ASP N N 86 119.760 119.760 122.285 -2.525 25768 15030 1 17 . 1 1 86 86 ASP C C 86 175.820 175.820 176.296 -0.476 25768 15031 1 17 . 1 1 86 86 ASP CA C 86 54.520 54.520 54.052 0.468 25768 15032 1 17 . 1 1 86 86 ASP CB C 86 41.390 41.390 41.026 0.364 25768 15033 1 17 . 1 1 86 86 ASP H H 86 8.110 8.110 8.564 -0.454 25768 15034 1 17 . 1 1 87 87 ILE N N 87 120.620 120.620 116.756 3.864 25768 15035 1 17 . 1 1 87 87 ILE C C 87 175.740 175.740 175.501 0.239 25768 15036 1 17 . 1 1 87 87 ILE CA C 87 61.160 61.160 61.286 -0.126 25768 15037 1 17 . 1 1 87 87 ILE CB C 87 39.260 39.260 38.696 0.564 25768 15038 1 17 . 1 1 87 87 ILE H H 87 7.800 7.800 7.519 0.281 25768 15039 1 17 . 1 1 88 88 LYS N N 88 125.820 125.820 124.229 1.591 25768 15040 1 17 . 1 1 88 88 LYS C C 88 175.340 175.340 175.712 -0.372 25768 15041 1 17 . 1 1 88 88 LYS CA C 88 56.300 56.300 55.313 0.987 25768 15042 1 17 . 1 1 88 88 LYS CB C 88 32.900 32.900 34.678 -1.778 25768 15043 1 17 . 1 1 88 88 LYS H H 88 8.250 8.250 8.248 0.002 25768 15044 1 17 . 1 1 89 89 GLN N N 89 121.750 121.750 120.178 1.572 25768 15045 1 17 . 1 1 89 89 GLN C C 89 175.000 175.000 176.000 -1.000 25768 15046 1 17 . 1 1 89 89 GLN CA C 89 55.210 55.210 55.256 -0.046 25768 15047 1 17 . 1 1 89 89 GLN CB C 89 30.570 30.570 29.224 1.346 25768 15048 1 17 . 1 1 89 89 GLN H H 89 8.000 8.000 8.235 -0.235 25768 15049 1 17 . 1 1 90 90 LEU N N 90 126.660 126.660 121.618 5.042 25768 15050 1 17 . 1 1 90 90 LEU C C 90 174.240 174.240 175.623 -1.383 25768 15051 1 17 . 1 1 90 90 LEU CA C 90 52.720 52.720 54.172 -1.452 25768 15052 1 17 . 1 1 90 90 LEU CB C 90 42.350 42.350 41.444 0.906 25768 15053 1 17 . 1 1 90 90 LEU H H 90 8.630 8.630 8.561 0.069 25768 15054 1 17 . 1 1 92 92 PRO C C 92 173.900 173.900 176.390 -2.490 25768 15055 1 17 . 1 1 92 92 PRO CA C 92 63.320 63.320 62.948 0.372 25768 15056 1 17 . 1 1 92 92 PRO CB C 92 31.920 31.920 32.407 -0.488 25768 15057 1 17 . 1 1 93 93 THR N N 93 119.770 119.770 121.050 -1.280 25768 15058 1 17 . 1 1 93 93 THR C C 93 171.360 171.360 173.401 -2.041 25768 15059 1 17 . 1 1 93 93 THR CA C 93 62.610 62.610 61.944 0.666 25768 15060 1 17 . 1 1 93 93 THR CB C 93 72.680 72.680 70.233 2.447 25768 15061 1 17 . 1 1 93 93 THR H H 93 8.290 8.290 8.315 -0.025 25768 15062 1 17 . 1 1 94 94 LEU N N 94 128.880 128.880 125.063 3.817 25768 15063 1 17 . 1 1 94 94 LEU C C 94 175.130 175.130 174.932 0.198 25768 15064 1 17 . 1 1 94 94 LEU CA C 94 53.520 53.520 53.901 -0.381 25768 15065 1 17 . 1 1 94 94 LEU CB C 94 46.140 46.140 43.827 2.313 25768 15066 1 17 . 1 1 94 94 LEU H H 94 8.680 8.680 8.569 0.111 25768 15067 1 17 . 1 1 95 95 LEU N N 95 123.630 123.630 118.972 4.658 25768 15068 1 17 . 1 1 95 95 LEU C C 95 175.540 175.540 174.847 0.693 25768 15069 1 17 . 1 1 95 95 LEU CA C 95 55.190 55.190 54.300 0.890 25768 15070 1 17 . 1 1 95 95 LEU CB C 95 45.300 45.300 45.648 -0.348 25768 15071 1 17 . 1 1 95 95 LEU H H 95 9.580 9.580 7.946 1.634 25768 15072 1 17 . 1 1 96 96 LEU N N 96 123.150 123.150 123.308 -0.158 25768 15073 1 17 . 1 1 96 96 LEU C C 96 174.960 174.960 175.117 -0.157 25768 15074 1 17 . 1 1 96 96 LEU CA C 96 54.420 54.420 54.720 -0.300 25768 15075 1 17 . 1 1 96 96 LEU CB C 96 44.560 44.560 43.526 1.034 25768 15076 1 17 . 1 1 96 96 LEU H H 96 8.770 8.770 8.175 0.595 25768 15077 1 17 . 1 1 97 97 GLN N N 97 121.290 121.290 121.356 -0.066 25768 15078 1 17 . 1 1 97 97 GLN C C 97 174.380 174.380 173.793 0.587 25768 15079 1 17 . 1 1 97 97 GLN CA C 97 54.740 54.740 54.857 -0.117 25768 15080 1 17 . 1 1 97 97 GLN CB C 97 36.600 36.600 32.875 3.725 25768 15081 1 17 . 1 1 97 97 GLN H H 97 9.480 9.480 7.868 1.612 25768 15082 1 17 . 1 1 98 98 TYR N N 98 122.250 122.250 119.141 3.109 25768 15083 1 17 . 1 1 98 98 TYR C C 98 173.460 173.460 174.792 -1.332 25768 15084 1 17 . 1 1 98 98 TYR CA C 98 55.160 55.160 54.580 0.580 25768 15085 1 17 . 1 1 98 98 TYR CB C 98 42.420 42.420 40.235 2.185 25768 15086 1 17 . 1 1 98 98 TYR H H 98 9.010 9.010 8.776 0.234 25768 15087 1 17 . 1 1 99 99 TYR N N 99 126.860 126.860 125.518 1.342 25768 15088 1 17 . 1 1 99 99 TYR C C 99 175.380 175.380 176.142 -0.762 25768 15089 1 17 . 1 1 99 99 TYR CA C 99 54.220 54.220 58.621 -4.401 25768 15090 1 17 . 1 1 99 99 TYR CB C 99 38.890 38.890 37.418 1.472 25768 15091 1 17 . 1 1 99 99 TYR H H 99 8.300 8.300 8.259 0.041 25768 15092 1 17 . 1 1 100 100 PRO C C 100 178.330 178.330 177.029 1.301 25768 15093 1 17 . 1 1 100 100 PRO CA C 100 64.750 64.750 65.409 -0.659 25768 15094 1 17 . 1 1 100 100 PRO CB C 100 32.130 32.130 31.919 0.211 25768 15095 1 17 . 1 1 101 101 MET N N 101 114.520 114.520 116.570 -2.050 25768 15096 1 17 . 1 1 101 101 MET C C 101 178.240 178.240 175.890 2.350 25768 15097 1 17 . 1 1 101 101 MET CA C 101 53.500 53.500 54.499 -0.999 25768 15098 1 17 . 1 1 101 101 MET CB C 101 30.160 30.160 33.096 -2.936 25768 15099 1 17 . 1 1 101 101 MET H H 101 9.390 9.390 8.066 1.324 25768 15100 1 17 . 1 1 102 102 GLY N N 102 117.500 117.500 108.596 8.904 25768 15101 1 17 . 1 1 102 102 GLY C C 102 175.690 175.690 174.589 1.101 25768 15102 1 17 . 1 1 102 102 GLY CA C 102 46.760 46.760 45.872 0.888 25768 15103 1 17 . 1 1 102 102 GLY H H 102 8.640 8.640 7.615 1.025 25768 15104 1 17 . 1 1 103 103 GLY N N 103 111.030 111.030 111.589 -0.559 25768 15105 1 17 . 1 1 103 103 GLY C C 103 174.070 174.070 173.482 0.588 25768 15106 1 17 . 1 1 103 103 GLY CA C 103 46.140 46.140 45.264 0.876 25768 15107 1 17 . 1 1 103 103 GLY H H 103 9.390 9.390 8.057 1.333 25768 15108 1 17 . 1 1 104 104 THR N N 104 109.290 109.290 113.191 -3.901 25768 15109 1 17 . 1 1 104 104 THR C C 104 174.290 174.290 174.545 -0.255 25768 15110 1 17 . 1 1 104 104 THR CA C 104 60.900 60.900 59.551 1.349 25768 15111 1 17 . 1 1 104 104 THR CB C 104 72.070 72.070 70.693 1.377 25768 15112 1 17 . 1 1 104 104 THR H H 104 7.290 7.290 7.675 -0.385 25768 15113 1 17 . 1 1 105 105 ASN C C 105 175.050 175.050 175.141 -0.091 25768 15114 1 17 . 1 1 105 105 ASN CA C 105 52.880 52.880 53.240 -0.360 25768 15115 1 17 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.359 -0.100 25768 15116 1 17 . 1 1 106 106 SER N N 106 113.000 113.000 115.694 -2.694 25768 15117 1 17 . 1 1 106 106 SER C C 106 176.000 176.000 175.366 0.634 25768 15118 1 17 . 1 1 106 106 SER CA C 106 58.700 58.700 58.212 0.488 25768 15119 1 17 . 1 1 106 106 SER CB C 106 64.540 64.540 64.303 0.237 25768 15120 1 17 . 1 1 106 106 SER H H 106 7.450 7.450 7.628 -0.178 25768 15121 1 17 . 1 1 107 107 ALA N N 107 132.220 132.220 127.816 4.404 25768 15122 1 17 . 1 1 107 107 ALA C C 107 176.610 176.610 177.605 -0.995 25768 15123 1 17 . 1 1 107 107 ALA CA C 107 54.380 54.380 52.539 1.841 25768 15124 1 17 . 1 1 107 107 ALA CB C 107 18.690 18.690 19.169 -0.479 25768 15125 1 17 . 1 1 107 107 ALA H H 107 8.870 8.870 8.514 0.356 25768 15126 1 17 . 1 1 108 108 PHE N N 108 116.050 116.050 119.601 -3.551 25768 15127 1 17 . 1 1 108 108 PHE C C 108 174.270 174.270 175.093 -0.823 25768 15128 1 17 . 1 1 108 108 PHE CA C 108 56.140 56.140 58.031 -1.891 25768 15129 1 17 . 1 1 108 108 PHE CB C 108 40.520 40.520 39.870 0.650 25768 15130 1 17 . 1 1 108 108 PHE H H 108 7.550 7.550 7.566 -0.016 25768 15131 1 17 . 1 1 109 109 GLN N N 109 128.260 128.260 126.559 1.701 25768 15132 1 17 . 1 1 109 109 GLN C C 109 172.300 172.300 174.156 -1.856 25768 15133 1 17 . 1 1 109 109 GLN CA C 109 52.310 52.310 52.159 0.151 25768 15134 1 17 . 1 1 109 109 GLN CB C 109 29.050 29.050 30.411 -1.361 25768 15135 1 17 . 1 1 109 109 GLN H H 109 9.060 9.060 8.667 0.393 25768 15136 1 17 . 1 1 110 110 PRO C C 110 175.020 175.020 175.921 -0.901 25768 15137 1 17 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.291 -0.742 25768 15138 1 17 . 1 1 110 110 PRO CB C 110 33.280 33.280 32.303 0.976 25768 15139 1 17 . 1 1 111 111 TYR N N 111 115.730 115.730 113.554 2.176 25768 15140 1 17 . 1 1 111 111 TYR C C 111 173.850 173.850 172.830 1.020 25768 15141 1 17 . 1 1 111 111 TYR CA C 111 56.470 56.470 56.456 0.014 25768 15142 1 17 . 1 1 111 111 TYR CB C 111 38.650 38.650 39.975 -1.325 25768 15143 1 17 . 1 1 111 111 TYR H H 111 8.500 8.500 7.756 0.744 25768 15144 1 17 . 1 1 112 112 GLY N N 112 103.570 103.570 106.744 -3.174 25768 15145 1 17 . 1 1 112 112 GLY C C 112 172.020 172.020 171.708 0.312 25768 15146 1 17 . 1 1 112 112 GLY CA C 112 43.950 43.950 43.388 0.562 25768 15147 1 17 . 1 1 112 112 GLY H H 112 8.110 8.110 7.676 0.434 25768 15148 1 17 . 1 1 113 113 GLY N N 113 108.510 108.510 106.213 2.297 25768 15149 1 17 . 1 1 113 113 GLY C C 113 171.540 171.540 171.900 -0.360 25768 15150 1 17 . 1 1 113 113 GLY CA C 113 46.120 46.120 45.902 0.218 25768 15151 1 17 . 1 1 113 113 GLY H H 113 9.080 9.080 7.754 1.326 25768 15152 1 17 . 1 1 114 114 LEU N N 114 120.270 120.270 118.775 1.495 25768 15153 1 17 . 1 1 114 114 LEU C C 114 175.810 175.810 175.594 0.216 25768 15154 1 17 . 1 1 114 114 LEU CA C 114 53.920 53.920 54.258 -0.338 25768 15155 1 17 . 1 1 114 114 LEU CB C 114 47.940 47.940 46.823 1.117 25768 15156 1 17 . 1 1 114 114 LEU H H 114 8.620 8.620 7.922 0.698 25768 15157 1 17 . 1 1 115 115 GLY N N 115 110.620 110.620 106.533 4.087 25768 15158 1 17 . 1 1 115 115 GLY C C 115 171.560 171.560 172.404 -0.844 25768 15159 1 17 . 1 1 115 115 GLY CA C 115 46.940 46.940 45.268 1.672 25768 15160 1 17 . 1 1 115 115 GLY H H 115 9.000 9.000 7.746 1.254 25768 15161 1 17 . 1 1 116 116 VAL N N 116 113.600 113.600 117.288 -3.688 25768 15162 1 17 . 1 1 116 116 VAL C C 116 174.120 174.120 174.608 -0.488 25768 15163 1 17 . 1 1 116 116 VAL CA C 116 58.970 58.970 59.374 -0.404 25768 15164 1 17 . 1 1 116 116 VAL CB C 116 36.600 36.600 34.255 2.345 25768 15165 1 17 . 1 1 116 116 VAL H H 116 8.680 8.680 7.676 1.004 25768 15166 1 17 . 1 1 117 117 ASN N N 117 120.020 120.020 122.085 -2.065 25768 15167 1 17 . 1 1 117 117 ASN CA C 117 52.190 52.190 52.812 -0.622 25768 15168 1 17 . 1 1 117 117 ASN CB C 117 42.450 42.450 41.497 0.953 25768 15169 1 17 . 1 1 117 117 ASN H H 117 8.840 8.840 8.474 0.366 25768 15170 1 17 . 1 1 119 119 THR C C 119 174.350 174.350 173.881 0.469 25768 15171 1 17 . 1 1 119 119 THR CA C 119 63.140 63.140 61.101 2.039 25768 15172 1 17 . 1 1 119 119 THR CB C 119 70.170 70.170 70.736 -0.566 25768 15173 1 17 . 1 1 120 120 THR N N 120 114.120 114.120 116.842 -2.722 25768 15174 1 17 . 1 1 120 120 THR C C 120 174.220 174.220 173.745 0.475 25768 15175 1 17 . 1 1 120 120 THR CA C 120 61.900 61.900 61.800 0.100 25768 15176 1 17 . 1 1 120 120 THR CB C 120 70.140 70.140 68.600 1.540 25768 15177 1 17 . 1 1 120 120 THR H H 120 7.570 7.570 8.309 -0.739 25768 15178 1 17 . 1 1 121 121 PHE N N 121 121.230 121.230 124.068 -2.838 25768 15179 1 17 . 1 1 121 121 PHE C C 121 174.910 174.910 175.635 -0.725 25768 15180 1 17 . 1 1 121 121 PHE CA C 121 58.720 58.720 57.220 1.500 25768 15181 1 17 . 1 1 121 121 PHE CB C 121 40.470 40.470 39.856 0.614 25768 15182 1 17 . 1 1 121 121 PHE H H 121 7.830 7.830 8.609 -0.779 25768 15183 1 17 . 1 1 122 122 PHE C C 122 175.070 175.070 175.778 -0.708 25768 15184 1 17 . 1 1 122 122 PHE CA C 122 57.890 57.890 58.459 -0.569 25768 15185 1 17 . 1 1 122 122 PHE CB C 122 39.870 39.870 39.853 0.017 25768 15186 1 17 . 1 1 123 123 ASP N N 123 122.170 122.170 126.528 -4.358 25768 15187 1 17 . 1 1 123 123 ASP C C 123 176.150 176.150 176.823 -0.673 25768 15188 1 17 . 1 1 123 123 ASP CA C 123 54.530 54.530 53.923 0.607 25768 15189 1 17 . 1 1 123 123 ASP CB C 123 41.830 41.830 41.235 0.595 25768 15190 1 17 . 1 1 123 123 ASP H H 123 7.950 7.950 8.630 -0.680 25768 15191 1 17 . 1 1 124 124 GLU N N 124 122.690 122.690 119.053 3.637 25768 15192 1 17 . 1 1 124 124 GLU C C 124 176.630 176.630 177.623 -0.993 25768 15193 1 17 . 1 1 124 124 GLU CA C 124 57.620 57.620 57.798 -0.178 25768 15194 1 17 . 1 1 124 124 GLU CB C 124 30.450 30.450 30.361 0.089 25768 15195 1 17 . 1 1 124 124 GLU H H 124 8.340 8.340 8.432 -0.092 25768 15196 1 17 . 1 1 125 125 ASP N N 125 121.280 121.280 120.753 0.527 25768 15197 1 17 . 1 1 125 125 ASP C C 125 176.940 176.940 177.875 -0.935 25768 15198 1 17 . 1 1 125 125 ASP CA C 125 55.180 55.180 57.090 -1.910 25768 15199 1 17 . 1 1 125 125 ASP CB C 125 41.220 41.220 41.004 0.216 25768 15200 1 17 . 1 1 125 125 ASP H H 125 8.310 8.310 8.202 0.108 25768 15201 1 17 . 1 1 126 126 LEU N N 126 122.830 122.830 119.638 3.192 25768 15202 1 17 . 1 1 126 126 LEU C C 126 178.020 178.020 178.085 -0.065 25768 15203 1 17 . 1 1 126 126 LEU CA C 126 56.450 56.450 57.004 -0.554 25768 15204 1 17 . 1 1 126 126 LEU CB C 126 42.150 42.150 41.361 0.789 25768 15205 1 17 . 1 1 126 126 LEU H H 126 8.010 8.010 8.431 -0.421 25768 15206 1 17 . 1 1 127 127 ALA N N 127 122.660 122.660 119.593 3.067 25768 15207 1 17 . 1 1 127 127 ALA C C 127 178.600 178.600 177.881 0.719 25768 15208 1 17 . 1 1 127 127 ALA CA C 127 53.780 53.780 52.880 0.900 25768 15209 1 17 . 1 1 127 127 ALA CB C 127 19.000 19.000 19.256 -0.256 25768 15210 1 17 . 1 1 127 127 ALA H H 127 8.100 8.100 7.942 0.158 25768 15211 1 17 . 1 1 128 128 SER N N 128 113.740 113.740 113.528 0.212 25768 15212 1 17 . 1 1 128 128 SER C C 128 175.010 175.010 173.595 1.415 25768 15213 1 17 . 1 1 128 128 SER CA C 128 59.580 59.580 57.204 2.376 25768 15214 1 17 . 1 1 128 128 SER CB C 128 63.800 63.800 64.381 -0.581 25768 15215 1 17 . 1 1 128 128 SER H H 128 7.920 7.920 7.771 0.149 25768 15216 1 17 . 1 1 129 129 ASN N N 129 120.300 120.300 119.992 0.308 25768 15217 1 17 . 1 1 129 129 ASN C C 129 175.590 175.590 174.097 1.493 25768 15218 1 17 . 1 1 129 129 ASN CA C 129 54.180 54.180 53.003 1.177 25768 15219 1 17 . 1 1 129 129 ASN CB C 129 38.900 38.900 38.912 -0.012 25768 15220 1 17 . 1 1 129 129 ASN H H 129 8.120 8.120 8.760 -0.640 25768 15221 1 17 . 1 1 130 130 ARG N N 130 120.630 120.630 122.553 -1.923 25768 15222 1 17 . 1 1 130 130 ARG C C 130 176.720 176.720 174.074 2.646 25768 15223 1 17 . 1 1 130 130 ARG CA C 130 57.240 57.240 56.039 1.201 25768 15224 1 17 . 1 1 130 130 ARG CB C 130 30.500 30.500 32.916 -2.416 25768 15225 1 17 . 1 1 130 130 ARG H H 130 8.050 8.050 8.442 -0.392 25768 15226 1 17 . 1 1 131 131 LYS N N 131 121.150 121.150 122.900 -1.750 25768 15227 1 17 . 1 1 131 131 LYS C C 131 176.750 176.750 175.644 1.106 25768 15228 1 17 . 1 1 131 131 LYS CA C 131 57.050 57.050 55.372 1.678 25768 15229 1 17 . 1 1 131 131 LYS CB C 131 32.870 32.870 33.634 -0.764 25768 15230 1 17 . 1 1 131 131 LYS H H 131 8.020 8.020 8.351 -0.331 25768 15231 1 17 . 1 1 132 132 ALA N N 132 124.110 124.110 125.105 -0.995 25768 15232 1 17 . 1 1 132 132 ALA C C 132 177.680 177.680 177.245 0.435 25768 15233 1 17 . 1 1 132 132 ALA CA C 132 53.070 53.070 53.021 0.049 25768 15234 1 17 . 1 1 132 132 ALA CB C 132 19.250 19.250 19.121 0.129 25768 15235 1 17 . 1 1 132 132 ALA H H 132 8.010 8.010 8.552 -0.542 25768 15236 1 17 . 1 1 133 133 GLN N N 133 118.830 118.830 119.313 -0.483 25768 15237 1 17 . 1 1 133 133 GLN C C 133 176.380 176.380 176.621 -0.241 25768 15238 1 17 . 1 1 133 133 GLN CA C 133 56.400 56.400 55.836 0.564 25768 15239 1 17 . 1 1 133 133 GLN CB C 133 29.670 29.670 29.710 -0.040 25768 15240 1 17 . 1 1 133 133 GLN H H 133 8.070 8.070 8.826 -0.756 25768 15241 1 17 . 1 1 134 134 GLY N N 134 109.400 109.400 107.924 1.476 25768 15242 1 17 . 1 1 134 134 GLY C C 134 174.060 174.060 173.489 0.571 25768 15243 1 17 . 1 1 134 134 GLY CA C 134 45.690 45.690 44.587 1.103 25768 15244 1 17 . 1 1 134 134 GLY H H 134 8.150 8.150 7.961 0.189 25768 15245 1 17 . 1 1 135 135 PHE N N 135 120.480 120.480 120.754 -0.274 25768 15246 1 17 . 1 1 135 135 PHE C C 135 176.000 176.000 175.377 0.623 25768 15247 1 17 . 1 1 135 135 PHE CA C 135 58.370 58.370 57.680 0.690 25768 15248 1 17 . 1 1 135 135 PHE CB C 135 39.710 39.710 38.532 1.178 25768 15249 1 17 . 1 1 135 135 PHE H H 135 8.060 8.060 8.511 -0.451 25768 15250 1 17 . 1 1 136 136 SER N N 136 116.740 116.740 114.907 1.833 25768 15251 1 17 . 1 1 136 136 SER C C 136 174.620 174.620 174.156 0.464 25768 15252 1 17 . 1 1 136 136 SER CA C 136 58.870 58.870 58.639 0.231 25768 15253 1 17 . 1 1 136 136 SER CB C 136 64.200 64.200 64.182 0.018 25768 15254 1 17 . 1 1 136 136 SER H H 136 8.160 8.160 7.748 0.412 25768 15255 1 17 . 1 1 137 137 SER N N 137 117.650 117.650 118.826 -1.176 25768 15256 1 17 . 1 1 137 137 SER C C 137 174.410 174.410 174.356 0.054 25768 15257 1 17 . 1 1 137 137 SER CA C 137 58.880 58.880 58.525 0.355 25768 15258 1 17 . 1 1 137 137 SER CB C 137 64.140 64.140 63.375 0.765 25768 15259 1 17 . 1 1 137 137 SER H H 137 8.140 8.140 7.899 0.241 25768 15260 1 17 . 1 1 138 138 MET N N 138 121.980 121.980 124.681 -2.701 25768 15261 1 17 . 1 1 138 138 MET C C 138 175.680 175.680 175.977 -0.297 25768 15262 1 17 . 1 1 138 138 MET CA C 138 56.180 56.180 55.322 0.858 25768 15263 1 17 . 1 1 138 138 MET CB C 138 33.240 33.240 33.136 0.104 25768 15264 1 17 . 1 1 138 138 MET H H 138 8.110 8.110 8.380 -0.270 25768 15265 1 17 . 1 1 139 139 LYS N N 139 122.110 122.110 122.204 -0.094 25768 15266 1 17 . 1 1 139 139 LYS C C 139 176.220 176.220 175.309 0.911 25768 15267 1 17 . 1 1 139 139 LYS CA C 139 56.370 56.370 55.672 0.697 25768 15268 1 17 . 1 1 139 139 LYS CB C 139 33.220 33.220 32.841 0.379 25768 15269 1 17 . 1 1 139 139 LYS H H 139 8.140 8.140 8.283 -0.143 25768 15270 1 17 . 1 1 140 140 LEU N N 140 123.860 123.860 123.527 0.333 25768 15271 1 17 . 1 1 140 140 LEU C C 140 177.100 177.100 177.542 -0.442 25768 15272 1 17 . 1 1 140 140 LEU CA C 140 55.710 55.710 57.062 -1.352 25768 15273 1 17 . 1 1 140 140 LEU CB C 140 42.460 42.460 42.430 0.030 25768 15274 1 17 . 1 1 140 140 LEU H H 140 8.140 8.140 8.692 -0.552 25768 15275 1 17 . 1 1 141 141 GLN N N 141 120.350 120.350 117.927 2.423 25768 15276 1 17 . 1 1 141 141 GLN C C 141 175.170 175.170 174.711 0.459 25768 15277 1 17 . 1 1 141 141 GLN CA C 141 56.200 56.200 55.485 0.715 25768 15278 1 17 . 1 1 141 141 GLN CB C 141 29.950 29.950 30.835 -0.885 25768 15279 1 17 . 1 1 141 141 GLN H H 141 8.210 8.210 7.812 0.398 25768 15280 1 17 . 1 1 142 142 ASP N N 142 120.950 120.950 119.944 1.006 25768 15281 1 17 . 1 1 142 142 ASP C C 142 175.840 175.840 175.229 0.611 25768 15282 1 17 . 1 1 142 142 ASP CA C 142 54.700 54.700 53.990 0.710 25768 15283 1 17 . 1 1 142 142 ASP CB C 142 41.760 41.760 40.988 0.772 25768 15284 1 17 . 1 1 142 142 ASP H H 142 8.120 8.120 8.533 -0.413 25768 15285 1 17 . 1 1 143 143 SER N N 143 114.880 114.880 114.079 0.801 25768 15286 1 17 . 1 1 143 143 SER C C 143 173.290 173.290 173.461 -0.171 25768 15287 1 17 . 1 1 143 143 SER CA C 143 58.450 58.450 58.447 0.003 25768 15288 1 17 . 1 1 143 143 SER CB C 143 64.760 64.760 62.955 1.805 25768 15289 1 17 . 1 1 143 143 SER H H 143 7.960 7.960 8.028 -0.068 25768 15290 1 17 . 1 1 144 144 TRP N N 144 123.110 123.110 121.318 1.792 25768 15291 1 17 . 1 1 144 144 TRP C C 144 175.880 175.880 176.799 -0.919 25768 15292 1 17 . 1 1 144 144 TRP CA C 144 56.420 56.420 58.010 -1.590 25768 15293 1 17 . 1 1 144 144 TRP CB C 144 31.160 31.160 29.578 1.582 25768 15294 1 17 . 1 1 144 144 TRP H H 144 8.080 8.080 7.842 0.238 25768 15295 1 17 . 1 1 145 145 GLY N N 145 110.410 110.410 114.256 -3.846 25768 15296 1 17 . 1 1 145 145 GLY C C 145 172.870 172.870 172.146 0.724 25768 15297 1 17 . 1 1 145 145 GLY CA C 145 45.130 45.130 44.982 0.148 25768 15298 1 17 . 1 1 145 145 GLY H H 145 8.660 8.660 8.356 0.304 25768 15299 1 17 . 1 1 148 148 GLY C C 148 171.800 171.800 172.893 -1.093 25768 15300 1 17 . 1 1 148 148 GLY CA C 148 44.140 44.140 44.715 -0.575 25768 15301 1 17 . 1 1 149 149 GLU N N 149 123.070 123.070 120.470 2.600 25768 15302 1 17 . 1 1 149 149 GLU C C 149 174.210 174.210 174.320 -0.110 25768 15303 1 17 . 1 1 149 149 GLU CA C 149 55.120 55.120 55.370 -0.250 25768 15304 1 17 . 1 1 149 149 GLU CB C 149 37.410 37.410 34.028 3.382 25768 15305 1 17 . 1 1 149 149 GLU H H 149 8.550 8.550 8.055 0.495 25768 15306 1 17 . 1 1 150 150 LEU N N 150 126.130 126.130 123.893 2.237 25768 15307 1 17 . 1 1 150 150 LEU C C 150 174.410 174.410 175.015 -0.605 25768 15308 1 17 . 1 1 150 150 LEU CA C 150 54.260 54.260 53.288 0.972 25768 15309 1 17 . 1 1 150 150 LEU CB C 150 47.510 47.510 44.698 2.812 25768 15310 1 17 . 1 1 150 150 LEU H H 150 8.550 8.550 8.130 0.420 25768 15311 1 17 . 1 1 151 151 GLY N N 151 109.500 109.500 108.773 0.727 25768 15312 1 17 . 1 1 151 151 GLY C C 151 170.610 170.610 171.774 -1.164 25768 15313 1 17 . 1 1 151 151 GLY CA C 151 45.980 45.980 43.459 2.521 25768 15314 1 17 . 1 1 151 151 GLY H H 151 8.090 8.090 7.905 0.185 25768 15315 1 17 . 1 1 152 152 PHE N N 152 110.960 110.960 119.170 -8.210 25768 15316 1 17 . 1 1 152 152 PHE C C 152 171.510 171.510 175.158 -3.648 25768 15317 1 17 . 1 1 152 152 PHE CA C 152 58.170 58.170 55.867 2.303 25768 15318 1 17 . 1 1 152 152 PHE CB C 152 41.690 41.690 40.419 1.272 25768 15319 1 17 . 1 1 152 152 PHE H H 152 8.380 8.380 8.217 0.163 25768 15320 1 17 . 1 1 153 153 ASP N N 153 118.880 118.880 125.675 -6.795 25768 15321 1 17 . 1 1 153 153 ASP C C 153 176.520 176.520 174.714 1.806 25768 15322 1 17 . 1 1 153 153 ASP CA C 153 52.940 52.940 55.303 -2.363 25768 15323 1 17 . 1 1 153 153 ASP CB C 153 44.540 44.540 43.270 1.270 25768 15324 1 17 . 1 1 153 153 ASP H H 153 7.970 7.970 8.668 -0.698 25768 15325 1 17 . 1 1 154 154 TYR N N 154 123.630 123.630 124.695 -1.065 25768 15326 1 17 . 1 1 154 154 TYR C C 154 175.610 175.610 173.981 1.629 25768 15327 1 17 . 1 1 154 154 TYR CA C 154 57.310 57.310 57.477 -0.167 25768 15328 1 17 . 1 1 154 154 TYR CB C 154 42.040 42.040 42.932 -0.892 25768 15329 1 17 . 1 1 154 154 TYR H H 154 9.730 9.730 9.512 0.218 25768 15330 1 17 . 1 1 155 155 MET N N 155 126.190 126.190 126.465 -0.275 25768 15331 1 17 . 1 1 155 155 MET C C 155 174.970 174.970 175.259 -0.289 25768 15332 1 17 . 1 1 155 155 MET CA C 155 54.720 54.720 56.216 -1.496 25768 15333 1 17 . 1 1 155 155 MET CB C 155 28.300 28.300 32.889 -4.589 25768 15334 1 17 . 1 1 155 155 MET H H 155 8.600 8.600 8.510 0.090 25768 15335 1 17 . 1 1 156 156 LEU N N 156 125.290 125.290 128.882 -3.592 25768 15336 1 17 . 1 1 156 156 LEU C C 156 177.680 177.680 177.869 -0.189 25768 15337 1 17 . 1 1 156 156 LEU CA C 156 56.040 56.040 55.657 0.383 25768 15338 1 17 . 1 1 156 156 LEU CB C 156 43.040 43.040 43.110 -0.070 25768 15339 1 17 . 1 1 156 156 LEU H H 156 9.190 9.190 8.620 0.570 25768 15340 1 17 . 1 1 157 157 ASN N N 157 114.690 114.690 114.037 0.653 25768 15341 1 17 . 1 1 157 157 ASN C C 157 173.640 173.640 175.949 -2.309 25768 15342 1 17 . 1 1 157 157 ASN CA C 157 52.650 52.650 55.199 -2.549 25768 15343 1 17 . 1 1 157 157 ASN CB C 157 37.270 37.270 37.361 -0.090 25768 15344 1 17 . 1 1 157 157 ASN H H 157 8.060 8.060 8.141 -0.081 25768 15345 1 17 . 1 1 158 158 GLU N N 158 114.530 114.530 118.051 -3.521 25768 15346 1 17 . 1 1 158 158 GLU C C 158 176.090 176.090 177.524 -1.434 25768 15347 1 17 . 1 1 158 158 GLU CA C 158 60.010 60.010 58.267 1.743 25768 15348 1 17 . 1 1 158 158 GLU CB C 158 29.730 29.730 30.390 -0.660 25768 15349 1 17 . 1 1 158 158 GLU H H 158 8.560 8.560 8.858 -0.298 25768 15350 1 17 . 1 1 159 159 HIS N N 159 110.480 110.480 113.095 -2.615 25768 15351 1 17 . 1 1 159 159 HIS C C 159 173.130 173.130 174.168 -1.038 25768 15352 1 17 . 1 1 159 159 HIS CA C 159 56.770 56.770 56.811 -0.041 25768 15353 1 17 . 1 1 159 159 HIS CB C 159 32.630 32.630 32.309 0.321 25768 15354 1 17 . 1 1 159 159 HIS H H 159 8.190 8.190 7.933 0.257 25768 15355 1 17 . 1 1 160 160 ALA N N 160 122.890 122.890 122.247 0.643 25768 15356 1 17 . 1 1 160 160 ALA C C 160 176.200 176.200 174.772 1.428 25768 15357 1 17 . 1 1 160 160 ALA CA C 160 51.730 51.730 52.130 -0.400 25768 15358 1 17 . 1 1 160 160 ALA CB C 160 21.560 21.560 20.642 0.917 25768 15359 1 17 . 1 1 160 160 ALA H H 160 8.400 8.400 7.005 1.395 25768 15360 1 17 . 1 1 161 161 LEU N N 161 116.540 116.540 118.653 -2.113 25768 15361 1 17 . 1 1 161 161 LEU C C 161 174.930 174.930 175.599 -0.669 25768 15362 1 17 . 1 1 161 161 LEU CA C 161 54.280 54.280 54.456 -0.177 25768 15363 1 17 . 1 1 161 161 LEU CB C 161 45.640 45.640 44.467 1.173 25768 15364 1 17 . 1 1 161 161 LEU H H 161 8.590 8.590 8.100 0.490 25768 15365 1 17 . 1 1 162 162 PHE N N 162 121.780 121.780 125.013 -3.233 25768 15366 1 17 . 1 1 162 162 PHE C C 162 171.960 171.960 174.448 -2.488 25768 15367 1 17 . 1 1 162 162 PHE CA C 162 56.420 56.420 57.075 -0.655 25768 15368 1 17 . 1 1 162 162 PHE CB C 162 43.340 43.340 42.347 0.993 25768 15369 1 17 . 1 1 162 162 PHE H H 162 9.180 9.180 9.496 -0.316 25768 15370 1 17 . 1 1 163 163 ASN N N 163 127.850 127.850 122.329 5.521 25768 15371 1 17 . 1 1 163 163 ASN C C 163 171.320 171.320 173.731 -2.411 25768 15372 1 17 . 1 1 163 163 ASN CA C 163 52.340 52.340 51.863 0.477 25768 15373 1 17 . 1 1 163 163 ASN CB C 163 46.410 46.410 42.130 4.280 25768 15374 1 17 . 1 1 163 163 ASN H H 163 7.700 7.700 8.714 -1.014 25768 15375 1 17 . 1 1 164 164 MET N N 164 119.950 119.950 120.505 -0.555 25768 15376 1 17 . 1 1 164 164 MET C C 164 172.830 172.830 175.031 -2.201 25768 15377 1 17 . 1 1 164 164 MET CA C 164 55.180 55.180 54.795 0.385 25768 15378 1 17 . 1 1 164 164 MET CB C 164 37.770 37.770 37.034 0.736 25768 15379 1 17 . 1 1 164 164 MET H H 164 7.070 7.070 8.338 -1.268 25768 15380 1 17 . 1 1 165 165 ALA N N 165 120.600 120.600 124.030 -3.430 25768 15381 1 17 . 1 1 165 165 ALA C C 165 174.240 174.240 174.886 -0.646 25768 15382 1 17 . 1 1 165 165 ALA CA C 165 51.630 51.630 51.437 0.193 25768 15383 1 17 . 1 1 165 165 ALA CB C 165 22.330 22.330 21.607 0.723 25768 15384 1 17 . 1 1 165 165 ALA H H 165 8.290 8.290 8.415 -0.125 25768 15385 1 17 . 1 1 166 166 VAL N N 166 117.900 117.900 123.032 -5.132 25768 15386 1 17 . 1 1 166 166 VAL C C 166 172.950 172.950 174.589 -1.639 25768 15387 1 17 . 1 1 166 166 VAL CA C 166 59.710 59.710 59.379 0.331 25768 15388 1 17 . 1 1 166 166 VAL CB C 166 35.290 35.290 35.407 -0.117 25768 15389 1 17 . 1 1 166 166 VAL H H 166 8.720 8.720 8.878 -0.158 25768 15390 1 17 . 1 1 171 171 ILE C C 171 175.750 175.750 174.087 1.663 25768 15391 1 17 . 1 1 171 171 ILE CA C 171 61.720 61.720 61.104 0.616 25768 15392 1 17 . 1 1 171 171 ILE CB C 171 39.300 39.300 39.591 -0.291 25768 15393 1 17 . 1 1 172 172 ASP N N 172 124.070 124.070 126.415 -2.345 25768 15394 1 17 . 1 1 172 172 ASP C C 172 176.590 176.590 175.020 1.570 25768 15395 1 17 . 1 1 172 172 ASP CA C 172 54.460 54.460 54.161 0.299 25768 15396 1 17 . 1 1 172 172 ASP CB C 172 41.410 41.410 40.939 0.471 25768 15397 1 17 . 1 1 172 172 ASP H H 172 8.460 8.460 8.367 0.093 25768 15398 1 17 . 1 1 173 173 THR N N 173 115.570 115.570 117.182 -1.612 25768 15399 1 17 . 1 1 173 173 THR C C 173 175.030 175.030 174.245 0.785 25768 15400 1 17 . 1 1 173 173 THR CA C 173 62.680 62.680 62.108 0.572 25768 15401 1 17 . 1 1 173 173 THR CB C 173 69.840 69.840 69.801 0.039 25768 15402 1 17 . 1 1 173 173 THR H H 173 8.080 8.080 8.123 -0.043 25768 15403 1 17 . 1 1 174 174 LYS N N 174 122.680 122.680 125.976 -3.296 25768 15404 1 17 . 1 1 174 174 LYS C C 174 176.340 176.340 175.371 0.969 25768 15405 1 17 . 1 1 174 174 LYS CA C 174 56.820 56.820 55.666 1.154 25768 15406 1 17 . 1 1 174 174 LYS CB C 174 32.790 32.790 32.724 0.066 25768 15407 1 17 . 1 1 174 174 LYS H H 174 8.180 8.180 8.622 -0.442 25768 15408 1 17 . 1 1 175 175 ALA N N 175 124.050 124.050 122.797 1.253 25768 15409 1 17 . 1 1 175 175 ALA C C 175 177.550 177.550 176.417 1.133 25768 15410 1 17 . 1 1 175 175 ALA CA C 175 52.840 52.840 51.824 1.016 25768 15411 1 17 . 1 1 175 175 ALA CB C 175 19.580 19.580 19.864 -0.284 25768 15412 1 17 . 1 1 175 175 ALA H H 175 8.050 8.050 7.829 0.221 25768 15413 1 17 . 1 1 176 176 SER N N 176 114.920 114.920 118.583 -3.663 25768 15414 1 17 . 1 1 176 176 SER C C 176 174.240 174.240 174.347 -0.107 25768 15415 1 17 . 1 1 176 176 SER CA C 176 58.390 58.390 58.411 -0.021 25768 15416 1 17 . 1 1 176 176 SER CB C 176 64.370 64.370 63.758 0.612 25768 15417 1 17 . 1 1 176 176 SER H H 176 8.070 8.070 8.844 -0.774 25768 15418 1 17 . 1 1 177 177 ILE N N 177 121.650 121.650 119.644 2.006 25768 15419 1 17 . 1 1 177 177 ILE C C 177 174.990 174.990 174.276 0.714 25768 15420 1 17 . 1 1 177 177 ILE CA C 177 61.570 61.570 61.343 0.228 25768 15421 1 17 . 1 1 177 177 ILE CB C 177 39.100 39.100 38.691 0.408 25768 15422 1 17 . 1 1 177 177 ILE H H 177 7.960 7.960 7.732 0.228 25768 15423 1 17 . 1 1 178 178 ASN N N 178 127.040 127.040 125.012 2.028 25768 15424 1 17 . 1 1 178 178 ASN C C 178 179.160 179.160 176.001 3.159 25768 15425 1 17 . 1 1 178 178 ASN CA C 178 55.100 55.100 53.849 1.251 25768 15426 1 17 . 1 1 178 178 ASN CB C 178 41.300 41.300 38.800 2.501 25768 15427 1 17 . 1 1 178 178 ASN H H 178 7.850 7.850 8.421 -0.571 25768 15428 1 17 . 1 1 180 180 PRO C C 180 177.520 177.520 176.233 1.287 25768 15429 1 17 . 1 1 180 180 PRO CA C 180 63.980 63.980 63.102 0.878 25768 15430 1 17 . 1 1 180 180 PRO CB C 180 32.190 32.190 32.576 -0.386 25768 15431 1 17 . 1 1 181 181 SER N N 181 115.600 115.600 115.334 0.266 25768 15432 1 17 . 1 1 181 181 SER C C 181 174.710 174.710 173.797 0.913 25768 15433 1 17 . 1 1 181 181 SER CA C 181 58.900 58.900 58.346 0.554 25768 15434 1 17 . 1 1 181 181 SER CB C 181 64.070 64.070 63.863 0.207 25768 15435 1 17 . 1 1 181 181 SER H H 181 8.260 8.260 8.160 0.100 25768 15436 1 17 . 1 1 182 182 ALA N N 182 125.880 125.880 124.113 1.767 25768 15437 1 17 . 1 1 182 182 ALA C C 182 177.560 177.560 176.667 0.893 25768 15438 1 17 . 1 1 182 182 ALA CA C 182 53.090 53.090 52.443 0.647 25768 15439 1 17 . 1 1 182 182 ALA CB C 182 19.310 19.310 18.034 1.276 25768 15440 1 17 . 1 1 182 182 ALA H H 182 8.130 8.130 8.048 0.082 25768 15441 1 17 . 1 1 183 183 LEU N N 183 119.980 119.980 121.167 -1.187 25768 15442 1 17 . 1 1 183 183 LEU C C 183 177.850 177.850 176.541 1.309 25768 15443 1 17 . 1 1 183 183 LEU CA C 183 55.650 55.650 55.242 0.408 25768 15444 1 17 . 1 1 183 183 LEU CB C 183 42.530 42.530 41.123 1.407 25768 15445 1 17 . 1 1 183 183 LEU H H 183 7.940 7.940 8.006 -0.066 25768 15446 1 17 . 1 1 184 184 GLY N N 184 109.250 109.250 113.501 -4.251 25768 15447 1 17 . 1 1 184 184 GLY C C 184 174.250 174.250 172.980 1.270 25768 15448 1 17 . 1 1 184 184 GLY CA C 184 45.830 45.830 45.321 0.509 25768 15449 1 17 . 1 1 184 184 GLY H H 184 8.150 8.150 7.911 0.239 25768 15450 1 17 . 1 1 185 185 VAL N N 185 118.830 118.830 121.374 -2.544 25768 15451 1 17 . 1 1 185 185 VAL C C 185 175.890 175.890 174.950 0.940 25768 15452 1 17 . 1 1 185 185 VAL CA C 185 62.740 62.740 61.898 0.843 25768 15453 1 17 . 1 1 185 185 VAL CB C 185 32.770 32.770 30.589 2.181 25768 15454 1 17 . 1 1 185 185 VAL H H 185 7.760 7.760 8.149 -0.389 25768 15455 1 17 . 1 1 186 186 ASN N N 186 121.850 121.850 124.564 -2.714 25768 15456 1 17 . 1 1 186 186 ASN C C 186 174.970 174.970 174.998 -0.028 25768 15457 1 17 . 1 1 186 186 ASN CA C 186 53.590 53.590 52.983 0.607 25768 15458 1 17 . 1 1 186 186 ASN CB C 186 39.160 39.160 38.671 0.489 25768 15459 1 17 . 1 1 186 186 ASN H H 186 8.380 8.380 8.156 0.224 25768 15460 1 17 . 1 1 187 187 LYS N N 187 122.120 122.120 124.305 -2.185 25768 15461 1 17 . 1 1 187 187 LYS C C 187 176.490 176.490 176.847 -0.357 25768 15462 1 17 . 1 1 187 187 LYS CA C 187 56.750 56.750 57.877 -1.127 25768 15463 1 17 . 1 1 187 187 LYS CB C 187 33.250 33.250 32.960 0.290 25768 15464 1 17 . 1 1 187 187 LYS H H 187 8.140 8.140 8.707 -0.567 25768 15465 1 17 . 1 1 188 188 THR N N 188 115.250 115.250 111.937 3.313 25768 15466 1 17 . 1 1 188 188 THR C C 188 174.250 174.250 173.705 0.545 25768 15467 1 17 . 1 1 188 188 THR CA C 188 62.360 62.360 62.196 0.164 25768 15468 1 17 . 1 1 188 188 THR CB C 188 70.280 70.280 67.581 2.699 25768 15469 1 17 . 1 1 188 188 THR H H 188 8.100 8.100 8.182 -0.082 25768 15470 1 17 . 1 1 189 189 LYS N N 189 123.780 123.780 124.487 -0.707 25768 15471 1 17 . 1 1 189 189 LYS C C 189 176.090 176.090 175.611 0.479 25768 15472 1 17 . 1 1 189 189 LYS CA C 189 56.590 56.590 56.837 -0.247 25768 15473 1 17 . 1 1 189 189 LYS CB C 189 33.350 33.350 34.084 -0.734 25768 15474 1 17 . 1 1 189 189 LYS H H 189 8.110 8.110 8.063 0.047 25768 15475 1 17 . 1 1 190 190 VAL N N 190 120.920 120.920 120.582 0.338 25768 15476 1 17 . 1 1 190 190 VAL C C 190 175.590 175.590 174.789 0.801 25768 15477 1 17 . 1 1 190 190 VAL CA C 190 62.400 62.400 61.775 0.625 25768 15478 1 17 . 1 1 190 190 VAL CB C 190 32.990 32.990 31.776 1.214 25768 15479 1 17 . 1 1 190 190 VAL H H 190 8.040 8.040 7.790 0.250 25768 15480 1 17 . 1 1 191 191 ASP N N 191 123.790 123.790 121.689 2.101 25768 15481 1 17 . 1 1 191 191 ASP C C 191 175.750 175.750 177.220 -1.470 25768 15482 1 17 . 1 1 191 191 ASP CA C 191 54.650 54.650 55.613 -0.963 25768 15483 1 17 . 1 1 191 191 ASP CB C 191 41.450 41.450 41.087 0.363 25768 15484 1 17 . 1 1 191 191 ASP H H 191 8.240 8.240 8.083 0.157 25768 15485 1 17 . 1 1 192 192 VAL N N 192 118.850 118.850 117.891 0.959 25768 15486 1 17 . 1 1 192 192 VAL C C 192 175.380 175.380 175.209 0.171 25768 15487 1 17 . 1 1 192 192 VAL CA C 192 62.110 62.110 63.695 -1.585 25768 15488 1 17 . 1 1 192 192 VAL CB C 192 33.290 33.290 31.865 1.425 25768 15489 1 17 . 1 1 192 192 VAL H H 192 7.860 7.860 7.767 0.093 25768 15490 1 17 . 1 1 193 193 ASP N N 193 124.190 124.190 122.553 1.637 25768 15491 1 17 . 1 1 193 193 ASP C C 193 175.630 175.630 175.089 0.541 25768 15492 1 17 . 1 1 193 193 ASP CA C 193 54.540 54.540 54.376 0.164 25768 15493 1 17 . 1 1 193 193 ASP CB C 193 41.410 41.410 38.949 2.461 25768 15494 1 17 . 1 1 193 193 ASP H H 193 8.310 8.310 8.346 -0.036 25768 15495 1 17 . 1 1 194 194 VAL N N 194 119.580 119.580 120.435 -0.855 25768 15496 1 17 . 1 1 194 194 VAL C C 194 174.950 174.950 174.233 0.717 25768 15497 1 17 . 1 1 194 194 VAL CA C 194 61.770 61.770 61.249 0.521 25768 15498 1 17 . 1 1 194 194 VAL CB C 194 33.680 33.680 34.245 -0.565 25768 15499 1 17 . 1 1 194 194 VAL H H 194 7.890 7.890 7.583 0.307 25768 15500 1 17 . 1 1 195 195 ASP N N 195 125.660 125.660 128.921 -3.261 25768 15501 1 17 . 1 1 195 195 ASP C C 195 174.290 174.290 174.186 0.104 25768 15502 1 17 . 1 1 195 195 ASP CA C 195 51.940 51.940 52.139 -0.199 25768 15503 1 17 . 1 1 195 195 ASP CB C 195 40.950 40.950 40.968 -0.018 25768 15504 1 17 . 1 1 195 195 ASP H H 195 8.410 8.410 8.190 0.220 25768 15505 1 17 . 1 1 198 198 VAL C C 198 173.940 173.940 173.601 0.339 25768 15506 1 17 . 1 1 198 198 VAL CA C 198 61.270 61.270 61.453 -0.183 25768 15507 1 17 . 1 1 198 198 VAL CB C 198 35.910 35.910 34.009 1.901 25768 15508 1 17 . 1 1 199 199 TYR N N 199 123.780 123.780 121.203 2.577 25768 15509 1 17 . 1 1 199 199 TYR C C 199 174.150 174.150 174.498 -0.348 25768 15510 1 17 . 1 1 199 199 TYR CA C 199 56.220 56.220 56.812 -0.592 25768 15511 1 17 . 1 1 199 199 TYR CB C 199 41.660 41.660 42.224 -0.563 25768 15512 1 17 . 1 1 199 199 TYR H H 199 8.540 8.540 8.643 -0.103 25768 15513 1 17 . 1 1 200 200 MET N N 200 123.920 123.920 123.318 0.602 25768 15514 1 17 . 1 1 200 200 MET C C 200 173.810 173.810 174.301 -0.491 25768 15515 1 17 . 1 1 200 200 MET CA C 200 54.710 54.710 54.018 0.692 25768 15516 1 17 . 1 1 200 200 MET CB C 200 37.110 37.110 36.767 0.343 25768 15517 1 17 . 1 1 200 200 MET H H 200 9.130 9.130 8.417 0.713 25768 15518 1 17 . 1 1 201 201 ILE N N 201 123.670 123.670 118.286 5.384 25768 15519 1 17 . 1 1 201 201 ILE C C 201 174.030 174.030 174.018 0.012 25768 15520 1 17 . 1 1 201 201 ILE CA C 201 59.820 59.820 60.002 -0.182 25768 15521 1 17 . 1 1 201 201 ILE CB C 201 41.720 41.720 40.577 1.143 25768 15522 1 17 . 1 1 201 201 ILE H H 201 8.030 8.030 8.341 -0.311 25768 15523 1 17 . 1 1 202 202 GLY N N 202 112.910 112.910 112.943 -0.033 25768 15524 1 17 . 1 1 202 202 GLY C C 202 170.280 170.280 171.306 -1.026 25768 15525 1 17 . 1 1 202 202 GLY CA C 202 46.800 46.800 44.777 2.023 25768 15526 1 17 . 1 1 202 202 GLY H H 202 8.580 8.580 7.812 0.768 25768 15527 1 17 . 1 1 203 203 PHE N N 203 116.240 116.240 115.151 1.089 25768 15528 1 17 . 1 1 203 203 PHE C C 203 173.940 173.940 173.633 0.307 25768 15529 1 17 . 1 1 203 203 PHE CA C 203 55.890 55.890 54.595 1.295 25768 15530 1 17 . 1 1 203 203 PHE CB C 203 45.060 45.060 42.457 2.603 25768 15531 1 17 . 1 1 203 203 PHE H H 203 8.620 8.620 8.629 -0.009 25768 15532 1 17 . 1 1 204 204 GLY N N 204 105.610 105.610 106.191 -0.581 25768 15533 1 17 . 1 1 204 204 GLY C C 204 171.190 171.190 171.487 -0.297 25768 15534 1 17 . 1 1 204 204 GLY CA C 204 46.720 46.720 44.784 1.936 25768 15535 1 17 . 1 1 204 204 GLY H H 204 8.960 8.960 8.886 0.074 25768 15536 1 17 . 1 1 205 205 TYR N N 205 121.160 121.160 120.242 0.918 25768 15537 1 17 . 1 1 205 205 TYR C C 205 173.030 173.030 174.273 -1.243 25768 15538 1 17 . 1 1 205 205 TYR CA C 205 57.190 57.190 55.805 1.385 25768 15539 1 17 . 1 1 205 205 TYR CB C 205 44.400 44.400 43.297 1.103 25768 15540 1 17 . 1 1 205 205 TYR H H 205 9.380 9.380 8.343 1.037 25768 15541 1 17 . 1 1 206 206 LYS N N 206 126.970 126.970 123.329 3.641 25768 15542 1 17 . 1 1 206 206 LYS C C 206 174.210 174.210 176.009 -1.799 25768 15543 1 17 . 1 1 206 206 LYS CA C 206 54.770 54.770 55.904 -1.134 25768 15544 1 17 . 1 1 206 206 LYS CB C 206 34.440 34.440 33.303 1.137 25768 15545 1 17 . 1 1 206 206 LYS H H 206 8.380 8.380 8.197 0.183 25768 15546 1 17 . 1 1 207 207 PHE N N 207 126.330 126.330 124.755 1.575 25768 15547 1 17 . 1 1 207 207 PHE C C 207 175.020 175.020 175.957 -0.937 25768 15548 1 17 . 1 1 207 207 PHE CA C 207 58.170 58.170 59.527 -1.357 25768 15549 1 17 . 1 1 207 207 PHE CB C 207 40.920 40.920 39.528 1.393 25768 15550 1 17 . 1 1 207 207 PHE H H 207 9.290 9.290 8.158 1.132 25768 15551 1 17 . 1 1 208 208 LEU N N 208 122.740 122.740 125.819 -3.079 25768 15552 1 17 . 1 1 208 208 LEU C C 208 176.510 176.510 177.354 -0.844 25768 15553 1 17 . 1 1 208 208 LEU CA C 208 54.910 54.910 55.359 -0.449 25768 15554 1 17 . 1 1 208 208 LEU CB C 208 43.830 43.830 42.133 1.697 25768 15555 1 17 . 1 1 208 208 LEU H H 208 8.310 8.310 8.360 -0.050 25768 15556 1 18 . 1 1 2 2 HIS C C 2 175.310 175.310 174.779 0.531 25768 15557 1 18 . 1 1 3 3 LYS N N 3 122.080 122.080 121.935 0.145 25768 15558 1 18 . 1 1 3 3 LYS C C 3 173.490 173.490 174.227 -0.737 25768 15559 1 18 . 1 1 3 3 LYS CA C 3 55.050 55.050 54.863 0.187 25768 15560 1 18 . 1 1 3 3 LYS CB C 3 35.380 35.380 35.200 0.180 25768 15561 1 18 . 1 1 3 3 LYS H H 3 8.620 8.620 8.295 0.325 25768 15562 1 18 . 1 1 4 4 ALA N N 4 120.860 120.860 122.990 -2.130 25768 15563 1 18 . 1 1 4 4 ALA C C 4 178.190 178.190 178.562 -0.372 25768 15564 1 18 . 1 1 4 4 ALA CA C 4 53.480 53.480 52.837 0.642 25768 15565 1 18 . 1 1 4 4 ALA CB C 4 18.140 18.140 17.957 0.183 25768 15566 1 18 . 1 1 4 4 ALA H H 4 8.580 8.580 8.362 0.218 25768 15567 1 18 . 1 1 5 5 GLY N N 5 112.890 112.890 112.757 0.133 25768 15568 1 18 . 1 1 5 5 GLY C C 5 173.830 173.830 173.972 -0.142 25768 15569 1 18 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.816 0.064 25768 15570 1 18 . 1 1 5 5 GLY H H 5 9.210 9.210 8.863 0.347 25768 15571 1 18 . 1 1 6 6 ASP N N 6 121.590 121.590 120.275 1.315 25768 15572 1 18 . 1 1 6 6 ASP C C 6 174.380 174.380 174.601 -0.221 25768 15573 1 18 . 1 1 6 6 ASP CA C 6 55.790 55.790 54.068 1.722 25768 15574 1 18 . 1 1 6 6 ASP CB C 6 41.760 41.760 42.581 -0.822 25768 15575 1 18 . 1 1 6 6 ASP H H 6 7.620 7.620 7.670 -0.050 25768 15576 1 18 . 1 1 7 7 PHE N N 7 120.860 120.860 120.713 0.147 25768 15577 1 18 . 1 1 7 7 PHE C C 7 174.050 174.050 173.637 0.413 25768 15578 1 18 . 1 1 7 7 PHE CA C 7 56.110 56.110 56.458 -0.348 25768 15579 1 18 . 1 1 7 7 PHE CB C 7 42.550 42.550 42.138 0.412 25768 15580 1 18 . 1 1 7 7 PHE H H 7 8.250 8.250 8.670 -0.420 25768 15581 1 18 . 1 1 8 8 ILE N N 8 127.950 127.950 123.023 4.927 25768 15582 1 18 . 1 1 8 8 ILE C C 8 174.000 174.000 173.759 0.241 25768 15583 1 18 . 1 1 8 8 ILE CA C 8 61.160 61.160 60.185 0.975 25768 15584 1 18 . 1 1 8 8 ILE CB C 8 42.660 42.660 40.508 2.152 25768 15585 1 18 . 1 1 8 8 ILE H H 8 9.230 9.230 8.602 0.628 25768 15586 1 18 . 1 1 9 9 ILE N N 9 125.380 125.380 120.999 4.381 25768 15587 1 18 . 1 1 9 9 ILE C C 9 173.630 173.630 174.636 -1.006 25768 15588 1 18 . 1 1 9 9 ILE CA C 9 59.600 59.600 59.427 0.173 25768 15589 1 18 . 1 1 9 9 ILE CB C 9 41.180 41.180 39.909 1.271 25768 15590 1 18 . 1 1 9 9 ILE H H 9 8.580 8.580 8.586 -0.006 25768 15591 1 18 . 1 1 10 10 ARG N N 10 124.950 124.950 120.529 4.421 25768 15592 1 18 . 1 1 10 10 ARG C C 10 175.030 175.030 174.689 0.341 25768 15593 1 18 . 1 1 10 10 ARG CA C 10 53.920 53.920 54.897 -0.977 25768 15594 1 18 . 1 1 10 10 ARG CB C 10 31.880 31.880 35.516 -3.636 25768 15595 1 18 . 1 1 10 10 ARG H H 10 9.230 9.230 8.924 0.306 25768 15596 1 18 . 1 1 11 11 GLY N N 11 105.650 105.650 106.921 -1.271 25768 15597 1 18 . 1 1 11 11 GLY C C 11 172.090 172.090 172.747 -0.657 25768 15598 1 18 . 1 1 11 11 GLY CA C 11 44.460 44.460 43.467 0.993 25768 15599 1 18 . 1 1 11 11 GLY H H 11 8.780 8.780 8.353 0.427 25768 15600 1 18 . 1 1 12 12 GLY N N 12 107.800 107.800 106.340 1.460 25768 15601 1 18 . 1 1 12 12 GLY C C 12 171.460 171.460 171.804 -0.344 25768 15602 1 18 . 1 1 12 12 GLY CA C 12 46.630 46.630 44.280 2.350 25768 15603 1 18 . 1 1 12 12 GLY H H 12 8.510 8.510 8.600 -0.090 25768 15604 1 18 . 1 1 13 13 PHE N N 13 119.900 119.900 123.887 -3.987 25768 15605 1 18 . 1 1 13 13 PHE C C 13 174.190 174.190 173.643 0.547 25768 15606 1 18 . 1 1 13 13 PHE CA C 13 56.340 56.340 56.781 -0.441 25768 15607 1 18 . 1 1 13 13 PHE CB C 13 41.090 41.090 43.193 -2.103 25768 15608 1 18 . 1 1 13 13 PHE H H 13 8.610 8.610 9.036 -0.426 25768 15609 1 18 . 1 1 14 14 ALA N N 14 128.030 128.030 129.498 -1.468 25768 15610 1 18 . 1 1 14 14 ALA C C 14 176.560 176.560 177.434 -0.874 25768 15611 1 18 . 1 1 14 14 ALA CA C 14 49.940 49.940 50.798 -0.858 25768 15612 1 18 . 1 1 14 14 ALA CB C 14 20.360 20.360 21.005 -0.645 25768 15613 1 18 . 1 1 14 14 ALA H H 14 9.220 9.220 8.876 0.344 25768 15614 1 18 . 1 1 15 15 THR N N 15 118.620 118.620 113.549 5.071 25768 15615 1 18 . 1 1 15 15 THR CA C 15 61.440 61.440 61.807 -0.367 25768 15616 1 18 . 1 1 15 15 THR CB C 15 71.370 71.370 69.454 1.916 25768 15617 1 18 . 1 1 15 15 THR H H 15 9.220 9.220 8.316 0.904 25768 15618 1 18 . 1 1 18 18 PRO C C 18 176.690 176.690 176.171 0.519 25768 15619 1 18 . 1 1 18 18 PRO CA C 18 63.610 63.610 63.857 -0.247 25768 15620 1 18 . 1 1 18 18 PRO CB C 18 32.440 32.440 32.632 -0.192 25768 15621 1 18 . 1 1 19 19 ASP N N 19 120.320 120.320 115.643 4.677 25768 15622 1 18 . 1 1 19 19 ASP C C 19 175.950 175.950 174.975 0.975 25768 15623 1 18 . 1 1 19 19 ASP CA C 19 54.710 54.710 53.695 1.015 25768 15624 1 18 . 1 1 19 19 ASP CB C 19 41.450 41.450 43.474 -2.024 25768 15625 1 18 . 1 1 19 19 ASP H H 19 8.330 8.330 7.888 0.442 25768 15626 1 18 . 1 1 20 20 ASP N N 20 121.990 121.990 122.341 -0.351 25768 15627 1 18 . 1 1 20 20 ASP C C 20 176.760 176.760 176.768 -0.008 25768 15628 1 18 . 1 1 20 20 ASP CA C 20 54.470 54.470 54.686 -0.216 25768 15629 1 18 . 1 1 20 20 ASP CB C 20 41.310 41.310 42.218 -0.908 25768 15630 1 18 . 1 1 20 20 ASP H H 20 8.240 8.240 8.552 -0.312 25768 15631 1 18 . 1 1 21 21 SER N N 21 117.050 117.050 115.079 1.971 25768 15632 1 18 . 1 1 21 21 SER C C 21 175.170 175.170 173.486 1.684 25768 15633 1 18 . 1 1 21 21 SER CA C 21 59.490 59.490 57.561 1.929 25768 15634 1 18 . 1 1 21 21 SER CB C 21 64.080 64.080 64.987 -0.907 25768 15635 1 18 . 1 1 21 21 SER H H 21 8.360 8.360 7.836 0.524 25768 15636 1 18 . 1 1 22 22 SER N N 22 117.820 117.820 117.388 0.432 25768 15637 1 18 . 1 1 22 22 SER C C 22 174.940 174.940 173.948 0.992 25768 15638 1 18 . 1 1 22 22 SER CA C 22 59.160 59.160 58.316 0.844 25768 15639 1 18 . 1 1 22 22 SER CB C 22 64.110 64.110 62.540 1.570 25768 15640 1 18 . 1 1 22 22 SER H H 22 8.310 8.310 8.775 -0.465 25768 15641 1 18 . 1 1 23 23 SER N N 23 117.660 117.660 118.224 -0.564 25768 15642 1 18 . 1 1 23 23 SER C C 23 174.340 174.340 174.040 0.300 25768 15643 1 18 . 1 1 23 23 SER CA C 23 59.050 59.050 58.244 0.806 25768 15644 1 18 . 1 1 23 23 SER CB C 23 64.210 64.210 63.737 0.473 25768 15645 1 18 . 1 1 23 23 SER H H 23 8.120 8.120 8.375 -0.255 25768 15646 1 18 . 1 1 24 24 ASP N N 24 122.590 122.590 119.174 3.416 25768 15647 1 18 . 1 1 24 24 ASP C C 24 176.250 176.250 174.417 1.833 25768 15648 1 18 . 1 1 24 24 ASP CA C 24 54.910 54.910 55.657 -0.747 25768 15649 1 18 . 1 1 24 24 ASP CB C 24 41.270 41.270 39.930 1.340 25768 15650 1 18 . 1 1 24 24 ASP H H 24 8.230 8.230 8.707 -0.477 25768 15651 1 18 . 1 1 25 25 ILE N N 25 120.650 120.650 112.512 8.138 25768 15652 1 18 . 1 1 25 25 ILE C C 25 176.190 176.190 175.831 0.359 25768 15653 1 18 . 1 1 25 25 ILE CA C 25 61.880 61.880 60.186 1.694 25768 15654 1 18 . 1 1 25 25 ILE CB C 25 38.730 38.730 39.825 -1.095 25768 15655 1 18 . 1 1 25 25 ILE H H 25 7.860 7.860 7.486 0.374 25768 15656 1 18 . 1 1 26 26 LYS N N 26 124.420 124.420 125.010 -0.590 25768 15657 1 18 . 1 1 26 26 LYS C C 26 176.640 176.640 176.355 0.285 25768 15658 1 18 . 1 1 26 26 LYS CA C 26 56.520 56.520 57.952 -1.432 25768 15659 1 18 . 1 1 26 26 LYS CB C 26 32.890 32.890 32.637 0.253 25768 15660 1 18 . 1 1 26 26 LYS H H 26 8.140 8.140 8.598 -0.458 25768 15661 1 18 . 1 1 27 27 LEU N N 27 123.120 123.120 114.693 8.427 25768 15662 1 18 . 1 1 27 27 LEU C C 27 177.110 177.110 174.078 3.032 25768 15663 1 18 . 1 1 27 27 LEU CA C 27 55.590 55.590 54.772 0.818 25768 15664 1 18 . 1 1 27 27 LEU CB C 27 42.500 42.500 42.424 0.076 25768 15665 1 18 . 1 1 27 27 LEU H H 27 8.080 8.080 7.469 0.611 25768 15666 1 18 . 1 1 28 28 ASP N N 28 120.850 120.850 120.804 0.046 25768 15667 1 18 . 1 1 28 28 ASP C C 28 176.960 176.960 177.151 -0.191 25768 15668 1 18 . 1 1 28 28 ASP CA C 28 54.800 54.800 53.934 0.867 25768 15669 1 18 . 1 1 28 28 ASP CB C 28 41.380 41.380 42.335 -0.955 25768 15670 1 18 . 1 1 28 28 ASP H H 28 8.180 8.180 8.130 0.050 25768 15671 1 18 . 1 1 29 29 GLY N N 29 109.800 109.800 115.430 -5.630 25768 15672 1 18 . 1 1 29 29 GLY C C 29 174.370 174.370 174.526 -0.156 25768 15673 1 18 . 1 1 29 29 GLY CA C 29 46.150 46.150 45.910 0.240 25768 15674 1 18 . 1 1 29 29 GLY H H 29 8.230 8.230 8.761 -0.531 25768 15675 1 18 . 1 1 30 30 ALA N N 30 123.880 123.880 125.124 -1.244 25768 15676 1 18 . 1 1 30 30 ALA C C 30 178.040 178.040 178.077 -0.037 25768 15677 1 18 . 1 1 30 30 ALA CA C 30 53.140 53.140 53.024 0.116 25768 15678 1 18 . 1 1 30 30 ALA CB C 30 19.350 19.350 19.529 -0.179 25768 15679 1 18 . 1 1 30 30 ALA H H 30 8.040 8.040 7.850 0.190 25768 15680 1 18 . 1 1 31 31 LYS N N 31 119.800 119.800 119.844 -0.044 25768 15681 1 18 . 1 1 31 31 LYS C C 31 176.770 176.770 174.580 2.190 25768 15682 1 18 . 1 1 31 31 LYS CA C 31 56.870 56.870 55.700 1.170 25768 15683 1 18 . 1 1 31 31 LYS CB C 31 32.980 32.980 33.506 -0.526 25768 15684 1 18 . 1 1 31 31 LYS H H 31 8.060 8.060 7.935 0.125 25768 15685 1 18 . 1 1 32 32 GLN N N 32 120.930 120.930 119.667 1.263 25768 15686 1 18 . 1 1 32 32 GLN C C 32 176.000 176.000 174.846 1.154 25768 15687 1 18 . 1 1 32 32 GLN CA C 32 56.280 56.280 56.347 -0.068 25768 15688 1 18 . 1 1 32 32 GLN CB C 32 29.580 29.580 29.875 -0.295 25768 15689 1 18 . 1 1 32 32 GLN H H 32 8.170 8.170 8.530 -0.360 25768 15690 1 18 . 1 1 33 33 ARG N N 33 122.370 122.370 123.100 -0.730 25768 15691 1 18 . 1 1 33 33 ARG C C 33 176.820 176.820 176.261 0.559 25768 15692 1 18 . 1 1 33 33 ARG CA C 33 56.680 56.680 56.398 0.283 25768 15693 1 18 . 1 1 33 33 ARG CB C 33 31.040 31.040 31.471 -0.431 25768 15694 1 18 . 1 1 33 33 ARG H H 33 8.270 8.270 8.652 -0.382 25768 15695 1 18 . 1 1 34 34 GLY N N 34 110.210 110.210 111.103 -0.893 25768 15696 1 18 . 1 1 34 34 GLY C C 34 174.280 174.280 173.922 0.358 25768 15697 1 18 . 1 1 34 34 GLY CA C 34 45.770 45.770 44.936 0.834 25768 15698 1 18 . 1 1 34 34 GLY H H 34 8.360 8.360 7.982 0.378 25768 15699 1 18 . 1 1 35 35 THR N N 35 114.100 114.100 112.550 1.550 25768 15700 1 18 . 1 1 35 35 THR C C 35 174.550 174.550 174.252 0.298 25768 15701 1 18 . 1 1 35 35 THR CA C 35 62.140 62.140 61.957 0.183 25768 15702 1 18 . 1 1 35 35 THR CB C 35 70.330 70.330 69.932 0.398 25768 15703 1 18 . 1 1 35 35 THR H H 35 7.970 7.970 7.607 0.363 25768 15704 1 18 . 1 1 36 36 LYS N N 36 123.850 123.850 124.130 -0.280 25768 15705 1 18 . 1 1 36 36 LYS C C 36 176.040 176.040 176.174 -0.134 25768 15706 1 18 . 1 1 36 36 LYS CA C 36 56.600 56.600 56.632 -0.032 25768 15707 1 18 . 1 1 36 36 LYS CB C 36 33.280 33.280 33.615 -0.335 25768 15708 1 18 . 1 1 36 36 LYS H H 36 8.230 8.230 8.524 -0.294 25768 15709 1 18 . 1 1 37 37 ALA N N 37 125.650 125.650 120.471 5.179 25768 15710 1 18 . 1 1 37 37 ALA C C 37 177.570 177.570 177.864 -0.294 25768 15711 1 18 . 1 1 37 37 ALA CA C 37 52.860 52.860 53.150 -0.290 25768 15712 1 18 . 1 1 37 37 ALA CB C 37 19.610 19.610 20.482 -0.872 25768 15713 1 18 . 1 1 37 37 ALA H H 37 8.290 8.290 8.577 -0.287 25768 15714 1 18 . 1 1 38 38 THR N N 38 113.350 113.350 111.770 1.580 25768 15715 1 18 . 1 1 38 38 THR C C 38 174.540 174.540 175.957 -1.417 25768 15716 1 18 . 1 1 38 38 THR CA C 38 62.010 62.010 62.778 -0.768 25768 15717 1 18 . 1 1 38 38 THR CB C 38 70.350 70.350 69.454 0.896 25768 15718 1 18 . 1 1 38 38 THR H H 38 7.970 7.970 8.015 -0.045 25768 15719 1 18 . 1 1 39 39 VAL N N 39 120.790 120.790 119.507 1.283 25768 15720 1 18 . 1 1 39 39 VAL C C 39 175.620 175.620 175.837 -0.217 25768 15721 1 18 . 1 1 39 39 VAL CA C 39 62.470 62.470 62.212 0.258 25768 15722 1 18 . 1 1 39 39 VAL CB C 39 32.940 32.940 32.687 0.253 25768 15723 1 18 . 1 1 39 39 VAL H H 39 8.020 8.020 7.872 0.148 25768 15724 1 18 . 1 1 40 40 ASP N N 40 123.690 123.690 119.718 3.972 25768 15725 1 18 . 1 1 40 40 ASP C C 40 176.190 176.190 176.205 -0.015 25768 15726 1 18 . 1 1 40 40 ASP CA C 40 54.780 54.780 55.319 -0.539 25768 15727 1 18 . 1 1 40 40 ASP CB C 40 41.590 41.590 39.985 1.605 25768 15728 1 18 . 1 1 40 40 ASP H H 40 8.310 8.310 8.859 -0.549 25768 15729 1 18 . 1 1 41 41 SER N N 41 115.470 115.470 115.213 0.257 25768 15730 1 18 . 1 1 41 41 SER C C 41 174.170 174.170 174.238 -0.068 25768 15731 1 18 . 1 1 41 41 SER CA C 41 59.000 59.000 59.641 -0.641 25768 15732 1 18 . 1 1 41 41 SER CB C 41 64.420 64.420 63.960 0.460 25768 15733 1 18 . 1 1 41 41 SER H H 41 8.130 8.130 8.257 -0.127 25768 15734 1 18 . 1 1 42 42 ASP N N 42 122.430 122.430 119.925 2.505 25768 15735 1 18 . 1 1 42 42 ASP C C 42 175.740 175.740 174.603 1.137 25768 15736 1 18 . 1 1 42 42 ASP CA C 42 54.780 54.780 54.943 -0.163 25768 15737 1 18 . 1 1 42 42 ASP CB C 42 41.620 41.620 40.697 0.923 25768 15738 1 18 . 1 1 42 42 ASP H H 42 8.410 8.410 8.089 0.321 25768 15739 1 18 . 1 1 43 43 THR N N 43 117.580 117.580 114.747 2.833 25768 15740 1 18 . 1 1 43 43 THR C C 43 173.630 173.630 173.556 0.074 25768 15741 1 18 . 1 1 43 43 THR CA C 43 63.120 63.120 60.528 2.592 25768 15742 1 18 . 1 1 43 43 THR CB C 43 70.650 70.650 69.924 0.726 25768 15743 1 18 . 1 1 43 43 THR H H 43 8.010 8.010 7.997 0.013 25768 15744 1 18 . 1 1 44 44 GLN N N 44 125.420 125.420 120.840 4.580 25768 15745 1 18 . 1 1 44 44 GLN C C 44 174.080 174.080 174.506 -0.426 25768 15746 1 18 . 1 1 44 44 GLN CA C 44 55.110 55.110 54.652 0.458 25768 15747 1 18 . 1 1 44 44 GLN CB C 44 31.570 31.570 30.000 1.571 25768 15748 1 18 . 1 1 44 44 GLN H H 44 9.260 9.260 8.191 1.069 25768 15749 1 18 . 1 1 45 45 LEU N N 45 124.190 124.190 125.283 -1.093 25768 15750 1 18 . 1 1 45 45 LEU C C 45 175.970 175.970 176.983 -1.013 25768 15751 1 18 . 1 1 45 45 LEU CA C 45 54.690 54.690 54.824 -0.134 25768 15752 1 18 . 1 1 45 45 LEU CB C 45 42.270 42.270 42.027 0.243 25768 15753 1 18 . 1 1 45 45 LEU H H 45 8.550 8.550 8.579 -0.029 25768 15754 1 18 . 1 1 46 46 GLY N N 46 113.310 113.310 111.708 1.602 25768 15755 1 18 . 1 1 46 46 GLY C C 46 171.180 171.180 172.974 -1.794 25768 15756 1 18 . 1 1 46 46 GLY CA C 46 44.400 44.400 44.306 0.094 25768 15757 1 18 . 1 1 46 46 GLY H H 46 8.810 8.810 8.173 0.637 25768 15758 1 18 . 1 1 47 47 LEU N N 47 123.890 123.890 125.261 -1.371 25768 15759 1 18 . 1 1 47 47 LEU C C 47 175.400 175.400 175.187 0.213 25768 15760 1 18 . 1 1 47 47 LEU CA C 47 53.750 53.750 53.630 0.119 25768 15761 1 18 . 1 1 47 47 LEU CB C 47 46.800 46.800 44.147 2.653 25768 15762 1 18 . 1 1 47 47 LEU H H 47 8.590 8.590 8.795 -0.205 25768 15763 1 18 . 1 1 48 48 THR N N 48 111.210 111.210 118.345 -7.135 25768 15764 1 18 . 1 1 48 48 THR C C 48 172.520 172.520 173.319 -0.799 25768 15765 1 18 . 1 1 48 48 THR CA C 48 58.950 58.950 61.124 -2.174 25768 15766 1 18 . 1 1 48 48 THR CB C 48 72.360 72.360 72.124 0.236 25768 15767 1 18 . 1 1 48 48 THR H H 48 8.620 8.620 9.066 -0.446 25768 15768 1 18 . 1 1 49 49 PHE N N 49 118.810 118.810 126.572 -7.762 25768 15769 1 18 . 1 1 49 49 PHE C C 49 174.700 174.700 174.971 -0.271 25768 15770 1 18 . 1 1 49 49 PHE CA C 49 55.080 55.080 56.700 -1.620 25768 15771 1 18 . 1 1 49 49 PHE CB C 49 42.360 42.360 41.008 1.352 25768 15772 1 18 . 1 1 49 49 PHE H H 49 8.410 8.410 8.632 -0.222 25768 15773 1 18 . 1 1 50 50 THR N N 50 121.230 121.230 120.539 0.691 25768 15774 1 18 . 1 1 50 50 THR C C 50 173.250 173.250 173.235 0.015 25768 15775 1 18 . 1 1 50 50 THR CA C 50 62.740 62.740 61.646 1.094 25768 15776 1 18 . 1 1 50 50 THR CB C 50 73.740 73.740 70.424 3.316 25768 15777 1 18 . 1 1 50 50 THR H H 50 9.330 9.330 8.676 0.654 25768 15778 1 18 . 1 1 51 51 TYR N N 51 126.010 126.010 123.372 2.638 25768 15779 1 18 . 1 1 51 51 TYR C C 51 174.850 174.850 175.247 -0.397 25768 15780 1 18 . 1 1 51 51 TYR CA C 51 56.240 56.240 56.592 -0.352 25768 15781 1 18 . 1 1 51 51 TYR CB C 51 41.630 41.630 39.688 1.942 25768 15782 1 18 . 1 1 51 51 TYR H H 51 9.150 9.150 9.465 -0.315 25768 15783 1 18 . 1 1 52 52 MET N N 52 127.390 127.390 123.109 4.281 25768 15784 1 18 . 1 1 52 52 MET C C 52 174.490 174.490 174.888 -0.398 25768 15785 1 18 . 1 1 52 52 MET CA C 52 52.450 52.450 56.805 -4.355 25768 15786 1 18 . 1 1 52 52 MET CB C 52 28.590 28.590 33.300 -4.710 25768 15787 1 18 . 1 1 52 52 MET H H 52 7.950 7.950 8.289 -0.339 25768 15788 1 18 . 1 1 53 53 PHE N N 53 123.830 123.830 126.540 -2.710 25768 15789 1 18 . 1 1 53 53 PHE C C 53 173.720 173.720 173.693 0.027 25768 15790 1 18 . 1 1 53 53 PHE CA C 53 57.110 57.110 56.805 0.305 25768 15791 1 18 . 1 1 53 53 PHE CB C 53 39.420 39.420 41.259 -1.839 25768 15792 1 18 . 1 1 53 53 PHE H H 53 7.720 7.720 8.535 -0.815 25768 15793 1 18 . 1 1 54 54 ALA N N 54 125.650 125.650 128.031 -2.381 25768 15794 1 18 . 1 1 54 54 ALA C C 54 175.020 175.020 175.478 -0.458 25768 15795 1 18 . 1 1 54 54 ALA CA C 54 50.740 50.740 53.131 -2.391 25768 15796 1 18 . 1 1 54 54 ALA CB C 54 22.700 22.700 18.537 4.163 25768 15797 1 18 . 1 1 54 54 ALA H H 54 8.360 8.360 8.256 0.104 25768 15798 1 18 . 1 1 55 55 ASP N N 55 118.790 118.790 121.283 -2.493 25768 15799 1 18 . 1 1 55 55 ASP C C 55 174.780 174.780 175.605 -0.825 25768 15800 1 18 . 1 1 55 55 ASP CA C 55 58.590 58.590 54.600 3.990 25768 15801 1 18 . 1 1 55 55 ASP CB C 55 40.430 40.430 40.651 -0.222 25768 15802 1 18 . 1 1 55 55 ASP H H 55 8.590 8.590 8.389 0.201 25768 15803 1 18 . 1 1 56 56 LYS N N 56 106.200 106.200 117.269 -11.069 25768 15804 1 18 . 1 1 56 56 LYS C C 56 174.940 174.940 174.793 0.147 25768 15805 1 18 . 1 1 56 56 LYS CA C 56 55.260 55.260 56.931 -1.671 25768 15806 1 18 . 1 1 56 56 LYS CB C 56 34.510 34.510 35.310 -0.800 25768 15807 1 18 . 1 1 56 56 LYS H H 56 7.260 7.260 7.202 0.058 25768 15808 1 18 . 1 1 57 57 TRP N N 57 115.680 115.680 121.030 -5.350 25768 15809 1 18 . 1 1 57 57 TRP C C 57 173.940 173.940 175.369 -1.429 25768 15810 1 18 . 1 1 57 57 TRP CA C 57 55.410 55.410 57.303 -1.893 25768 15811 1 18 . 1 1 57 57 TRP CB C 57 34.470 34.470 31.718 2.752 25768 15812 1 18 . 1 1 57 57 TRP H H 57 6.570 6.570 8.239 -1.669 25768 15813 1 18 . 1 1 58 58 GLY N N 58 107.610 107.610 109.829 -2.219 25768 15814 1 18 . 1 1 58 58 GLY C C 58 172.730 172.730 172.087 0.643 25768 15815 1 18 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.686 -0.636 25768 15816 1 18 . 1 1 58 58 GLY H H 58 9.260 9.260 8.296 0.964 25768 15817 1 18 . 1 1 59 59 VAL N N 59 118.130 118.130 121.461 -3.331 25768 15818 1 18 . 1 1 59 59 VAL C C 59 173.000 173.000 174.308 -1.308 25768 15819 1 18 . 1 1 59 59 VAL CA C 59 59.950 59.950 59.430 0.520 25768 15820 1 18 . 1 1 59 59 VAL CB C 59 35.170 35.170 33.638 1.532 25768 15821 1 18 . 1 1 59 59 VAL H H 59 9.030 9.030 7.939 1.091 25768 15822 1 18 . 1 1 60 60 GLU N N 60 127.900 127.900 122.072 5.828 25768 15823 1 18 . 1 1 60 60 GLU C C 60 174.470 174.470 175.015 -0.545 25768 15824 1 18 . 1 1 60 60 GLU CA C 60 52.940 52.940 54.529 -1.589 25768 15825 1 18 . 1 1 60 60 GLU CB C 60 35.100 35.100 34.011 1.089 25768 15826 1 18 . 1 1 60 60 GLU H H 60 9.440 9.440 8.648 0.792 25768 15827 1 18 . 1 1 61 61 LEU N N 61 127.410 127.410 118.703 8.707 25768 15828 1 18 . 1 1 61 61 LEU C C 61 174.950 174.950 175.703 -0.753 25768 15829 1 18 . 1 1 61 61 LEU CA C 61 53.390 53.390 54.059 -0.669 25768 15830 1 18 . 1 1 61 61 LEU CB C 61 45.980 45.980 44.127 1.853 25768 15831 1 18 . 1 1 61 61 LEU H H 61 8.740 8.740 8.231 0.509 25768 15832 1 18 . 1 1 62 62 VAL N N 62 125.750 125.750 122.852 2.898 25768 15833 1 18 . 1 1 62 62 VAL C C 62 173.960 173.960 174.694 -0.734 25768 15834 1 18 . 1 1 62 62 VAL CA C 62 61.350 61.350 60.839 0.511 25768 15835 1 18 . 1 1 62 62 VAL CB C 62 34.740 34.740 33.845 0.895 25768 15836 1 18 . 1 1 62 62 VAL H H 62 8.790 8.790 8.107 0.683 25768 15837 1 18 . 1 1 63 63 ALA N N 63 127.230 127.230 126.937 0.293 25768 15838 1 18 . 1 1 63 63 ALA C C 63 173.930 173.930 174.613 -0.683 25768 15839 1 18 . 1 1 63 63 ALA CA C 63 51.140 51.140 52.038 -0.898 25768 15840 1 18 . 1 1 63 63 ALA CB C 63 22.500 22.500 21.803 0.697 25768 15841 1 18 . 1 1 63 63 ALA H H 63 8.740 8.740 8.194 0.546 25768 15842 1 18 . 1 1 64 64 ALA N N 64 120.410 120.410 125.671 -5.261 25768 15843 1 18 . 1 1 64 64 ALA C C 64 176.770 176.770 177.439 -0.669 25768 15844 1 18 . 1 1 64 64 ALA CA C 64 51.420 51.420 51.109 0.311 25768 15845 1 18 . 1 1 64 64 ALA CB C 64 22.590 22.590 22.197 0.393 25768 15846 1 18 . 1 1 64 64 ALA H H 64 8.290 8.290 8.385 -0.095 25768 15847 1 18 . 1 1 65 65 THR N N 65 116.130 116.130 118.245 -2.115 25768 15848 1 18 . 1 1 65 65 THR C C 65 171.220 171.220 172.791 -1.571 25768 15849 1 18 . 1 1 65 65 THR CA C 65 58.860 58.860 60.814 -1.954 25768 15850 1 18 . 1 1 65 65 THR CB C 65 72.020 72.020 68.937 3.083 25768 15851 1 18 . 1 1 65 65 THR H H 65 8.760 8.760 8.243 0.517 25768 15852 1 18 . 1 1 66 66 PRO C C 66 176.720 176.720 176.717 0.003 25768 15853 1 18 . 1 1 66 66 PRO CA C 66 63.610 63.610 62.921 0.689 25768 15854 1 18 . 1 1 66 66 PRO CB C 66 32.550 32.550 32.427 0.123 25768 15855 1 18 . 1 1 67 67 PHE N N 67 120.360 120.360 118.721 1.639 25768 15856 1 18 . 1 1 67 67 PHE C C 67 175.480 175.480 176.401 -0.921 25768 15857 1 18 . 1 1 67 67 PHE CA C 67 58.840 58.840 58.744 0.096 25768 15858 1 18 . 1 1 67 67 PHE CB C 67 40.170 40.170 39.959 0.211 25768 15859 1 18 . 1 1 67 67 PHE H H 67 8.590 8.590 8.384 0.206 25768 15860 1 18 . 1 1 68 68 ASN N N 68 119.030 119.030 120.069 -1.039 25768 15861 1 18 . 1 1 68 68 ASN C C 68 174.740 174.740 174.116 0.624 25768 15862 1 18 . 1 1 68 68 ASN CA C 68 53.430 53.430 54.109 -0.680 25768 15863 1 18 . 1 1 68 68 ASN CB C 68 39.420 39.420 39.149 0.271 25768 15864 1 18 . 1 1 68 68 ASN H H 68 8.340 8.340 8.701 -0.361 25768 15865 1 18 . 1 1 69 69 HIS N N 69 119.590 119.590 121.146 -1.556 25768 15866 1 18 . 1 1 69 69 HIS C C 69 174.370 174.370 174.163 0.207 25768 15867 1 18 . 1 1 69 69 HIS CA C 69 55.950 55.950 56.366 -0.416 25768 15868 1 18 . 1 1 69 69 HIS CB C 69 29.960 29.960 29.552 0.408 25768 15869 1 18 . 1 1 69 69 HIS H H 69 8.350 8.350 8.466 -0.116 25768 15870 1 18 . 1 1 70 70 GLN N N 70 121.980 121.980 123.495 -1.515 25768 15871 1 18 . 1 1 70 70 GLN C C 70 175.740 175.740 174.550 1.190 25768 15872 1 18 . 1 1 70 70 GLN CA C 70 56.340 56.340 55.050 1.290 25768 15873 1 18 . 1 1 70 70 GLN CB C 70 29.660 29.660 30.739 -1.079 25768 15874 1 18 . 1 1 70 70 GLN H H 70 8.350 8.350 8.524 -0.174 25768 15875 1 18 . 1 1 71 71 VAL N N 71 120.530 120.530 117.894 2.636 25768 15876 1 18 . 1 1 71 71 VAL C C 71 175.500 175.500 174.844 0.656 25768 15877 1 18 . 1 1 71 71 VAL CA C 71 62.540 62.540 62.114 0.426 25768 15878 1 18 . 1 1 71 71 VAL CB C 71 33.090 33.090 32.530 0.560 25768 15879 1 18 . 1 1 71 71 VAL H H 71 8.020 8.020 8.373 -0.353 25768 15880 1 18 . 1 1 72 72 ASP N N 72 123.910 123.910 126.093 -2.183 25768 15881 1 18 . 1 1 72 72 ASP C C 72 176.300 176.300 176.226 0.074 25768 15882 1 18 . 1 1 72 72 ASP CA C 72 54.340 54.340 52.937 1.403 25768 15883 1 18 . 1 1 72 72 ASP CB C 72 41.480 41.480 43.576 -2.096 25768 15884 1 18 . 1 1 72 72 ASP H H 72 8.280 8.280 8.409 -0.129 25768 15885 1 18 . 1 1 73 73 VAL N N 73 120.580 120.580 120.257 0.323 25768 15886 1 18 . 1 1 73 73 VAL C C 73 176.350 176.350 175.129 1.221 25768 15887 1 18 . 1 1 73 73 VAL CA C 73 62.970 62.970 62.524 0.446 25768 15888 1 18 . 1 1 73 73 VAL CB C 73 32.550 32.550 32.218 0.332 25768 15889 1 18 . 1 1 73 73 VAL H H 73 7.960 7.960 8.161 -0.201 25768 15890 1 18 . 1 1 74 74 LYS N N 74 123.620 123.620 121.962 1.658 25768 15891 1 18 . 1 1 74 74 LYS C C 74 177.130 177.130 175.934 1.196 25768 15892 1 18 . 1 1 74 74 LYS CA C 74 57.060 57.060 55.973 1.087 25768 15893 1 18 . 1 1 74 74 LYS CB C 74 32.860 32.860 33.039 -0.179 25768 15894 1 18 . 1 1 74 74 LYS H H 74 8.230 8.230 7.749 0.481 25768 15895 1 18 . 1 1 75 75 GLY N N 75 109.370 109.370 112.136 -2.766 25768 15896 1 18 . 1 1 75 75 GLY C C 75 174.030 174.030 173.812 0.218 25768 15897 1 18 . 1 1 75 75 GLY CA C 75 45.800 45.800 45.496 0.304 25768 15898 1 18 . 1 1 75 75 GLY H H 75 8.160 8.160 8.501 -0.341 25768 15899 1 18 . 1 1 76 76 LEU N N 76 121.660 121.660 121.859 -0.199 25768 15900 1 18 . 1 1 76 76 LEU C C 76 177.410 177.410 176.881 0.529 25768 15901 1 18 . 1 1 76 76 LEU CA C 76 55.410 55.410 54.552 0.858 25768 15902 1 18 . 1 1 76 76 LEU CB C 76 42.790 42.790 43.764 -0.974 25768 15903 1 18 . 1 1 76 76 LEU H H 76 8.030 8.030 8.121 -0.091 25768 15904 1 18 . 1 1 77 77 GLY N N 77 109.330 109.330 109.718 -0.388 25768 15905 1 18 . 1 1 77 77 GLY C C 77 171.800 171.800 172.227 -0.427 25768 15906 1 18 . 1 1 77 77 GLY CA C 77 44.990 44.990 44.052 0.938 25768 15907 1 18 . 1 1 77 77 GLY H H 77 8.100 8.100 8.367 -0.267 25768 15908 1 18 . 1 1 78 78 PRO C C 78 177.740 177.740 176.708 1.032 25768 15909 1 18 . 1 1 78 78 PRO CA C 78 63.890 63.890 62.926 0.964 25768 15910 1 18 . 1 1 78 78 PRO CB C 78 32.170 32.170 32.233 -0.062 25768 15911 1 18 . 1 1 79 79 GLY N N 79 109.530 109.530 111.637 -2.107 25768 15912 1 18 . 1 1 79 79 GLY C C 79 174.460 174.460 172.896 1.564 25768 15913 1 18 . 1 1 79 79 GLY CA C 79 45.780 45.780 44.806 0.974 25768 15914 1 18 . 1 1 79 79 GLY H H 79 8.410 8.410 8.418 -0.008 25768 15915 1 18 . 1 1 80 80 LEU N N 80 121.880 121.880 119.574 2.306 25768 15916 1 18 . 1 1 80 80 LEU C C 80 177.100 177.100 174.774 2.326 25768 15917 1 18 . 1 1 80 80 LEU CA C 80 55.720 55.720 54.755 0.966 25768 15918 1 18 . 1 1 80 80 LEU CB C 80 42.580 42.580 45.726 -3.146 25768 15919 1 18 . 1 1 80 80 LEU H H 80 8.010 8.010 8.015 -0.005 25768 15920 1 18 . 1 1 81 81 ASP N N 81 119.990 119.990 121.536 -1.546 25768 15921 1 18 . 1 1 81 81 ASP C C 81 176.880 176.880 175.664 1.216 25768 15922 1 18 . 1 1 81 81 ASP CA C 81 54.770 54.770 54.392 0.378 25768 15923 1 18 . 1 1 81 81 ASP CB C 81 41.390 41.390 42.138 -0.748 25768 15924 1 18 . 1 1 81 81 ASP H H 81 8.220 8.220 8.496 -0.276 25768 15925 1 18 . 1 1 82 82 GLY N N 82 109.270 109.270 110.378 -1.108 25768 15926 1 18 . 1 1 82 82 GLY C C 82 174.190 174.190 175.361 -1.171 25768 15927 1 18 . 1 1 82 82 GLY CA C 82 45.990 45.990 45.444 0.546 25768 15928 1 18 . 1 1 82 82 GLY H H 82 8.170 8.170 8.347 -0.177 25768 15929 1 18 . 1 1 83 83 LYS N N 83 121.000 121.000 121.338 -0.338 25768 15930 1 18 . 1 1 83 83 LYS C C 83 176.610 176.610 176.179 0.431 25768 15931 1 18 . 1 1 83 83 LYS CA C 83 56.620 56.620 55.888 0.732 25768 15932 1 18 . 1 1 83 83 LYS CB C 83 33.020 33.020 33.233 -0.213 25768 15933 1 18 . 1 1 83 83 LYS H H 83 7.970 7.970 8.028 -0.058 25768 15934 1 18 . 1 1 84 84 LEU N N 84 123.120 123.120 124.019 -0.899 25768 15935 1 18 . 1 1 84 84 LEU C C 84 176.920 176.920 176.284 0.636 25768 15936 1 18 . 1 1 84 84 LEU CA C 84 55.550 55.550 54.023 1.527 25768 15937 1 18 . 1 1 84 84 LEU CB C 84 42.430 42.430 42.669 -0.239 25768 15938 1 18 . 1 1 84 84 LEU H H 84 8.130 8.130 8.461 -0.331 25768 15939 1 18 . 1 1 85 85 ALA N N 85 123.930 123.930 128.564 -4.634 25768 15940 1 18 . 1 1 85 85 ALA C C 85 177.060 177.060 177.233 -0.173 25768 15941 1 18 . 1 1 85 85 ALA CA C 85 52.790 52.790 51.533 1.257 25768 15942 1 18 . 1 1 85 85 ALA CB C 85 19.670 19.670 19.377 0.293 25768 15943 1 18 . 1 1 85 85 ALA H H 85 8.040 8.040 8.469 -0.429 25768 15944 1 18 . 1 1 86 86 ASP N N 86 119.760 119.760 123.788 -4.028 25768 15945 1 18 . 1 1 86 86 ASP C C 86 175.820 175.820 175.940 -0.120 25768 15946 1 18 . 1 1 86 86 ASP CA C 86 54.520 54.520 53.968 0.552 25768 15947 1 18 . 1 1 86 86 ASP CB C 86 41.390 41.390 42.065 -0.675 25768 15948 1 18 . 1 1 86 86 ASP H H 86 8.110 8.110 8.611 -0.501 25768 15949 1 18 . 1 1 87 87 ILE N N 87 120.620 120.620 119.164 1.456 25768 15950 1 18 . 1 1 87 87 ILE C C 87 175.740 175.740 175.591 0.149 25768 15951 1 18 . 1 1 87 87 ILE CA C 87 61.160 61.160 60.819 0.341 25768 15952 1 18 . 1 1 87 87 ILE CB C 87 39.260 39.260 40.511 -1.252 25768 15953 1 18 . 1 1 87 87 ILE H H 87 7.800 7.800 8.201 -0.401 25768 15954 1 18 . 1 1 88 88 LYS N N 88 125.820 125.820 125.671 0.149 25768 15955 1 18 . 1 1 88 88 LYS C C 88 175.340 175.340 175.912 -0.572 25768 15956 1 18 . 1 1 88 88 LYS CA C 88 56.300 56.300 55.748 0.552 25768 15957 1 18 . 1 1 88 88 LYS CB C 88 32.900 32.900 33.138 -0.238 25768 15958 1 18 . 1 1 88 88 LYS H H 88 8.250 8.250 8.515 -0.265 25768 15959 1 18 . 1 1 89 89 GLN N N 89 121.750 121.750 124.170 -2.420 25768 15960 1 18 . 1 1 89 89 GLN C C 89 175.000 175.000 175.343 -0.343 25768 15961 1 18 . 1 1 89 89 GLN CA C 89 55.210 55.210 55.443 -0.233 25768 15962 1 18 . 1 1 89 89 GLN CB C 89 30.570 30.570 28.850 1.720 25768 15963 1 18 . 1 1 89 89 GLN H H 89 8.000 8.000 8.656 -0.656 25768 15964 1 18 . 1 1 90 90 LEU N N 90 126.660 126.660 128.220 -1.560 25768 15965 1 18 . 1 1 90 90 LEU C C 90 174.240 174.240 175.650 -1.410 25768 15966 1 18 . 1 1 90 90 LEU CA C 90 52.720 52.720 53.337 -0.617 25768 15967 1 18 . 1 1 90 90 LEU CB C 90 42.350 42.350 42.092 0.258 25768 15968 1 18 . 1 1 90 90 LEU H H 90 8.630 8.630 8.348 0.282 25768 15969 1 18 . 1 1 92 92 PRO C C 92 173.900 173.900 176.561 -2.661 25768 15970 1 18 . 1 1 92 92 PRO CA C 92 63.320 63.320 62.790 0.530 25768 15971 1 18 . 1 1 92 92 PRO CB C 92 31.920 31.920 32.708 -0.788 25768 15972 1 18 . 1 1 93 93 THR N N 93 119.770 119.770 115.571 4.199 25768 15973 1 18 . 1 1 93 93 THR C C 93 171.360 171.360 173.757 -2.397 25768 15974 1 18 . 1 1 93 93 THR CA C 93 62.610 62.610 62.505 0.105 25768 15975 1 18 . 1 1 93 93 THR CB C 93 72.680 72.680 69.723 2.957 25768 15976 1 18 . 1 1 93 93 THR H H 93 8.290 8.290 8.237 0.053 25768 15977 1 18 . 1 1 94 94 LEU N N 94 128.880 128.880 128.608 0.272 25768 15978 1 18 . 1 1 94 94 LEU C C 94 175.130 175.130 174.861 0.269 25768 15979 1 18 . 1 1 94 94 LEU CA C 94 53.520 53.520 54.112 -0.592 25768 15980 1 18 . 1 1 94 94 LEU CB C 94 46.140 46.140 44.447 1.693 25768 15981 1 18 . 1 1 94 94 LEU H H 94 8.680 8.680 8.588 0.092 25768 15982 1 18 . 1 1 95 95 LEU N N 95 123.630 123.630 121.584 2.046 25768 15983 1 18 . 1 1 95 95 LEU C C 95 175.540 175.540 174.520 1.020 25768 15984 1 18 . 1 1 95 95 LEU CA C 95 55.190 55.190 53.286 1.904 25768 15985 1 18 . 1 1 95 95 LEU CB C 95 45.300 45.300 45.206 0.094 25768 15986 1 18 . 1 1 95 95 LEU H H 95 9.580 9.580 8.801 0.779 25768 15987 1 18 . 1 1 96 96 LEU N N 96 123.150 123.150 114.467 8.683 25768 15988 1 18 . 1 1 96 96 LEU C C 96 174.960 174.960 175.564 -0.604 25768 15989 1 18 . 1 1 96 96 LEU CA C 96 54.420 54.420 54.115 0.305 25768 15990 1 18 . 1 1 96 96 LEU CB C 96 44.560 44.560 44.769 -0.209 25768 15991 1 18 . 1 1 96 96 LEU H H 96 8.770 8.770 9.103 -0.333 25768 15992 1 18 . 1 1 97 97 GLN N N 97 121.290 121.290 120.261 1.029 25768 15993 1 18 . 1 1 97 97 GLN C C 97 174.380 174.380 174.746 -0.366 25768 15994 1 18 . 1 1 97 97 GLN CA C 97 54.740 54.740 54.324 0.416 25768 15995 1 18 . 1 1 97 97 GLN CB C 97 36.600 36.600 33.574 3.026 25768 15996 1 18 . 1 1 97 97 GLN H H 97 9.480 9.480 9.293 0.187 25768 15997 1 18 . 1 1 98 98 TYR N N 98 122.250 122.250 119.807 2.443 25768 15998 1 18 . 1 1 98 98 TYR C C 98 173.460 173.460 174.989 -1.529 25768 15999 1 18 . 1 1 98 98 TYR CA C 98 55.160 55.160 56.201 -1.041 25768 16000 1 18 . 1 1 98 98 TYR CB C 98 42.420 42.420 42.023 0.397 25768 16001 1 18 . 1 1 98 98 TYR H H 98 9.010 9.010 8.653 0.357 25768 16002 1 18 . 1 1 99 99 TYR N N 99 126.860 126.860 119.584 7.276 25768 16003 1 18 . 1 1 99 99 TYR C C 99 175.380 175.380 173.815 1.565 25768 16004 1 18 . 1 1 99 99 TYR CA C 99 54.220 54.220 53.888 0.332 25768 16005 1 18 . 1 1 99 99 TYR CB C 99 38.890 38.890 37.905 0.985 25768 16006 1 18 . 1 1 99 99 TYR H H 99 8.300 8.300 7.906 0.394 25768 16007 1 18 . 1 1 100 100 PRO C C 100 178.330 178.330 176.806 1.524 25768 16008 1 18 . 1 1 100 100 PRO CA C 100 64.750 64.750 64.366 0.384 25768 16009 1 18 . 1 1 100 100 PRO CB C 100 32.130 32.130 31.948 0.182 25768 16010 1 18 . 1 1 101 101 MET N N 101 114.520 114.520 118.560 -4.040 25768 16011 1 18 . 1 1 101 101 MET C C 101 178.240 178.240 175.730 2.510 25768 16012 1 18 . 1 1 101 101 MET CA C 101 53.500 53.500 54.270 -0.770 25768 16013 1 18 . 1 1 101 101 MET CB C 101 30.160 30.160 32.402 -2.242 25768 16014 1 18 . 1 1 101 101 MET H H 101 9.390 9.390 7.691 1.699 25768 16015 1 18 . 1 1 102 102 GLY N N 102 117.500 117.500 108.210 9.290 25768 16016 1 18 . 1 1 102 102 GLY C C 102 175.690 175.690 174.601 1.089 25768 16017 1 18 . 1 1 102 102 GLY CA C 102 46.760 46.760 45.010 1.750 25768 16018 1 18 . 1 1 102 102 GLY H H 102 8.640 8.640 7.469 1.171 25768 16019 1 18 . 1 1 103 103 GLY N N 103 111.030 111.030 112.178 -1.148 25768 16020 1 18 . 1 1 103 103 GLY C C 103 174.070 174.070 174.455 -0.385 25768 16021 1 18 . 1 1 103 103 GLY CA C 103 46.140 46.140 44.906 1.234 25768 16022 1 18 . 1 1 103 103 GLY H H 103 9.390 9.390 8.057 1.333 25768 16023 1 18 . 1 1 104 104 THR N N 104 109.290 109.290 114.327 -5.037 25768 16024 1 18 . 1 1 104 104 THR C C 104 174.290 174.290 174.568 -0.278 25768 16025 1 18 . 1 1 104 104 THR CA C 104 60.900 60.900 59.971 0.929 25768 16026 1 18 . 1 1 104 104 THR CB C 104 72.070 72.070 70.132 1.938 25768 16027 1 18 . 1 1 104 104 THR H H 104 7.290 7.290 7.853 -0.563 25768 16028 1 18 . 1 1 105 105 ASN C C 105 175.050 175.050 174.600 0.450 25768 16029 1 18 . 1 1 105 105 ASN CA C 105 52.880 52.880 53.308 -0.428 25768 16030 1 18 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.756 -0.496 25768 16031 1 18 . 1 1 106 106 SER N N 106 113.000 113.000 114.742 -1.742 25768 16032 1 18 . 1 1 106 106 SER C C 106 176.000 176.000 174.188 1.812 25768 16033 1 18 . 1 1 106 106 SER CA C 106 58.700 58.700 56.952 1.748 25768 16034 1 18 . 1 1 106 106 SER CB C 106 64.540 64.540 64.521 0.019 25768 16035 1 18 . 1 1 106 106 SER H H 106 7.450 7.450 7.516 -0.066 25768 16036 1 18 . 1 1 107 107 ALA N N 107 132.220 132.220 125.968 6.252 25768 16037 1 18 . 1 1 107 107 ALA C C 107 176.610 176.610 176.933 -0.323 25768 16038 1 18 . 1 1 107 107 ALA CA C 107 54.380 54.380 52.318 2.062 25768 16039 1 18 . 1 1 107 107 ALA CB C 107 18.690 18.690 18.992 -0.302 25768 16040 1 18 . 1 1 107 107 ALA H H 107 8.870 8.870 8.554 0.316 25768 16041 1 18 . 1 1 108 108 PHE N N 108 116.050 116.050 118.123 -2.073 25768 16042 1 18 . 1 1 108 108 PHE C C 108 174.270 174.270 175.629 -1.359 25768 16043 1 18 . 1 1 108 108 PHE CA C 108 56.140 56.140 58.623 -2.483 25768 16044 1 18 . 1 1 108 108 PHE CB C 108 40.520 40.520 38.494 2.026 25768 16045 1 18 . 1 1 108 108 PHE H H 108 7.550 7.550 7.796 -0.246 25768 16046 1 18 . 1 1 109 109 GLN N N 109 128.260 128.260 124.455 3.805 25768 16047 1 18 . 1 1 109 109 GLN C C 109 172.300 172.300 173.905 -1.605 25768 16048 1 18 . 1 1 109 109 GLN CA C 109 52.310 52.310 52.765 -0.455 25768 16049 1 18 . 1 1 109 109 GLN CB C 109 29.050 29.050 29.375 -0.325 25768 16050 1 18 . 1 1 109 109 GLN H H 109 9.060 9.060 8.343 0.717 25768 16051 1 18 . 1 1 110 110 PRO C C 110 175.020 175.020 175.950 -0.930 25768 16052 1 18 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.600 -1.050 25768 16053 1 18 . 1 1 110 110 PRO CB C 110 33.280 33.280 32.074 1.206 25768 16054 1 18 . 1 1 111 111 TYR N N 111 115.730 115.730 122.871 -7.141 25768 16055 1 18 . 1 1 111 111 TYR C C 111 173.850 173.850 175.426 -1.576 25768 16056 1 18 . 1 1 111 111 TYR CA C 111 56.470 56.470 57.382 -0.911 25768 16057 1 18 . 1 1 111 111 TYR CB C 111 38.650 38.650 42.233 -3.583 25768 16058 1 18 . 1 1 111 111 TYR H H 111 8.500 8.500 9.159 -0.659 25768 16059 1 18 . 1 1 112 112 GLY N N 112 103.570 103.570 110.458 -6.888 25768 16060 1 18 . 1 1 112 112 GLY C C 112 172.020 172.020 173.363 -1.343 25768 16061 1 18 . 1 1 112 112 GLY CA C 112 43.950 43.950 44.767 -0.818 25768 16062 1 18 . 1 1 112 112 GLY H H 112 8.110 8.110 8.518 -0.408 25768 16063 1 18 . 1 1 113 113 GLY N N 113 108.510 108.510 110.580 -2.070 25768 16064 1 18 . 1 1 113 113 GLY C C 113 171.540 171.540 172.187 -0.647 25768 16065 1 18 . 1 1 113 113 GLY CA C 113 46.120 46.120 44.213 1.907 25768 16066 1 18 . 1 1 113 113 GLY H H 113 9.080 9.080 8.190 0.890 25768 16067 1 18 . 1 1 114 114 LEU N N 114 120.270 120.270 125.327 -5.057 25768 16068 1 18 . 1 1 114 114 LEU C C 114 175.810 175.810 175.754 0.056 25768 16069 1 18 . 1 1 114 114 LEU CA C 114 53.920 53.920 53.903 0.017 25768 16070 1 18 . 1 1 114 114 LEU CB C 114 47.940 47.940 46.982 0.958 25768 16071 1 18 . 1 1 114 114 LEU H H 114 8.620 8.620 8.512 0.108 25768 16072 1 18 . 1 1 115 115 GLY N N 115 110.620 110.620 110.999 -0.379 25768 16073 1 18 . 1 1 115 115 GLY C C 115 171.560 171.560 172.324 -0.764 25768 16074 1 18 . 1 1 115 115 GLY CA C 115 46.940 46.940 43.880 3.060 25768 16075 1 18 . 1 1 115 115 GLY H H 115 9.000 9.000 8.470 0.530 25768 16076 1 18 . 1 1 116 116 VAL N N 116 113.600 113.600 120.921 -7.321 25768 16077 1 18 . 1 1 116 116 VAL C C 116 174.120 174.120 174.475 -0.355 25768 16078 1 18 . 1 1 116 116 VAL CA C 116 58.970 58.970 60.761 -1.792 25768 16079 1 18 . 1 1 116 116 VAL CB C 116 36.600 36.600 33.885 2.716 25768 16080 1 18 . 1 1 116 116 VAL H H 116 8.680 8.680 7.703 0.977 25768 16081 1 18 . 1 1 117 117 ASN N N 117 120.020 120.020 124.892 -4.872 25768 16082 1 18 . 1 1 117 117 ASN CA C 117 52.190 52.190 52.750 -0.560 25768 16083 1 18 . 1 1 117 117 ASN CB C 117 42.450 42.450 41.562 0.888 25768 16084 1 18 . 1 1 117 117 ASN H H 117 8.840 8.840 8.472 0.368 25768 16085 1 18 . 1 1 119 119 THR C C 119 174.350 174.350 172.877 1.473 25768 16086 1 18 . 1 1 119 119 THR CA C 119 63.140 63.140 61.875 1.265 25768 16087 1 18 . 1 1 119 119 THR CB C 119 70.170 70.170 69.418 0.752 25768 16088 1 18 . 1 1 120 120 THR N N 120 114.120 114.120 117.582 -3.462 25768 16089 1 18 . 1 1 120 120 THR C C 120 174.220 174.220 174.515 -0.295 25768 16090 1 18 . 1 1 120 120 THR CA C 120 61.900 61.900 61.881 0.019 25768 16091 1 18 . 1 1 120 120 THR CB C 120 70.140 70.140 69.494 0.646 25768 16092 1 18 . 1 1 120 120 THR H H 120 7.570 7.570 8.144 -0.574 25768 16093 1 18 . 1 1 121 121 PHE N N 121 121.230 121.230 123.774 -2.544 25768 16094 1 18 . 1 1 121 121 PHE C C 121 174.910 174.910 176.197 -1.287 25768 16095 1 18 . 1 1 121 121 PHE CA C 121 58.720 58.720 57.955 0.765 25768 16096 1 18 . 1 1 121 121 PHE CB C 121 40.470 40.470 40.370 0.100 25768 16097 1 18 . 1 1 121 121 PHE H H 121 7.830 7.830 8.466 -0.636 25768 16098 1 18 . 1 1 122 122 PHE C C 122 175.070 175.070 174.997 0.073 25768 16099 1 18 . 1 1 122 122 PHE CA C 122 57.890 57.890 58.799 -0.909 25768 16100 1 18 . 1 1 122 122 PHE CB C 122 39.870 39.870 39.138 0.732 25768 16101 1 18 . 1 1 123 123 ASP N N 123 122.170 122.170 119.967 2.203 25768 16102 1 18 . 1 1 123 123 ASP C C 123 176.150 176.150 176.531 -0.381 25768 16103 1 18 . 1 1 123 123 ASP CA C 123 54.530 54.530 54.010 0.520 25768 16104 1 18 . 1 1 123 123 ASP CB C 123 41.830 41.830 40.170 1.660 25768 16105 1 18 . 1 1 123 123 ASP H H 123 7.950 7.950 8.283 -0.333 25768 16106 1 18 . 1 1 124 124 GLU N N 124 122.690 122.690 120.190 2.500 25768 16107 1 18 . 1 1 124 124 GLU C C 124 176.630 176.630 177.513 -0.883 25768 16108 1 18 . 1 1 124 124 GLU CA C 124 57.620 57.620 59.222 -1.603 25768 16109 1 18 . 1 1 124 124 GLU CB C 124 30.450 30.450 29.877 0.573 25768 16110 1 18 . 1 1 124 124 GLU H H 124 8.340 8.340 8.654 -0.314 25768 16111 1 18 . 1 1 125 125 ASP N N 125 121.280 121.280 119.375 1.905 25768 16112 1 18 . 1 1 125 125 ASP C C 125 176.940 176.940 177.609 -0.669 25768 16113 1 18 . 1 1 125 125 ASP CA C 125 55.180 55.180 56.369 -1.189 25768 16114 1 18 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.571 0.650 25768 16115 1 18 . 1 1 125 125 ASP H H 125 8.310 8.310 8.479 -0.169 25768 16116 1 18 . 1 1 126 126 LEU N N 126 122.830 122.830 119.368 3.462 25768 16117 1 18 . 1 1 126 126 LEU C C 126 178.020 178.020 178.470 -0.450 25768 16118 1 18 . 1 1 126 126 LEU CA C 126 56.450 56.450 56.819 -0.369 25768 16119 1 18 . 1 1 126 126 LEU CB C 126 42.150 42.150 41.711 0.439 25768 16120 1 18 . 1 1 126 126 LEU H H 126 8.010 8.010 7.866 0.144 25768 16121 1 18 . 1 1 127 127 ALA N N 127 122.660 122.660 118.682 3.978 25768 16122 1 18 . 1 1 127 127 ALA C C 127 178.600 178.600 177.485 1.115 25768 16123 1 18 . 1 1 127 127 ALA CA C 127 53.780 53.780 53.006 0.774 25768 16124 1 18 . 1 1 127 127 ALA CB C 127 19.000 19.000 19.809 -0.809 25768 16125 1 18 . 1 1 127 127 ALA H H 127 8.100 8.100 7.731 0.369 25768 16126 1 18 . 1 1 128 128 SER N N 128 113.740 113.740 114.544 -0.804 25768 16127 1 18 . 1 1 128 128 SER C C 128 175.010 175.010 173.029 1.981 25768 16128 1 18 . 1 1 128 128 SER CA C 128 59.580 59.580 59.074 0.506 25768 16129 1 18 . 1 1 128 128 SER CB C 128 63.800 63.800 62.468 1.332 25768 16130 1 18 . 1 1 128 128 SER H H 128 7.920 7.920 8.055 -0.135 25768 16131 1 18 . 1 1 129 129 ASN N N 129 120.300 120.300 120.481 -0.181 25768 16132 1 18 . 1 1 129 129 ASN C C 129 175.590 175.590 175.253 0.337 25768 16133 1 18 . 1 1 129 129 ASN CA C 129 54.180 54.180 53.442 0.738 25768 16134 1 18 . 1 1 129 129 ASN CB C 129 38.900 38.900 39.096 -0.196 25768 16135 1 18 . 1 1 129 129 ASN H H 129 8.120 8.120 8.543 -0.423 25768 16136 1 18 . 1 1 130 130 ARG N N 130 120.630 120.630 121.949 -1.319 25768 16137 1 18 . 1 1 130 130 ARG C C 130 176.720 176.720 175.516 1.204 25768 16138 1 18 . 1 1 130 130 ARG CA C 130 57.240 57.240 57.385 -0.145 25768 16139 1 18 . 1 1 130 130 ARG CB C 130 30.500 30.500 28.691 1.809 25768 16140 1 18 . 1 1 130 130 ARG H H 130 8.050 8.050 9.069 -1.019 25768 16141 1 18 . 1 1 131 131 LYS N N 131 121.150 121.150 113.392 7.758 25768 16142 1 18 . 1 1 131 131 LYS C C 131 176.750 176.750 175.121 1.629 25768 16143 1 18 . 1 1 131 131 LYS CA C 131 57.050 57.050 57.543 -0.493 25768 16144 1 18 . 1 1 131 131 LYS CB C 131 32.870 32.870 31.299 1.571 25768 16145 1 18 . 1 1 131 131 LYS H H 131 8.020 8.020 8.374 -0.354 25768 16146 1 18 . 1 1 132 132 ALA N N 132 124.110 124.110 121.375 2.735 25768 16147 1 18 . 1 1 132 132 ALA C C 132 177.680 177.680 175.847 1.833 25768 16148 1 18 . 1 1 132 132 ALA CA C 132 53.070 53.070 52.162 0.908 25768 16149 1 18 . 1 1 132 132 ALA CB C 132 19.250 19.250 20.411 -1.161 25768 16150 1 18 . 1 1 132 132 ALA H H 132 8.010 8.010 7.551 0.459 25768 16151 1 18 . 1 1 133 133 GLN N N 133 118.830 118.830 119.804 -0.974 25768 16152 1 18 . 1 1 133 133 GLN C C 133 176.380 176.380 175.190 1.190 25768 16153 1 18 . 1 1 133 133 GLN CA C 133 56.400 56.400 56.356 0.044 25768 16154 1 18 . 1 1 133 133 GLN CB C 133 29.670 29.670 28.301 1.369 25768 16155 1 18 . 1 1 133 133 GLN H H 133 8.070 8.070 8.630 -0.560 25768 16156 1 18 . 1 1 134 134 GLY N N 134 109.400 109.400 108.735 0.665 25768 16157 1 18 . 1 1 134 134 GLY C C 134 174.060 174.060 172.891 1.169 25768 16158 1 18 . 1 1 134 134 GLY CA C 134 45.690 45.690 44.961 0.729 25768 16159 1 18 . 1 1 134 134 GLY H H 134 8.150 8.150 8.278 -0.128 25768 16160 1 18 . 1 1 135 135 PHE N N 135 120.480 120.480 120.854 -0.374 25768 16161 1 18 . 1 1 135 135 PHE C C 135 176.000 176.000 176.542 -0.542 25768 16162 1 18 . 1 1 135 135 PHE CA C 135 58.370 58.370 58.852 -0.482 25768 16163 1 18 . 1 1 135 135 PHE CB C 135 39.710 39.710 40.211 -0.501 25768 16164 1 18 . 1 1 135 135 PHE H H 135 8.060 8.060 8.290 -0.230 25768 16165 1 18 . 1 1 136 136 SER N N 136 116.740 116.740 114.741 1.999 25768 16166 1 18 . 1 1 136 136 SER C C 136 174.620 174.620 173.806 0.814 25768 16167 1 18 . 1 1 136 136 SER CA C 136 58.870 58.870 59.310 -0.440 25768 16168 1 18 . 1 1 136 136 SER CB C 136 64.200 64.200 63.618 0.582 25768 16169 1 18 . 1 1 136 136 SER H H 136 8.160 8.160 8.475 -0.315 25768 16170 1 18 . 1 1 137 137 SER N N 137 117.650 117.650 115.599 2.051 25768 16171 1 18 . 1 1 137 137 SER C C 137 174.410 174.410 173.213 1.197 25768 16172 1 18 . 1 1 137 137 SER CA C 137 58.880 58.880 59.227 -0.347 25768 16173 1 18 . 1 1 137 137 SER CB C 137 64.140 64.140 62.975 1.165 25768 16174 1 18 . 1 1 137 137 SER H H 137 8.140 8.140 8.336 -0.196 25768 16175 1 18 . 1 1 138 138 MET N N 138 121.980 121.980 122.947 -0.967 25768 16176 1 18 . 1 1 138 138 MET C C 138 175.680 175.680 175.392 0.288 25768 16177 1 18 . 1 1 138 138 MET CA C 138 56.180 56.180 55.404 0.777 25768 16178 1 18 . 1 1 138 138 MET CB C 138 33.240 33.240 33.285 -0.045 25768 16179 1 18 . 1 1 138 138 MET H H 138 8.110 8.110 8.514 -0.404 25768 16180 1 18 . 1 1 139 139 LYS N N 139 122.110 122.110 122.316 -0.206 25768 16181 1 18 . 1 1 139 139 LYS C C 139 176.220 176.220 175.143 1.077 25768 16182 1 18 . 1 1 139 139 LYS CA C 139 56.370 56.370 56.382 -0.012 25768 16183 1 18 . 1 1 139 139 LYS CB C 139 33.220 33.220 34.248 -1.028 25768 16184 1 18 . 1 1 139 139 LYS H H 139 8.140 8.140 8.242 -0.102 25768 16185 1 18 . 1 1 140 140 LEU N N 140 123.860 123.860 122.304 1.556 25768 16186 1 18 . 1 1 140 140 LEU C C 140 177.100 177.100 175.235 1.865 25768 16187 1 18 . 1 1 140 140 LEU CA C 140 55.710 55.710 55.306 0.404 25768 16188 1 18 . 1 1 140 140 LEU CB C 140 42.460 42.460 41.932 0.528 25768 16189 1 18 . 1 1 140 140 LEU H H 140 8.140 8.140 8.350 -0.210 25768 16190 1 18 . 1 1 141 141 GLN N N 141 120.350 120.350 121.498 -1.148 25768 16191 1 18 . 1 1 141 141 GLN C C 141 175.170 175.170 175.015 0.155 25768 16192 1 18 . 1 1 141 141 GLN CA C 141 56.200 56.200 55.327 0.873 25768 16193 1 18 . 1 1 141 141 GLN CB C 141 29.950 29.950 30.398 -0.448 25768 16194 1 18 . 1 1 141 141 GLN H H 141 8.210 8.210 8.024 0.186 25768 16195 1 18 . 1 1 142 142 ASP N N 142 120.950 120.950 121.018 -0.068 25768 16196 1 18 . 1 1 142 142 ASP C C 142 175.840 175.840 174.742 1.098 25768 16197 1 18 . 1 1 142 142 ASP CA C 142 54.700 54.700 54.157 0.543 25768 16198 1 18 . 1 1 142 142 ASP CB C 142 41.760 41.760 41.815 -0.055 25768 16199 1 18 . 1 1 142 142 ASP H H 142 8.120 8.120 8.468 -0.348 25768 16200 1 18 . 1 1 143 143 SER N N 143 114.880 114.880 113.665 1.215 25768 16201 1 18 . 1 1 143 143 SER C C 143 173.290 173.290 172.351 0.939 25768 16202 1 18 . 1 1 143 143 SER CA C 143 58.450 58.450 58.097 0.353 25768 16203 1 18 . 1 1 143 143 SER CB C 143 64.760 64.760 64.816 -0.056 25768 16204 1 18 . 1 1 143 143 SER H H 143 7.960 7.960 7.777 0.183 25768 16205 1 18 . 1 1 144 144 TRP N N 144 123.110 123.110 120.958 2.152 25768 16206 1 18 . 1 1 144 144 TRP C C 144 175.880 175.880 175.813 0.067 25768 16207 1 18 . 1 1 144 144 TRP CA C 144 56.420 56.420 57.351 -0.931 25768 16208 1 18 . 1 1 144 144 TRP CB C 144 31.160 31.160 31.794 -0.634 25768 16209 1 18 . 1 1 144 144 TRP H H 144 8.080 8.080 8.553 -0.473 25768 16210 1 18 . 1 1 145 145 GLY N N 145 110.410 110.410 111.823 -1.413 25768 16211 1 18 . 1 1 145 145 GLY C C 145 172.870 172.870 173.053 -0.183 25768 16212 1 18 . 1 1 145 145 GLY CA C 145 45.130 45.130 44.640 0.490 25768 16213 1 18 . 1 1 145 145 GLY H H 145 8.660 8.660 8.727 -0.067 25768 16214 1 18 . 1 1 148 148 GLY C C 148 171.800 171.800 171.900 -0.100 25768 16215 1 18 . 1 1 148 148 GLY CA C 148 44.140 44.140 43.736 0.404 25768 16216 1 18 . 1 1 149 149 GLU N N 149 123.070 123.070 121.808 1.262 25768 16217 1 18 . 1 1 149 149 GLU C C 149 174.210 174.210 174.221 -0.011 25768 16218 1 18 . 1 1 149 149 GLU CA C 149 55.120 55.120 55.594 -0.475 25768 16219 1 18 . 1 1 149 149 GLU CB C 149 37.410 37.410 34.671 2.739 25768 16220 1 18 . 1 1 149 149 GLU H H 149 8.550 8.550 7.869 0.681 25768 16221 1 18 . 1 1 150 150 LEU N N 150 126.130 126.130 122.323 3.807 25768 16222 1 18 . 1 1 150 150 LEU C C 150 174.410 174.410 175.862 -1.452 25768 16223 1 18 . 1 1 150 150 LEU CA C 150 54.260 54.260 54.150 0.110 25768 16224 1 18 . 1 1 150 150 LEU CB C 150 47.510 47.510 44.532 2.978 25768 16225 1 18 . 1 1 150 150 LEU H H 150 8.550 8.550 8.395 0.155 25768 16226 1 18 . 1 1 151 151 GLY N N 151 109.500 109.500 111.360 -1.860 25768 16227 1 18 . 1 1 151 151 GLY C C 151 170.610 170.610 172.467 -1.857 25768 16228 1 18 . 1 1 151 151 GLY CA C 151 45.980 45.980 43.827 2.154 25768 16229 1 18 . 1 1 151 151 GLY H H 151 8.090 8.090 9.028 -0.938 25768 16230 1 18 . 1 1 152 152 PHE N N 152 110.960 110.960 127.149 -16.189 25768 16231 1 18 . 1 1 152 152 PHE C C 152 171.510 171.510 173.963 -2.453 25768 16232 1 18 . 1 1 152 152 PHE CA C 152 58.170 58.170 57.971 0.199 25768 16233 1 18 . 1 1 152 152 PHE CB C 152 41.690 41.690 42.249 -0.559 25768 16234 1 18 . 1 1 152 152 PHE H H 152 8.380 8.380 9.418 -1.038 25768 16235 1 18 . 1 1 153 153 ASP N N 153 118.880 118.880 127.256 -8.376 25768 16236 1 18 . 1 1 153 153 ASP C C 153 176.520 176.520 174.501 2.019 25768 16237 1 18 . 1 1 153 153 ASP CA C 153 52.940 52.940 52.051 0.889 25768 16238 1 18 . 1 1 153 153 ASP CB C 153 44.540 44.540 44.418 0.122 25768 16239 1 18 . 1 1 153 153 ASP H H 153 7.970 7.970 8.751 -0.781 25768 16240 1 18 . 1 1 154 154 TYR N N 154 123.630 123.630 123.911 -0.281 25768 16241 1 18 . 1 1 154 154 TYR C C 154 175.610 175.610 174.349 1.261 25768 16242 1 18 . 1 1 154 154 TYR CA C 154 57.310 57.310 57.013 0.297 25768 16243 1 18 . 1 1 154 154 TYR CB C 154 42.040 42.040 42.017 0.023 25768 16244 1 18 . 1 1 154 154 TYR H H 154 9.730 9.730 8.624 1.106 25768 16245 1 18 . 1 1 155 155 MET N N 155 126.190 126.190 126.734 -0.544 25768 16246 1 18 . 1 1 155 155 MET C C 155 174.970 174.970 174.754 0.216 25768 16247 1 18 . 1 1 155 155 MET CA C 155 54.720 54.720 55.862 -1.143 25768 16248 1 18 . 1 1 155 155 MET CB C 155 28.300 28.300 33.149 -4.849 25768 16249 1 18 . 1 1 155 155 MET H H 155 8.600 8.600 8.329 0.272 25768 16250 1 18 . 1 1 156 156 LEU N N 156 125.290 125.290 126.461 -1.171 25768 16251 1 18 . 1 1 156 156 LEU C C 156 177.680 177.680 177.292 0.388 25768 16252 1 18 . 1 1 156 156 LEU CA C 156 56.040 56.040 54.280 1.760 25768 16253 1 18 . 1 1 156 156 LEU CB C 156 43.040 43.040 42.864 0.176 25768 16254 1 18 . 1 1 156 156 LEU H H 156 9.190 9.190 8.751 0.439 25768 16255 1 18 . 1 1 157 157 ASN N N 157 114.690 114.690 117.085 -2.395 25768 16256 1 18 . 1 1 157 157 ASN C C 157 173.640 173.640 177.650 -4.010 25768 16257 1 18 . 1 1 157 157 ASN CA C 157 52.650 52.650 56.564 -3.914 25768 16258 1 18 . 1 1 157 157 ASN CB C 157 37.270 37.270 36.874 0.396 25768 16259 1 18 . 1 1 157 157 ASN H H 157 8.060 8.060 8.566 -0.506 25768 16260 1 18 . 1 1 158 158 GLU N N 158 114.530 114.530 120.586 -6.056 25768 16261 1 18 . 1 1 158 158 GLU C C 158 176.090 176.090 177.145 -1.055 25768 16262 1 18 . 1 1 158 158 GLU CA C 158 60.010 60.010 57.667 2.343 25768 16263 1 18 . 1 1 158 158 GLU CB C 158 29.730 29.730 30.308 -0.578 25768 16264 1 18 . 1 1 158 158 GLU H H 158 8.560 8.560 8.384 0.176 25768 16265 1 18 . 1 1 159 159 HIS N N 159 110.480 110.480 118.886 -8.406 25768 16266 1 18 . 1 1 159 159 HIS C C 159 173.130 173.130 174.886 -1.756 25768 16267 1 18 . 1 1 159 159 HIS CA C 159 56.770 56.770 54.817 1.953 25768 16268 1 18 . 1 1 159 159 HIS CB C 159 32.630 32.630 29.826 2.804 25768 16269 1 18 . 1 1 159 159 HIS H H 159 8.190 8.190 7.480 0.710 25768 16270 1 18 . 1 1 160 160 ALA N N 160 122.890 122.890 120.950 1.940 25768 16271 1 18 . 1 1 160 160 ALA C C 160 176.200 176.200 175.151 1.049 25768 16272 1 18 . 1 1 160 160 ALA CA C 160 51.730 51.730 53.192 -1.462 25768 16273 1 18 . 1 1 160 160 ALA CB C 160 21.560 21.560 17.886 3.674 25768 16274 1 18 . 1 1 160 160 ALA H H 160 8.400 8.400 7.597 0.803 25768 16275 1 18 . 1 1 161 161 LEU N N 161 116.540 116.540 117.505 -0.965 25768 16276 1 18 . 1 1 161 161 LEU C C 161 174.930 174.930 175.992 -1.062 25768 16277 1 18 . 1 1 161 161 LEU CA C 161 54.280 54.280 53.644 0.636 25768 16278 1 18 . 1 1 161 161 LEU CB C 161 45.640 45.640 44.858 0.782 25768 16279 1 18 . 1 1 161 161 LEU H H 161 8.590 8.590 7.714 0.876 25768 16280 1 18 . 1 1 162 162 PHE N N 162 121.780 121.780 122.769 -0.989 25768 16281 1 18 . 1 1 162 162 PHE C C 162 171.960 171.960 174.333 -2.373 25768 16282 1 18 . 1 1 162 162 PHE CA C 162 56.420 56.420 57.030 -0.610 25768 16283 1 18 . 1 1 162 162 PHE CB C 162 43.340 43.340 41.392 1.948 25768 16284 1 18 . 1 1 162 162 PHE H H 162 9.180 9.180 9.205 -0.025 25768 16285 1 18 . 1 1 163 163 ASN N N 163 127.850 127.850 126.151 1.699 25768 16286 1 18 . 1 1 163 163 ASN C C 163 171.320 171.320 173.958 -2.638 25768 16287 1 18 . 1 1 163 163 ASN CA C 163 52.340 52.340 52.122 0.218 25768 16288 1 18 . 1 1 163 163 ASN CB C 163 46.410 46.410 40.847 5.563 25768 16289 1 18 . 1 1 163 163 ASN H H 163 7.700 7.700 8.375 -0.675 25768 16290 1 18 . 1 1 164 164 MET N N 164 119.950 119.950 124.686 -4.736 25768 16291 1 18 . 1 1 164 164 MET C C 164 172.830 172.830 174.132 -1.302 25768 16292 1 18 . 1 1 164 164 MET CA C 164 55.180 55.180 54.488 0.692 25768 16293 1 18 . 1 1 164 164 MET CB C 164 37.770 37.770 37.098 0.672 25768 16294 1 18 . 1 1 164 164 MET H H 164 7.070 7.070 9.257 -2.187 25768 16295 1 18 . 1 1 165 165 ALA N N 165 120.600 120.600 127.273 -6.673 25768 16296 1 18 . 1 1 165 165 ALA C C 165 174.240 174.240 175.230 -0.990 25768 16297 1 18 . 1 1 165 165 ALA CA C 165 51.630 51.630 50.603 1.027 25768 16298 1 18 . 1 1 165 165 ALA CB C 165 22.330 22.330 22.028 0.302 25768 16299 1 18 . 1 1 165 165 ALA H H 165 8.290 8.290 9.361 -1.071 25768 16300 1 18 . 1 1 166 166 VAL N N 166 117.900 117.900 116.977 0.923 25768 16301 1 18 . 1 1 166 166 VAL C C 166 172.950 172.950 174.271 -1.321 25768 16302 1 18 . 1 1 166 166 VAL CA C 166 59.710 59.710 60.845 -1.135 25768 16303 1 18 . 1 1 166 166 VAL CB C 166 35.290 35.290 35.694 -0.404 25768 16304 1 18 . 1 1 166 166 VAL H H 166 8.720 8.720 7.982 0.738 25768 16305 1 18 . 1 1 171 171 ILE C C 171 175.750 175.750 175.150 0.600 25768 16306 1 18 . 1 1 171 171 ILE CA C 171 61.720 61.720 60.655 1.065 25768 16307 1 18 . 1 1 171 171 ILE CB C 171 39.300 39.300 38.585 0.715 25768 16308 1 18 . 1 1 172 172 ASP N N 172 124.070 124.070 120.358 3.712 25768 16309 1 18 . 1 1 172 172 ASP C C 172 176.590 176.590 175.677 0.913 25768 16310 1 18 . 1 1 172 172 ASP CA C 172 54.460 54.460 53.504 0.956 25768 16311 1 18 . 1 1 172 172 ASP CB C 172 41.410 41.410 42.051 -0.641 25768 16312 1 18 . 1 1 172 172 ASP H H 172 8.460 8.460 8.388 0.072 25768 16313 1 18 . 1 1 173 173 THR N N 173 115.570 115.570 118.109 -2.539 25768 16314 1 18 . 1 1 173 173 THR C C 173 175.030 175.030 174.421 0.609 25768 16315 1 18 . 1 1 173 173 THR CA C 173 62.680 62.680 62.310 0.370 25768 16316 1 18 . 1 1 173 173 THR CB C 173 69.840 69.840 69.436 0.404 25768 16317 1 18 . 1 1 173 173 THR H H 173 8.080 8.080 8.427 -0.347 25768 16318 1 18 . 1 1 174 174 LYS N N 174 122.680 122.680 126.618 -3.938 25768 16319 1 18 . 1 1 174 174 LYS C C 174 176.340 176.340 175.435 0.905 25768 16320 1 18 . 1 1 174 174 LYS CA C 174 56.820 56.820 57.092 -0.272 25768 16321 1 18 . 1 1 174 174 LYS CB C 174 32.790 32.790 33.564 -0.774 25768 16322 1 18 . 1 1 174 174 LYS H H 174 8.180 8.180 8.742 -0.562 25768 16323 1 18 . 1 1 175 175 ALA N N 175 124.050 124.050 128.852 -4.802 25768 16324 1 18 . 1 1 175 175 ALA C C 175 177.550 177.550 176.666 0.884 25768 16325 1 18 . 1 1 175 175 ALA CA C 175 52.840 52.840 52.366 0.474 25768 16326 1 18 . 1 1 175 175 ALA CB C 175 19.580 19.580 18.332 1.248 25768 16327 1 18 . 1 1 175 175 ALA H H 175 8.050 8.050 8.743 -0.693 25768 16328 1 18 . 1 1 176 176 SER N N 176 114.920 114.920 117.694 -2.774 25768 16329 1 18 . 1 1 176 176 SER C C 176 174.240 174.240 174.422 -0.182 25768 16330 1 18 . 1 1 176 176 SER CA C 176 58.390 58.390 58.566 -0.176 25768 16331 1 18 . 1 1 176 176 SER CB C 176 64.370 64.370 64.455 -0.085 25768 16332 1 18 . 1 1 176 176 SER H H 176 8.070 8.070 8.429 -0.359 25768 16333 1 18 . 1 1 177 177 ILE N N 177 121.650 121.650 123.730 -2.080 25768 16334 1 18 . 1 1 177 177 ILE C C 177 174.990 174.990 174.611 0.379 25768 16335 1 18 . 1 1 177 177 ILE CA C 177 61.570 61.570 60.715 0.855 25768 16336 1 18 . 1 1 177 177 ILE CB C 177 39.100 39.100 39.408 -0.308 25768 16337 1 18 . 1 1 177 177 ILE H H 177 7.960 7.960 8.007 -0.047 25768 16338 1 18 . 1 1 178 178 ASN N N 178 127.040 127.040 125.468 1.572 25768 16339 1 18 . 1 1 178 178 ASN C C 178 179.160 179.160 174.988 4.172 25768 16340 1 18 . 1 1 178 178 ASN CA C 178 55.100 55.100 53.527 1.573 25768 16341 1 18 . 1 1 178 178 ASN CB C 178 41.300 41.300 39.068 2.232 25768 16342 1 18 . 1 1 178 178 ASN H H 178 7.850 7.850 8.484 -0.634 25768 16343 1 18 . 1 1 180 180 PRO C C 180 177.520 177.520 176.940 0.580 25768 16344 1 18 . 1 1 180 180 PRO CA C 180 63.980 63.980 64.521 -0.541 25768 16345 1 18 . 1 1 180 180 PRO CB C 180 32.190 32.190 32.332 -0.142 25768 16346 1 18 . 1 1 181 181 SER N N 181 115.600 115.600 110.523 5.077 25768 16347 1 18 . 1 1 181 181 SER C C 181 174.710 174.710 173.172 1.538 25768 16348 1 18 . 1 1 181 181 SER CA C 181 58.900 58.900 58.249 0.651 25768 16349 1 18 . 1 1 181 181 SER CB C 181 64.070 64.070 63.448 0.622 25768 16350 1 18 . 1 1 181 181 SER H H 181 8.260 8.260 8.340 -0.080 25768 16351 1 18 . 1 1 182 182 ALA N N 182 125.880 125.880 124.206 1.674 25768 16352 1 18 . 1 1 182 182 ALA C C 182 177.560 177.560 175.863 1.697 25768 16353 1 18 . 1 1 182 182 ALA CA C 182 53.090 53.090 51.596 1.494 25768 16354 1 18 . 1 1 182 182 ALA CB C 182 19.310 19.310 19.967 -0.657 25768 16355 1 18 . 1 1 182 182 ALA H H 182 8.130 8.130 7.802 0.328 25768 16356 1 18 . 1 1 183 183 LEU N N 183 119.980 119.980 121.933 -1.953 25768 16357 1 18 . 1 1 183 183 LEU C C 183 177.850 177.850 177.545 0.305 25768 16358 1 18 . 1 1 183 183 LEU CA C 183 55.650 55.650 54.599 1.052 25768 16359 1 18 . 1 1 183 183 LEU CB C 183 42.530 42.530 43.046 -0.516 25768 16360 1 18 . 1 1 183 183 LEU H H 183 7.940 7.940 8.250 -0.310 25768 16361 1 18 . 1 1 184 184 GLY N N 184 109.250 109.250 112.643 -3.393 25768 16362 1 18 . 1 1 184 184 GLY C C 184 174.250 174.250 174.293 -0.043 25768 16363 1 18 . 1 1 184 184 GLY CA C 184 45.830 45.830 44.142 1.688 25768 16364 1 18 . 1 1 184 184 GLY H H 184 8.150 8.150 8.247 -0.097 25768 16365 1 18 . 1 1 185 185 VAL N N 185 118.830 118.830 118.030 0.800 25768 16366 1 18 . 1 1 185 185 VAL C C 185 175.890 175.890 175.379 0.511 25768 16367 1 18 . 1 1 185 185 VAL CA C 185 62.740 62.740 62.312 0.428 25768 16368 1 18 . 1 1 185 185 VAL CB C 185 32.770 32.770 32.667 0.103 25768 16369 1 18 . 1 1 185 185 VAL H H 185 7.760 7.760 8.051 -0.291 25768 16370 1 18 . 1 1 186 186 ASN N N 186 121.850 121.850 117.566 4.284 25768 16371 1 18 . 1 1 186 186 ASN C C 186 174.970 174.970 174.111 0.859 25768 16372 1 18 . 1 1 186 186 ASN CA C 186 53.590 53.590 52.551 1.039 25768 16373 1 18 . 1 1 186 186 ASN CB C 186 39.160 39.160 41.292 -2.132 25768 16374 1 18 . 1 1 186 186 ASN H H 186 8.380 8.380 8.790 -0.410 25768 16375 1 18 . 1 1 187 187 LYS N N 187 122.120 122.120 119.461 2.659 25768 16376 1 18 . 1 1 187 187 LYS C C 187 176.490 176.490 176.852 -0.362 25768 16377 1 18 . 1 1 187 187 LYS CA C 187 56.750 56.750 57.340 -0.590 25768 16378 1 18 . 1 1 187 187 LYS CB C 187 33.250 33.250 33.324 -0.074 25768 16379 1 18 . 1 1 187 187 LYS H H 187 8.140 8.140 8.500 -0.360 25768 16380 1 18 . 1 1 188 188 THR N N 188 115.250 115.250 113.211 2.039 25768 16381 1 18 . 1 1 188 188 THR C C 188 174.250 174.250 175.379 -1.129 25768 16382 1 18 . 1 1 188 188 THR CA C 188 62.360 62.360 63.304 -0.944 25768 16383 1 18 . 1 1 188 188 THR CB C 188 70.280 70.280 69.335 0.945 25768 16384 1 18 . 1 1 188 188 THR H H 188 8.100 8.100 8.224 -0.124 25768 16385 1 18 . 1 1 189 189 LYS N N 189 123.780 123.780 121.910 1.870 25768 16386 1 18 . 1 1 189 189 LYS C C 189 176.090 176.090 175.476 0.614 25768 16387 1 18 . 1 1 189 189 LYS CA C 189 56.590 56.590 56.135 0.455 25768 16388 1 18 . 1 1 189 189 LYS CB C 189 33.350 33.350 33.237 0.113 25768 16389 1 18 . 1 1 189 189 LYS H H 189 8.110 8.110 7.701 0.409 25768 16390 1 18 . 1 1 190 190 VAL N N 190 120.920 120.920 118.724 2.196 25768 16391 1 18 . 1 1 190 190 VAL C C 190 175.590 175.590 175.503 0.087 25768 16392 1 18 . 1 1 190 190 VAL CA C 190 62.400 62.400 62.761 -0.361 25768 16393 1 18 . 1 1 190 190 VAL CB C 190 32.990 32.990 30.745 2.245 25768 16394 1 18 . 1 1 190 190 VAL H H 190 8.040 8.040 8.439 -0.399 25768 16395 1 18 . 1 1 191 191 ASP N N 191 123.790 123.790 126.467 -2.677 25768 16396 1 18 . 1 1 191 191 ASP C C 191 175.750 175.750 176.006 -0.256 25768 16397 1 18 . 1 1 191 191 ASP CA C 191 54.650 54.650 53.429 1.221 25768 16398 1 18 . 1 1 191 191 ASP CB C 191 41.450 41.450 40.398 1.052 25768 16399 1 18 . 1 1 191 191 ASP H H 191 8.240 8.240 8.632 -0.392 25768 16400 1 18 . 1 1 192 192 VAL N N 192 118.850 118.850 119.826 -0.976 25768 16401 1 18 . 1 1 192 192 VAL C C 192 175.380 175.380 175.283 0.097 25768 16402 1 18 . 1 1 192 192 VAL CA C 192 62.110 62.110 62.461 -0.351 25768 16403 1 18 . 1 1 192 192 VAL CB C 192 33.290 33.290 31.439 1.851 25768 16404 1 18 . 1 1 192 192 VAL H H 192 7.860 7.860 7.641 0.219 25768 16405 1 18 . 1 1 193 193 ASP N N 193 124.190 124.190 122.679 1.511 25768 16406 1 18 . 1 1 193 193 ASP C C 193 175.630 175.630 175.840 -0.210 25768 16407 1 18 . 1 1 193 193 ASP CA C 193 54.540 54.540 53.849 0.691 25768 16408 1 18 . 1 1 193 193 ASP CB C 193 41.410 41.410 41.113 0.297 25768 16409 1 18 . 1 1 193 193 ASP H H 193 8.310 8.310 8.373 -0.063 25768 16410 1 18 . 1 1 194 194 VAL N N 194 119.580 119.580 116.364 3.216 25768 16411 1 18 . 1 1 194 194 VAL C C 194 174.950 174.950 175.094 -0.144 25768 16412 1 18 . 1 1 194 194 VAL CA C 194 61.770 61.770 62.085 -0.315 25768 16413 1 18 . 1 1 194 194 VAL CB C 194 33.680 33.680 31.301 2.379 25768 16414 1 18 . 1 1 194 194 VAL H H 194 7.890 7.890 7.519 0.371 25768 16415 1 18 . 1 1 195 195 ASP N N 195 125.660 125.660 129.097 -3.437 25768 16416 1 18 . 1 1 195 195 ASP C C 195 174.290 174.290 174.511 -0.221 25768 16417 1 18 . 1 1 195 195 ASP CA C 195 51.940 51.940 51.980 -0.040 25768 16418 1 18 . 1 1 195 195 ASP CB C 195 40.950 40.950 41.923 -0.973 25768 16419 1 18 . 1 1 195 195 ASP H H 195 8.410 8.410 8.236 0.174 25768 16420 1 18 . 1 1 198 198 VAL C C 198 173.940 173.940 174.939 -0.999 25768 16421 1 18 . 1 1 198 198 VAL CA C 198 61.270 61.270 59.782 1.488 25768 16422 1 18 . 1 1 198 198 VAL CB C 198 35.910 35.910 32.881 3.029 25768 16423 1 18 . 1 1 199 199 TYR N N 199 123.780 123.780 122.523 1.257 25768 16424 1 18 . 1 1 199 199 TYR C C 199 174.150 174.150 175.051 -0.901 25768 16425 1 18 . 1 1 199 199 TYR CA C 199 56.220 56.220 57.219 -0.999 25768 16426 1 18 . 1 1 199 199 TYR CB C 199 41.660 41.660 42.613 -0.953 25768 16427 1 18 . 1 1 199 199 TYR H H 199 8.540 8.540 8.084 0.456 25768 16428 1 18 . 1 1 200 200 MET N N 200 123.920 123.920 124.584 -0.664 25768 16429 1 18 . 1 1 200 200 MET C C 200 173.810 173.810 174.217 -0.407 25768 16430 1 18 . 1 1 200 200 MET CA C 200 54.710 54.710 55.250 -0.540 25768 16431 1 18 . 1 1 200 200 MET CB C 200 37.110 37.110 33.917 3.193 25768 16432 1 18 . 1 1 200 200 MET H H 200 9.130 9.130 8.545 0.585 25768 16433 1 18 . 1 1 201 201 ILE N N 201 123.670 123.670 125.508 -1.838 25768 16434 1 18 . 1 1 201 201 ILE C C 201 174.030 174.030 174.697 -0.667 25768 16435 1 18 . 1 1 201 201 ILE CA C 201 59.820 59.820 59.504 0.316 25768 16436 1 18 . 1 1 201 201 ILE CB C 201 41.720 41.720 41.984 -0.264 25768 16437 1 18 . 1 1 201 201 ILE H H 201 8.030 8.030 8.400 -0.370 25768 16438 1 18 . 1 1 202 202 GLY N N 202 112.910 112.910 111.391 1.519 25768 16439 1 18 . 1 1 202 202 GLY C C 202 170.280 170.280 172.519 -2.239 25768 16440 1 18 . 1 1 202 202 GLY CA C 202 46.800 46.800 44.321 2.479 25768 16441 1 18 . 1 1 202 202 GLY H H 202 8.580 8.580 8.919 -0.339 25768 16442 1 18 . 1 1 203 203 PHE N N 203 116.240 116.240 117.870 -1.630 25768 16443 1 18 . 1 1 203 203 PHE C C 203 173.940 173.940 175.653 -1.713 25768 16444 1 18 . 1 1 203 203 PHE CA C 203 55.890 55.890 55.827 0.063 25768 16445 1 18 . 1 1 203 203 PHE CB C 203 45.060 45.060 43.971 1.089 25768 16446 1 18 . 1 1 203 203 PHE H H 203 8.620 8.620 7.841 0.779 25768 16447 1 18 . 1 1 204 204 GLY N N 204 105.610 105.610 106.104 -0.494 25768 16448 1 18 . 1 1 204 204 GLY C C 204 171.190 171.190 171.847 -0.657 25768 16449 1 18 . 1 1 204 204 GLY CA C 204 46.720 46.720 44.967 1.753 25768 16450 1 18 . 1 1 204 204 GLY H H 204 8.960 8.960 8.363 0.597 25768 16451 1 18 . 1 1 205 205 TYR N N 205 121.160 121.160 120.904 0.256 25768 16452 1 18 . 1 1 205 205 TYR C C 205 173.030 173.030 174.056 -1.026 25768 16453 1 18 . 1 1 205 205 TYR CA C 205 57.190 57.190 57.276 -0.086 25768 16454 1 18 . 1 1 205 205 TYR CB C 205 44.400 44.400 43.448 0.952 25768 16455 1 18 . 1 1 205 205 TYR H H 205 9.380 9.380 9.332 0.048 25768 16456 1 18 . 1 1 206 206 LYS N N 206 126.970 126.970 123.061 3.909 25768 16457 1 18 . 1 1 206 206 LYS C C 206 174.210 174.210 175.168 -0.958 25768 16458 1 18 . 1 1 206 206 LYS CA C 206 54.770 54.770 55.005 -0.235 25768 16459 1 18 . 1 1 206 206 LYS CB C 206 34.440 34.440 34.921 -0.481 25768 16460 1 18 . 1 1 206 206 LYS H H 206 8.380 8.380 8.557 -0.177 25768 16461 1 18 . 1 1 207 207 PHE N N 207 126.330 126.330 126.141 0.189 25768 16462 1 18 . 1 1 207 207 PHE C C 207 175.020 175.020 174.905 0.115 25768 16463 1 18 . 1 1 207 207 PHE CA C 207 58.170 58.170 58.073 0.097 25768 16464 1 18 . 1 1 207 207 PHE CB C 207 40.920 40.920 39.458 1.462 25768 16465 1 18 . 1 1 207 207 PHE H H 207 9.290 9.290 8.150 1.140 25768 16466 1 18 . 1 1 208 208 LEU N N 208 122.740 122.740 128.509 -5.769 25768 16467 1 18 . 1 1 208 208 LEU C C 208 176.510 176.510 175.707 0.803 25768 16468 1 18 . 1 1 208 208 LEU CA C 208 54.910 54.910 54.358 0.553 25768 16469 1 18 . 1 1 208 208 LEU CB C 208 43.830 43.830 42.876 0.954 25768 16470 1 18 . 1 1 208 208 LEU H H 208 8.310 8.310 8.287 0.023 25768 16471 1 19 . 1 1 2 2 HIS C C 2 175.310 175.310 174.606 0.704 25768 16472 1 19 . 1 1 3 3 LYS N N 3 122.080 122.080 124.537 -2.457 25768 16473 1 19 . 1 1 3 3 LYS C C 3 173.490 173.490 174.968 -1.478 25768 16474 1 19 . 1 1 3 3 LYS CA C 3 55.050 55.050 54.441 0.609 25768 16475 1 19 . 1 1 3 3 LYS CB C 3 35.380 35.380 36.834 -1.454 25768 16476 1 19 . 1 1 3 3 LYS H H 3 8.620 8.620 7.993 0.627 25768 16477 1 19 . 1 1 4 4 ALA N N 4 120.860 120.860 125.069 -4.209 25768 16478 1 19 . 1 1 4 4 ALA C C 4 178.190 178.190 178.134 0.056 25768 16479 1 19 . 1 1 4 4 ALA CA C 4 53.480 53.480 52.556 0.924 25768 16480 1 19 . 1 1 4 4 ALA CB C 4 18.140 18.140 18.504 -0.364 25768 16481 1 19 . 1 1 4 4 ALA H H 4 8.580 8.580 8.413 0.167 25768 16482 1 19 . 1 1 5 5 GLY N N 5 112.890 112.890 113.160 -0.270 25768 16483 1 19 . 1 1 5 5 GLY C C 5 173.830 173.830 173.864 -0.034 25768 16484 1 19 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.785 0.095 25768 16485 1 19 . 1 1 5 5 GLY H H 5 9.210 9.210 8.872 0.338 25768 16486 1 19 . 1 1 6 6 ASP N N 6 121.590 121.590 121.205 0.385 25768 16487 1 19 . 1 1 6 6 ASP C C 6 174.380 174.380 175.070 -0.690 25768 16488 1 19 . 1 1 6 6 ASP CA C 6 55.790 55.790 54.840 0.950 25768 16489 1 19 . 1 1 6 6 ASP CB C 6 41.760 41.760 42.179 -0.419 25768 16490 1 19 . 1 1 6 6 ASP H H 6 7.620 7.620 7.638 -0.018 25768 16491 1 19 . 1 1 7 7 PHE N N 7 120.860 120.860 119.896 0.964 25768 16492 1 19 . 1 1 7 7 PHE C C 7 174.050 174.050 174.912 -0.862 25768 16493 1 19 . 1 1 7 7 PHE CA C 7 56.110 56.110 57.344 -1.234 25768 16494 1 19 . 1 1 7 7 PHE CB C 7 42.550 42.550 41.378 1.172 25768 16495 1 19 . 1 1 7 7 PHE H H 7 8.250 8.250 8.964 -0.714 25768 16496 1 19 . 1 1 8 8 ILE N N 8 127.950 127.950 121.108 6.842 25768 16497 1 19 . 1 1 8 8 ILE C C 8 174.000 174.000 174.715 -0.715 25768 16498 1 19 . 1 1 8 8 ILE CA C 8 61.160 61.160 60.458 0.702 25768 16499 1 19 . 1 1 8 8 ILE CB C 8 42.660 42.660 42.106 0.554 25768 16500 1 19 . 1 1 8 8 ILE H H 8 9.230 9.230 8.122 1.108 25768 16501 1 19 . 1 1 9 9 ILE N N 9 125.380 125.380 123.150 2.230 25768 16502 1 19 . 1 1 9 9 ILE C C 9 173.630 173.630 174.444 -0.814 25768 16503 1 19 . 1 1 9 9 ILE CA C 9 59.600 59.600 59.736 -0.136 25768 16504 1 19 . 1 1 9 9 ILE CB C 9 41.180 41.180 41.734 -0.554 25768 16505 1 19 . 1 1 9 9 ILE H H 9 8.580 8.580 8.611 -0.031 25768 16506 1 19 . 1 1 10 10 ARG N N 10 124.950 124.950 124.200 0.750 25768 16507 1 19 . 1 1 10 10 ARG C C 10 175.030 175.030 173.508 1.522 25768 16508 1 19 . 1 1 10 10 ARG CA C 10 53.920 53.920 55.368 -1.448 25768 16509 1 19 . 1 1 10 10 ARG CB C 10 31.880 31.880 34.616 -2.736 25768 16510 1 19 . 1 1 10 10 ARG H H 10 9.230 9.230 8.092 1.138 25768 16511 1 19 . 1 1 11 11 GLY N N 11 105.650 105.650 109.747 -4.097 25768 16512 1 19 . 1 1 11 11 GLY C C 11 172.090 172.090 171.705 0.385 25768 16513 1 19 . 1 1 11 11 GLY CA C 11 44.460 44.460 44.805 -0.345 25768 16514 1 19 . 1 1 11 11 GLY H H 11 8.780 8.780 8.869 -0.089 25768 16515 1 19 . 1 1 12 12 GLY N N 12 107.800 107.800 107.468 0.332 25768 16516 1 19 . 1 1 12 12 GLY C C 12 171.460 171.460 171.331 0.129 25768 16517 1 19 . 1 1 12 12 GLY CA C 12 46.630 46.630 44.876 1.754 25768 16518 1 19 . 1 1 12 12 GLY H H 12 8.510 8.510 8.358 0.152 25768 16519 1 19 . 1 1 13 13 PHE N N 13 119.900 119.900 117.993 1.907 25768 16520 1 19 . 1 1 13 13 PHE C C 13 174.190 174.190 173.894 0.296 25768 16521 1 19 . 1 1 13 13 PHE CA C 13 56.340 56.340 56.448 -0.108 25768 16522 1 19 . 1 1 13 13 PHE CB C 13 41.090 41.090 43.640 -2.550 25768 16523 1 19 . 1 1 13 13 PHE H H 13 8.610 8.610 8.020 0.590 25768 16524 1 19 . 1 1 14 14 ALA N N 14 128.030 128.030 123.317 4.713 25768 16525 1 19 . 1 1 14 14 ALA C C 14 176.560 176.560 176.590 -0.030 25768 16526 1 19 . 1 1 14 14 ALA CA C 14 49.940 49.940 50.626 -0.686 25768 16527 1 19 . 1 1 14 14 ALA CB C 14 20.360 20.360 22.068 -1.708 25768 16528 1 19 . 1 1 14 14 ALA H H 14 9.220 9.220 8.962 0.258 25768 16529 1 19 . 1 1 15 15 THR N N 15 118.620 118.620 117.268 1.352 25768 16530 1 19 . 1 1 15 15 THR CA C 15 61.440 61.440 61.311 0.129 25768 16531 1 19 . 1 1 15 15 THR CB C 15 71.370 71.370 68.918 2.452 25768 16532 1 19 . 1 1 15 15 THR H H 15 9.220 9.220 7.708 1.512 25768 16533 1 19 . 1 1 18 18 PRO C C 18 176.690 176.690 176.749 -0.059 25768 16534 1 19 . 1 1 18 18 PRO CA C 18 63.610 63.610 63.012 0.598 25768 16535 1 19 . 1 1 18 18 PRO CB C 18 32.440 32.440 31.474 0.966 25768 16536 1 19 . 1 1 19 19 ASP N N 19 120.320 120.320 123.948 -3.628 25768 16537 1 19 . 1 1 19 19 ASP C C 19 175.950 175.950 175.886 0.064 25768 16538 1 19 . 1 1 19 19 ASP CA C 19 54.710 54.710 55.091 -0.381 25768 16539 1 19 . 1 1 19 19 ASP CB C 19 41.450 41.450 40.932 0.518 25768 16540 1 19 . 1 1 19 19 ASP H H 19 8.330 8.330 8.439 -0.109 25768 16541 1 19 . 1 1 20 20 ASP N N 20 121.990 121.990 122.208 -0.218 25768 16542 1 19 . 1 1 20 20 ASP C C 20 176.760 176.760 176.177 0.583 25768 16543 1 19 . 1 1 20 20 ASP CA C 20 54.470 54.470 55.596 -1.127 25768 16544 1 19 . 1 1 20 20 ASP CB C 20 41.310 41.310 41.358 -0.048 25768 16545 1 19 . 1 1 20 20 ASP H H 20 8.240 8.240 8.550 -0.310 25768 16546 1 19 . 1 1 21 21 SER N N 21 117.050 117.050 114.713 2.337 25768 16547 1 19 . 1 1 21 21 SER C C 21 175.170 175.170 174.063 1.107 25768 16548 1 19 . 1 1 21 21 SER CA C 21 59.490 59.490 57.534 1.956 25768 16549 1 19 . 1 1 21 21 SER CB C 21 64.080 64.080 64.363 -0.283 25768 16550 1 19 . 1 1 21 21 SER H H 21 8.360 8.360 8.057 0.303 25768 16551 1 19 . 1 1 22 22 SER N N 22 117.820 117.820 120.039 -2.219 25768 16552 1 19 . 1 1 22 22 SER C C 22 174.940 174.940 174.888 0.052 25768 16553 1 19 . 1 1 22 22 SER CA C 22 59.160 59.160 58.435 0.724 25768 16554 1 19 . 1 1 22 22 SER CB C 22 64.110 64.110 63.661 0.449 25768 16555 1 19 . 1 1 22 22 SER H H 22 8.310 8.310 8.679 -0.369 25768 16556 1 19 . 1 1 23 23 SER N N 23 117.660 117.660 117.207 0.453 25768 16557 1 19 . 1 1 23 23 SER C C 23 174.340 174.340 174.150 0.190 25768 16558 1 19 . 1 1 23 23 SER CA C 23 59.050 59.050 58.499 0.551 25768 16559 1 19 . 1 1 23 23 SER CB C 23 64.210 64.210 64.060 0.150 25768 16560 1 19 . 1 1 23 23 SER H H 23 8.120 8.120 7.743 0.377 25768 16561 1 19 . 1 1 24 24 ASP N N 24 122.590 122.590 122.130 0.460 25768 16562 1 19 . 1 1 24 24 ASP C C 24 176.250 176.250 175.814 0.436 25768 16563 1 19 . 1 1 24 24 ASP CA C 24 54.910 54.910 53.615 1.295 25768 16564 1 19 . 1 1 24 24 ASP CB C 24 41.270 41.270 41.833 -0.563 25768 16565 1 19 . 1 1 24 24 ASP H H 24 8.230 8.230 8.278 -0.048 25768 16566 1 19 . 1 1 25 25 ILE N N 25 120.650 120.650 114.858 5.792 25768 16567 1 19 . 1 1 25 25 ILE C C 25 176.190 176.190 175.371 0.819 25768 16568 1 19 . 1 1 25 25 ILE CA C 25 61.880 61.880 61.320 0.560 25768 16569 1 19 . 1 1 25 25 ILE CB C 25 38.730 38.730 39.834 -1.104 25768 16570 1 19 . 1 1 25 25 ILE H H 25 7.860 7.860 8.218 -0.358 25768 16571 1 19 . 1 1 26 26 LYS N N 26 124.420 124.420 125.732 -1.312 25768 16572 1 19 . 1 1 26 26 LYS C C 26 176.640 176.640 174.941 1.699 25768 16573 1 19 . 1 1 26 26 LYS CA C 26 56.520 56.520 56.197 0.324 25768 16574 1 19 . 1 1 26 26 LYS CB C 26 32.890 32.890 33.097 -0.207 25768 16575 1 19 . 1 1 26 26 LYS H H 26 8.140 8.140 8.681 -0.541 25768 16576 1 19 . 1 1 27 27 LEU N N 27 123.120 123.120 121.993 1.127 25768 16577 1 19 . 1 1 27 27 LEU C C 27 177.110 177.110 176.453 0.657 25768 16578 1 19 . 1 1 27 27 LEU CA C 27 55.590 55.590 55.295 0.295 25768 16579 1 19 . 1 1 27 27 LEU CB C 27 42.500 42.500 41.554 0.946 25768 16580 1 19 . 1 1 27 27 LEU H H 27 8.080 8.080 7.941 0.139 25768 16581 1 19 . 1 1 28 28 ASP N N 28 120.850 120.850 121.538 -0.688 25768 16582 1 19 . 1 1 28 28 ASP C C 28 176.960 176.960 177.481 -0.521 25768 16583 1 19 . 1 1 28 28 ASP CA C 28 54.800 54.800 54.573 0.227 25768 16584 1 19 . 1 1 28 28 ASP CB C 28 41.380 41.380 41.682 -0.302 25768 16585 1 19 . 1 1 28 28 ASP H H 28 8.180 8.180 8.633 -0.453 25768 16586 1 19 . 1 1 29 29 GLY N N 29 109.800 109.800 108.141 1.659 25768 16587 1 19 . 1 1 29 29 GLY C C 29 174.370 174.370 173.024 1.346 25768 16588 1 19 . 1 1 29 29 GLY CA C 29 46.150 46.150 44.579 1.571 25768 16589 1 19 . 1 1 29 29 GLY H H 29 8.230 8.230 7.601 0.629 25768 16590 1 19 . 1 1 30 30 ALA N N 30 123.880 123.880 122.861 1.019 25768 16591 1 19 . 1 1 30 30 ALA C C 30 178.040 178.040 176.982 1.058 25768 16592 1 19 . 1 1 30 30 ALA CA C 30 53.140 53.140 51.834 1.306 25768 16593 1 19 . 1 1 30 30 ALA CB C 30 19.350 19.350 19.301 0.049 25768 16594 1 19 . 1 1 30 30 ALA H H 30 8.040 8.040 8.064 -0.024 25768 16595 1 19 . 1 1 31 31 LYS N N 31 119.800 119.800 121.261 -1.461 25768 16596 1 19 . 1 1 31 31 LYS C C 31 176.770 176.770 176.059 0.711 25768 16597 1 19 . 1 1 31 31 LYS CA C 31 56.870 56.870 55.826 1.044 25768 16598 1 19 . 1 1 31 31 LYS CB C 31 32.980 32.980 32.023 0.957 25768 16599 1 19 . 1 1 31 31 LYS H H 31 8.060 8.060 7.777 0.283 25768 16600 1 19 . 1 1 32 32 GLN N N 32 120.930 120.930 123.649 -2.719 25768 16601 1 19 . 1 1 32 32 GLN C C 32 176.000 176.000 174.758 1.242 25768 16602 1 19 . 1 1 32 32 GLN CA C 32 56.280 56.280 56.734 -0.454 25768 16603 1 19 . 1 1 32 32 GLN CB C 32 29.580 29.580 28.818 0.762 25768 16604 1 19 . 1 1 32 32 GLN H H 32 8.170 8.170 8.662 -0.492 25768 16605 1 19 . 1 1 33 33 ARG N N 33 122.370 122.370 123.522 -1.152 25768 16606 1 19 . 1 1 33 33 ARG C C 33 176.820 176.820 175.715 1.105 25768 16607 1 19 . 1 1 33 33 ARG CA C 33 56.680 56.680 56.256 0.424 25768 16608 1 19 . 1 1 33 33 ARG CB C 33 31.040 31.040 31.596 -0.556 25768 16609 1 19 . 1 1 33 33 ARG H H 33 8.270 8.270 8.409 -0.139 25768 16610 1 19 . 1 1 34 34 GLY N N 34 110.210 110.210 108.730 1.480 25768 16611 1 19 . 1 1 34 34 GLY C C 34 174.280 174.280 174.767 -0.487 25768 16612 1 19 . 1 1 34 34 GLY CA C 34 45.770 45.770 45.484 0.286 25768 16613 1 19 . 1 1 34 34 GLY H H 34 8.360 8.360 8.243 0.117 25768 16614 1 19 . 1 1 35 35 THR N N 35 114.100 114.100 118.110 -4.010 25768 16615 1 19 . 1 1 35 35 THR C C 35 174.550 174.550 175.082 -0.532 25768 16616 1 19 . 1 1 35 35 THR CA C 35 62.140 62.140 62.047 0.093 25768 16617 1 19 . 1 1 35 35 THR CB C 35 70.330 70.330 70.350 -0.020 25768 16618 1 19 . 1 1 35 35 THR H H 35 7.970 7.970 7.881 0.089 25768 16619 1 19 . 1 1 36 36 LYS N N 36 123.850 123.850 124.309 -0.459 25768 16620 1 19 . 1 1 36 36 LYS C C 36 176.040 176.040 175.296 0.744 25768 16621 1 19 . 1 1 36 36 LYS CA C 36 56.600 56.600 56.329 0.271 25768 16622 1 19 . 1 1 36 36 LYS CB C 36 33.280 33.280 33.042 0.238 25768 16623 1 19 . 1 1 36 36 LYS H H 36 8.230 8.230 8.370 -0.140 25768 16624 1 19 . 1 1 37 37 ALA N N 37 125.650 125.650 127.240 -1.590 25768 16625 1 19 . 1 1 37 37 ALA C C 37 177.570 177.570 176.487 1.083 25768 16626 1 19 . 1 1 37 37 ALA CA C 37 52.860 52.860 51.775 1.085 25768 16627 1 19 . 1 1 37 37 ALA CB C 37 19.610 19.610 19.218 0.392 25768 16628 1 19 . 1 1 37 37 ALA H H 37 8.290 8.290 8.142 0.148 25768 16629 1 19 . 1 1 38 38 THR N N 38 113.350 113.350 114.315 -0.965 25768 16630 1 19 . 1 1 38 38 THR C C 38 174.540 174.540 174.087 0.453 25768 16631 1 19 . 1 1 38 38 THR CA C 38 62.010 62.010 61.867 0.143 25768 16632 1 19 . 1 1 38 38 THR CB C 38 70.350 70.350 69.887 0.463 25768 16633 1 19 . 1 1 38 38 THR H H 38 7.970 7.970 7.963 0.007 25768 16634 1 19 . 1 1 39 39 VAL N N 39 120.790 120.790 122.586 -1.796 25768 16635 1 19 . 1 1 39 39 VAL C C 39 175.620 175.620 174.226 1.394 25768 16636 1 19 . 1 1 39 39 VAL CA C 39 62.470 62.470 61.843 0.627 25768 16637 1 19 . 1 1 39 39 VAL CB C 39 32.940 32.940 31.937 1.003 25768 16638 1 19 . 1 1 39 39 VAL H H 39 8.020 8.020 8.247 -0.227 25768 16639 1 19 . 1 1 40 40 ASP N N 40 123.690 123.690 125.684 -1.994 25768 16640 1 19 . 1 1 40 40 ASP C C 40 176.190 176.190 175.915 0.275 25768 16641 1 19 . 1 1 40 40 ASP CA C 40 54.780 54.780 53.947 0.833 25768 16642 1 19 . 1 1 40 40 ASP CB C 40 41.590 41.590 41.351 0.239 25768 16643 1 19 . 1 1 40 40 ASP H H 40 8.310 8.310 8.508 -0.198 25768 16644 1 19 . 1 1 41 41 SER N N 41 115.470 115.470 118.687 -3.217 25768 16645 1 19 . 1 1 41 41 SER C C 41 174.170 174.170 174.366 -0.196 25768 16646 1 19 . 1 1 41 41 SER CA C 41 59.000 59.000 58.481 0.519 25768 16647 1 19 . 1 1 41 41 SER CB C 41 64.420 64.420 63.932 0.488 25768 16648 1 19 . 1 1 41 41 SER H H 41 8.130 8.130 8.791 -0.661 25768 16649 1 19 . 1 1 42 42 ASP N N 42 122.430 122.430 122.533 -0.103 25768 16650 1 19 . 1 1 42 42 ASP C C 42 175.740 175.740 174.741 0.999 25768 16651 1 19 . 1 1 42 42 ASP CA C 42 54.780 54.780 54.698 0.082 25768 16652 1 19 . 1 1 42 42 ASP CB C 42 41.620 41.620 41.443 0.177 25768 16653 1 19 . 1 1 42 42 ASP H H 42 8.410 8.410 8.363 0.047 25768 16654 1 19 . 1 1 43 43 THR N N 43 117.580 117.580 118.934 -1.354 25768 16655 1 19 . 1 1 43 43 THR C C 43 173.630 173.630 174.579 -0.949 25768 16656 1 19 . 1 1 43 43 THR CA C 43 63.120 63.120 61.741 1.379 25768 16657 1 19 . 1 1 43 43 THR CB C 43 70.650 70.650 69.484 1.167 25768 16658 1 19 . 1 1 43 43 THR H H 43 8.010 8.010 8.196 -0.186 25768 16659 1 19 . 1 1 44 44 GLN N N 44 125.420 125.420 125.345 0.075 25768 16660 1 19 . 1 1 44 44 GLN C C 44 174.080 174.080 175.066 -0.986 25768 16661 1 19 . 1 1 44 44 GLN CA C 44 55.110 55.110 55.281 -0.171 25768 16662 1 19 . 1 1 44 44 GLN CB C 44 31.570 31.570 29.637 1.933 25768 16663 1 19 . 1 1 44 44 GLN H H 44 9.260 9.260 8.665 0.595 25768 16664 1 19 . 1 1 45 45 LEU N N 45 124.190 124.190 121.978 2.212 25768 16665 1 19 . 1 1 45 45 LEU C C 45 175.970 175.970 176.984 -1.014 25768 16666 1 19 . 1 1 45 45 LEU CA C 45 54.690 54.690 55.121 -0.431 25768 16667 1 19 . 1 1 45 45 LEU CB C 45 42.270 42.270 43.219 -0.949 25768 16668 1 19 . 1 1 45 45 LEU H H 45 8.550 8.550 8.379 0.171 25768 16669 1 19 . 1 1 46 46 GLY N N 46 113.310 113.310 113.643 -0.333 25768 16670 1 19 . 1 1 46 46 GLY C C 46 171.180 171.180 172.508 -1.328 25768 16671 1 19 . 1 1 46 46 GLY CA C 46 44.400 44.400 44.019 0.382 25768 16672 1 19 . 1 1 46 46 GLY H H 46 8.810 8.810 8.436 0.374 25768 16673 1 19 . 1 1 47 47 LEU N N 47 123.890 123.890 126.706 -2.816 25768 16674 1 19 . 1 1 47 47 LEU C C 47 175.400 175.400 175.619 -0.219 25768 16675 1 19 . 1 1 47 47 LEU CA C 47 53.750 53.750 54.299 -0.549 25768 16676 1 19 . 1 1 47 47 LEU CB C 47 46.800 46.800 45.416 1.384 25768 16677 1 19 . 1 1 47 47 LEU H H 47 8.590 8.590 7.792 0.798 25768 16678 1 19 . 1 1 48 48 THR N N 48 111.210 111.210 115.991 -4.781 25768 16679 1 19 . 1 1 48 48 THR C C 48 172.520 172.520 172.991 -0.471 25768 16680 1 19 . 1 1 48 48 THR CA C 48 58.950 58.950 61.309 -2.359 25768 16681 1 19 . 1 1 48 48 THR CB C 48 72.360 72.360 71.895 0.465 25768 16682 1 19 . 1 1 48 48 THR H H 48 8.620 8.620 8.413 0.207 25768 16683 1 19 . 1 1 49 49 PHE N N 49 118.810 118.810 124.379 -5.569 25768 16684 1 19 . 1 1 49 49 PHE C C 49 174.700 174.700 174.860 -0.160 25768 16685 1 19 . 1 1 49 49 PHE CA C 49 55.080 55.080 56.584 -1.504 25768 16686 1 19 . 1 1 49 49 PHE CB C 49 42.360 42.360 42.592 -0.232 25768 16687 1 19 . 1 1 49 49 PHE H H 49 8.410 8.410 8.751 -0.341 25768 16688 1 19 . 1 1 50 50 THR N N 50 121.230 121.230 123.233 -2.003 25768 16689 1 19 . 1 1 50 50 THR C C 50 173.250 173.250 172.809 0.441 25768 16690 1 19 . 1 1 50 50 THR CA C 50 62.740 62.740 61.926 0.814 25768 16691 1 19 . 1 1 50 50 THR CB C 50 73.740 73.740 69.978 3.762 25768 16692 1 19 . 1 1 50 50 THR H H 50 9.330 9.330 8.577 0.753 25768 16693 1 19 . 1 1 51 51 TYR N N 51 126.010 126.010 127.848 -1.838 25768 16694 1 19 . 1 1 51 51 TYR C C 51 174.850 174.850 174.304 0.546 25768 16695 1 19 . 1 1 51 51 TYR CA C 51 56.240 56.240 56.496 -0.256 25768 16696 1 19 . 1 1 51 51 TYR CB C 51 41.630 41.630 40.081 1.549 25768 16697 1 19 . 1 1 51 51 TYR H H 51 9.150 9.150 9.368 -0.218 25768 16698 1 19 . 1 1 52 52 MET N N 52 127.390 127.390 126.318 1.072 25768 16699 1 19 . 1 1 52 52 MET C C 52 174.490 174.490 174.752 -0.262 25768 16700 1 19 . 1 1 52 52 MET CA C 52 52.450 52.450 55.778 -3.328 25768 16701 1 19 . 1 1 52 52 MET CB C 52 28.590 28.590 32.474 -3.884 25768 16702 1 19 . 1 1 52 52 MET H H 52 7.950 7.950 8.068 -0.118 25768 16703 1 19 . 1 1 53 53 PHE N N 53 123.830 123.830 126.563 -2.733 25768 16704 1 19 . 1 1 53 53 PHE C C 53 173.720 173.720 173.841 -0.121 25768 16705 1 19 . 1 1 53 53 PHE CA C 53 57.110 57.110 56.883 0.227 25768 16706 1 19 . 1 1 53 53 PHE CB C 53 39.420 39.420 41.252 -1.832 25768 16707 1 19 . 1 1 53 53 PHE H H 53 7.720 7.720 8.488 -0.767 25768 16708 1 19 . 1 1 54 54 ALA N N 54 125.650 125.650 128.117 -2.467 25768 16709 1 19 . 1 1 54 54 ALA C C 54 175.020 175.020 176.183 -1.163 25768 16710 1 19 . 1 1 54 54 ALA CA C 54 50.740 50.740 53.044 -2.304 25768 16711 1 19 . 1 1 54 54 ALA CB C 54 22.700 22.700 18.924 3.776 25768 16712 1 19 . 1 1 54 54 ALA H H 54 8.360 8.360 8.451 -0.091 25768 16713 1 19 . 1 1 55 55 ASP N N 55 118.790 118.790 120.044 -1.254 25768 16714 1 19 . 1 1 55 55 ASP C C 55 174.780 174.780 175.934 -1.154 25768 16715 1 19 . 1 1 55 55 ASP CA C 55 58.590 58.590 54.409 4.181 25768 16716 1 19 . 1 1 55 55 ASP CB C 55 40.430 40.430 39.358 1.071 25768 16717 1 19 . 1 1 55 55 ASP H H 55 8.590 8.590 8.650 -0.060 25768 16718 1 19 . 1 1 56 56 LYS N N 56 106.200 106.200 116.913 -10.713 25768 16719 1 19 . 1 1 56 56 LYS C C 56 174.940 174.940 174.397 0.543 25768 16720 1 19 . 1 1 56 56 LYS CA C 56 55.260 55.260 56.555 -1.295 25768 16721 1 19 . 1 1 56 56 LYS CB C 56 34.510 34.510 35.281 -0.771 25768 16722 1 19 . 1 1 56 56 LYS H H 56 7.260 7.260 7.203 0.057 25768 16723 1 19 . 1 1 57 57 TRP N N 57 115.680 115.680 121.124 -5.444 25768 16724 1 19 . 1 1 57 57 TRP C C 57 173.940 173.940 175.671 -1.731 25768 16725 1 19 . 1 1 57 57 TRP CA C 57 55.410 55.410 56.203 -0.793 25768 16726 1 19 . 1 1 57 57 TRP CB C 57 34.470 34.470 31.346 3.124 25768 16727 1 19 . 1 1 57 57 TRP H H 57 6.570 6.570 8.042 -1.472 25768 16728 1 19 . 1 1 58 58 GLY N N 58 107.610 107.610 111.212 -3.602 25768 16729 1 19 . 1 1 58 58 GLY C C 58 172.730 172.730 172.016 0.714 25768 16730 1 19 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.594 -0.544 25768 16731 1 19 . 1 1 58 58 GLY H H 58 9.260 9.260 8.321 0.939 25768 16732 1 19 . 1 1 59 59 VAL N N 59 118.130 118.130 123.946 -5.816 25768 16733 1 19 . 1 1 59 59 VAL C C 59 173.000 173.000 173.469 -0.469 25768 16734 1 19 . 1 1 59 59 VAL CA C 59 59.950 59.950 59.891 0.059 25768 16735 1 19 . 1 1 59 59 VAL CB C 59 35.170 35.170 34.317 0.853 25768 16736 1 19 . 1 1 59 59 VAL H H 59 9.030 9.030 7.876 1.154 25768 16737 1 19 . 1 1 60 60 GLU N N 60 127.900 127.900 128.234 -0.334 25768 16738 1 19 . 1 1 60 60 GLU C C 60 174.470 174.470 174.431 0.039 25768 16739 1 19 . 1 1 60 60 GLU CA C 60 52.940 52.940 53.990 -1.050 25768 16740 1 19 . 1 1 60 60 GLU CB C 60 35.100 35.100 34.167 0.933 25768 16741 1 19 . 1 1 60 60 GLU H H 60 9.440 9.440 8.521 0.919 25768 16742 1 19 . 1 1 61 61 LEU N N 61 127.410 127.410 125.601 1.809 25768 16743 1 19 . 1 1 61 61 LEU C C 61 174.950 174.950 174.955 -0.005 25768 16744 1 19 . 1 1 61 61 LEU CA C 61 53.390 53.390 53.873 -0.483 25768 16745 1 19 . 1 1 61 61 LEU CB C 61 45.980 45.980 45.414 0.565 25768 16746 1 19 . 1 1 61 61 LEU H H 61 8.740 8.740 8.968 -0.228 25768 16747 1 19 . 1 1 62 62 VAL N N 62 125.750 125.750 123.420 2.330 25768 16748 1 19 . 1 1 62 62 VAL C C 62 173.960 173.960 174.094 -0.134 25768 16749 1 19 . 1 1 62 62 VAL CA C 62 61.350 61.350 60.590 0.760 25768 16750 1 19 . 1 1 62 62 VAL CB C 62 34.740 34.740 35.209 -0.469 25768 16751 1 19 . 1 1 62 62 VAL H H 62 8.790 8.790 8.976 -0.186 25768 16752 1 19 . 1 1 63 63 ALA N N 63 127.230 127.230 126.280 0.950 25768 16753 1 19 . 1 1 63 63 ALA C C 63 173.930 173.930 174.936 -1.006 25768 16754 1 19 . 1 1 63 63 ALA CA C 63 51.140 51.140 51.487 -0.347 25768 16755 1 19 . 1 1 63 63 ALA CB C 63 22.500 22.500 22.422 0.078 25768 16756 1 19 . 1 1 63 63 ALA H H 63 8.740 8.740 8.228 0.512 25768 16757 1 19 . 1 1 64 64 ALA N N 64 120.410 120.410 121.234 -0.824 25768 16758 1 19 . 1 1 64 64 ALA C C 64 176.770 176.770 176.642 0.128 25768 16759 1 19 . 1 1 64 64 ALA CA C 64 51.420 51.420 51.216 0.204 25768 16760 1 19 . 1 1 64 64 ALA CB C 64 22.590 22.590 22.191 0.399 25768 16761 1 19 . 1 1 64 64 ALA H H 64 8.290 8.290 8.292 -0.002 25768 16762 1 19 . 1 1 65 65 THR N N 65 116.130 116.130 115.296 0.834 25768 16763 1 19 . 1 1 65 65 THR C C 65 171.220 171.220 173.029 -1.809 25768 16764 1 19 . 1 1 65 65 THR CA C 65 58.860 58.860 59.280 -0.420 25768 16765 1 19 . 1 1 65 65 THR CB C 65 72.020 72.020 68.287 3.733 25768 16766 1 19 . 1 1 65 65 THR H H 65 8.760 8.760 8.392 0.368 25768 16767 1 19 . 1 1 66 66 PRO C C 66 176.720 176.720 175.836 0.884 25768 16768 1 19 . 1 1 66 66 PRO CA C 66 63.610 63.610 63.096 0.514 25768 16769 1 19 . 1 1 66 66 PRO CB C 66 32.550 32.550 32.203 0.347 25768 16770 1 19 . 1 1 67 67 PHE N N 67 120.360 120.360 123.939 -3.579 25768 16771 1 19 . 1 1 67 67 PHE C C 67 175.480 175.480 174.564 0.916 25768 16772 1 19 . 1 1 67 67 PHE CA C 67 58.840 58.840 57.577 1.263 25768 16773 1 19 . 1 1 67 67 PHE CB C 67 40.170 40.170 40.043 0.127 25768 16774 1 19 . 1 1 67 67 PHE H H 67 8.590 8.590 8.616 -0.026 25768 16775 1 19 . 1 1 68 68 ASN N N 68 119.030 119.030 121.830 -2.800 25768 16776 1 19 . 1 1 68 68 ASN C C 68 174.740 174.740 174.843 -0.103 25768 16777 1 19 . 1 1 68 68 ASN CA C 68 53.430 53.430 52.425 1.005 25768 16778 1 19 . 1 1 68 68 ASN CB C 68 39.420 39.420 39.345 0.075 25768 16779 1 19 . 1 1 68 68 ASN H H 68 8.340 8.340 8.457 -0.117 25768 16780 1 19 . 1 1 69 69 HIS N N 69 119.590 119.590 119.174 0.416 25768 16781 1 19 . 1 1 69 69 HIS C C 69 174.370 174.370 174.630 -0.260 25768 16782 1 19 . 1 1 69 69 HIS CA C 69 55.950 55.950 56.264 -0.314 25768 16783 1 19 . 1 1 69 69 HIS CB C 69 29.960 29.960 30.815 -0.855 25768 16784 1 19 . 1 1 69 69 HIS H H 69 8.350 8.350 8.281 0.069 25768 16785 1 19 . 1 1 70 70 GLN N N 70 121.980 121.980 119.652 2.328 25768 16786 1 19 . 1 1 70 70 GLN C C 70 175.740 175.740 174.545 1.195 25768 16787 1 19 . 1 1 70 70 GLN CA C 70 56.340 56.340 56.161 0.179 25768 16788 1 19 . 1 1 70 70 GLN CB C 70 29.660 29.660 28.406 1.254 25768 16789 1 19 . 1 1 70 70 GLN H H 70 8.350 8.350 8.436 -0.086 25768 16790 1 19 . 1 1 71 71 VAL N N 71 120.530 120.530 120.996 -0.466 25768 16791 1 19 . 1 1 71 71 VAL C C 71 175.500 175.500 175.188 0.312 25768 16792 1 19 . 1 1 71 71 VAL CA C 71 62.540 62.540 61.592 0.948 25768 16793 1 19 . 1 1 71 71 VAL CB C 71 33.090 33.090 31.922 1.168 25768 16794 1 19 . 1 1 71 71 VAL H H 71 8.020 8.020 8.034 -0.014 25768 16795 1 19 . 1 1 72 72 ASP N N 72 123.910 123.910 126.395 -2.485 25768 16796 1 19 . 1 1 72 72 ASP C C 72 176.300 176.300 176.565 -0.265 25768 16797 1 19 . 1 1 72 72 ASP CA C 72 54.340 54.340 54.233 0.107 25768 16798 1 19 . 1 1 72 72 ASP CB C 72 41.480 41.480 40.855 0.625 25768 16799 1 19 . 1 1 72 72 ASP H H 72 8.280 8.280 8.439 -0.159 25768 16800 1 19 . 1 1 73 73 VAL N N 73 120.580 120.580 122.741 -2.161 25768 16801 1 19 . 1 1 73 73 VAL C C 73 176.350 176.350 176.714 -0.364 25768 16802 1 19 . 1 1 73 73 VAL CA C 73 62.970 62.970 63.683 -0.713 25768 16803 1 19 . 1 1 73 73 VAL CB C 73 32.550 32.550 32.104 0.446 25768 16804 1 19 . 1 1 73 73 VAL H H 73 7.960 7.960 8.182 -0.222 25768 16805 1 19 . 1 1 74 74 LYS N N 74 123.620 123.620 121.044 2.576 25768 16806 1 19 . 1 1 74 74 LYS C C 74 177.130 177.130 176.140 0.990 25768 16807 1 19 . 1 1 74 74 LYS CA C 74 57.060 57.060 55.702 1.358 25768 16808 1 19 . 1 1 74 74 LYS CB C 74 32.860 32.860 31.604 1.256 25768 16809 1 19 . 1 1 74 74 LYS H H 74 8.230 8.230 7.971 0.259 25768 16810 1 19 . 1 1 75 75 GLY N N 75 109.370 109.370 113.089 -3.719 25768 16811 1 19 . 1 1 75 75 GLY C C 75 174.030 174.030 173.972 0.058 25768 16812 1 19 . 1 1 75 75 GLY CA C 75 45.800 45.800 45.265 0.535 25768 16813 1 19 . 1 1 75 75 GLY H H 75 8.160 8.160 8.236 -0.076 25768 16814 1 19 . 1 1 76 76 LEU N N 76 121.660 121.660 122.496 -0.836 25768 16815 1 19 . 1 1 76 76 LEU C C 76 177.410 177.410 176.417 0.993 25768 16816 1 19 . 1 1 76 76 LEU CA C 76 55.410 55.410 54.924 0.486 25768 16817 1 19 . 1 1 76 76 LEU CB C 76 42.790 42.790 44.012 -1.222 25768 16818 1 19 . 1 1 76 76 LEU H H 76 8.030 8.030 7.908 0.122 25768 16819 1 19 . 1 1 77 77 GLY N N 77 109.330 109.330 110.052 -0.722 25768 16820 1 19 . 1 1 77 77 GLY C C 77 171.800 171.800 173.389 -1.589 25768 16821 1 19 . 1 1 77 77 GLY CA C 77 44.990 44.990 44.394 0.596 25768 16822 1 19 . 1 1 77 77 GLY H H 77 8.100 8.100 8.260 -0.160 25768 16823 1 19 . 1 1 78 78 PRO C C 78 177.740 177.740 177.611 0.129 25768 16824 1 19 . 1 1 78 78 PRO CA C 78 63.890 63.890 63.420 0.470 25768 16825 1 19 . 1 1 78 78 PRO CB C 78 32.170 32.170 32.138 0.032 25768 16826 1 19 . 1 1 79 79 GLY N N 79 109.530 109.530 105.614 3.916 25768 16827 1 19 . 1 1 79 79 GLY C C 79 174.460 174.460 174.478 -0.018 25768 16828 1 19 . 1 1 79 79 GLY CA C 79 45.780 45.780 45.228 0.552 25768 16829 1 19 . 1 1 79 79 GLY H H 79 8.410 8.410 8.646 -0.236 25768 16830 1 19 . 1 1 80 80 LEU N N 80 121.880 121.880 118.850 3.030 25768 16831 1 19 . 1 1 80 80 LEU C C 80 177.100 177.100 177.217 -0.117 25768 16832 1 19 . 1 1 80 80 LEU CA C 80 55.720 55.720 55.354 0.366 25768 16833 1 19 . 1 1 80 80 LEU CB C 80 42.580 42.580 42.682 -0.102 25768 16834 1 19 . 1 1 80 80 LEU H H 80 8.010 8.010 7.942 0.068 25768 16835 1 19 . 1 1 81 81 ASP N N 81 119.990 119.990 118.827 1.163 25768 16836 1 19 . 1 1 81 81 ASP C C 81 176.880 176.880 177.102 -0.222 25768 16837 1 19 . 1 1 81 81 ASP CA C 81 54.770 54.770 54.131 0.639 25768 16838 1 19 . 1 1 81 81 ASP CB C 81 41.390 41.390 42.072 -0.682 25768 16839 1 19 . 1 1 81 81 ASP H H 81 8.220 8.220 8.527 -0.307 25768 16840 1 19 . 1 1 82 82 GLY N N 82 109.270 109.270 108.797 0.473 25768 16841 1 19 . 1 1 82 82 GLY C C 82 174.190 174.190 174.540 -0.350 25768 16842 1 19 . 1 1 82 82 GLY CA C 82 45.990 45.990 44.602 1.388 25768 16843 1 19 . 1 1 82 82 GLY H H 82 8.170 8.170 7.542 0.628 25768 16844 1 19 . 1 1 83 83 LYS N N 83 121.000 121.000 119.590 1.410 25768 16845 1 19 . 1 1 83 83 LYS C C 83 176.610 176.610 176.809 -0.199 25768 16846 1 19 . 1 1 83 83 LYS CA C 83 56.620 56.620 57.134 -0.514 25768 16847 1 19 . 1 1 83 83 LYS CB C 83 33.020 33.020 32.565 0.455 25768 16848 1 19 . 1 1 83 83 LYS H H 83 7.970 7.970 8.127 -0.157 25768 16849 1 19 . 1 1 84 84 LEU N N 84 123.120 123.120 120.968 2.152 25768 16850 1 19 . 1 1 84 84 LEU C C 84 176.920 176.920 176.679 0.241 25768 16851 1 19 . 1 1 84 84 LEU CA C 84 55.550 55.550 54.931 0.619 25768 16852 1 19 . 1 1 84 84 LEU CB C 84 42.430 42.430 42.049 0.381 25768 16853 1 19 . 1 1 84 84 LEU H H 84 8.130 8.130 7.838 0.291 25768 16854 1 19 . 1 1 85 85 ALA N N 85 123.930 123.930 125.781 -1.851 25768 16855 1 19 . 1 1 85 85 ALA C C 85 177.060 177.060 176.209 0.851 25768 16856 1 19 . 1 1 85 85 ALA CA C 85 52.790 52.790 51.909 0.881 25768 16857 1 19 . 1 1 85 85 ALA CB C 85 19.670 19.670 19.784 -0.114 25768 16858 1 19 . 1 1 85 85 ALA H H 85 8.040 8.040 8.107 -0.067 25768 16859 1 19 . 1 1 86 86 ASP N N 86 119.760 119.760 120.254 -0.494 25768 16860 1 19 . 1 1 86 86 ASP C C 86 175.820 175.820 176.259 -0.439 25768 16861 1 19 . 1 1 86 86 ASP CA C 86 54.520 54.520 53.905 0.615 25768 16862 1 19 . 1 1 86 86 ASP CB C 86 41.390 41.390 40.760 0.630 25768 16863 1 19 . 1 1 86 86 ASP H H 86 8.110 8.110 8.385 -0.275 25768 16864 1 19 . 1 1 87 87 ILE N N 87 120.620 120.620 118.218 2.402 25768 16865 1 19 . 1 1 87 87 ILE C C 87 175.740 175.740 176.491 -0.751 25768 16866 1 19 . 1 1 87 87 ILE CA C 87 61.160 61.160 61.719 -0.559 25768 16867 1 19 . 1 1 87 87 ILE CB C 87 39.260 39.260 38.651 0.609 25768 16868 1 19 . 1 1 87 87 ILE H H 87 7.800 7.800 8.373 -0.573 25768 16869 1 19 . 1 1 88 88 LYS N N 88 125.820 125.820 121.510 4.310 25768 16870 1 19 . 1 1 88 88 LYS C C 88 175.340 175.340 175.551 -0.211 25768 16871 1 19 . 1 1 88 88 LYS CA C 88 56.300 56.300 55.792 0.508 25768 16872 1 19 . 1 1 88 88 LYS CB C 88 32.900 32.900 33.168 -0.268 25768 16873 1 19 . 1 1 88 88 LYS H H 88 8.250 8.250 8.160 0.090 25768 16874 1 19 . 1 1 89 89 GLN N N 89 121.750 121.750 120.874 0.876 25768 16875 1 19 . 1 1 89 89 GLN C C 89 175.000 175.000 175.748 -0.748 25768 16876 1 19 . 1 1 89 89 GLN CA C 89 55.210 55.210 54.975 0.235 25768 16877 1 19 . 1 1 89 89 GLN CB C 89 30.570 30.570 31.873 -1.304 25768 16878 1 19 . 1 1 89 89 GLN H H 89 8.000 8.000 8.379 -0.379 25768 16879 1 19 . 1 1 90 90 LEU N N 90 126.660 126.660 120.441 6.219 25768 16880 1 19 . 1 1 90 90 LEU C C 90 174.240 174.240 175.988 -1.748 25768 16881 1 19 . 1 1 90 90 LEU CA C 90 52.720 52.720 54.083 -1.363 25768 16882 1 19 . 1 1 90 90 LEU CB C 90 42.350 42.350 41.189 1.161 25768 16883 1 19 . 1 1 90 90 LEU H H 90 8.630 8.630 8.203 0.427 25768 16884 1 19 . 1 1 92 92 PRO C C 92 173.900 173.900 176.414 -2.514 25768 16885 1 19 . 1 1 92 92 PRO CA C 92 63.320 63.320 62.692 0.628 25768 16886 1 19 . 1 1 92 92 PRO CB C 92 31.920 31.920 32.534 -0.614 25768 16887 1 19 . 1 1 93 93 THR N N 93 119.770 119.770 113.819 5.951 25768 16888 1 19 . 1 1 93 93 THR C C 93 171.360 171.360 174.333 -2.973 25768 16889 1 19 . 1 1 93 93 THR CA C 93 62.610 62.610 61.957 0.653 25768 16890 1 19 . 1 1 93 93 THR CB C 93 72.680 72.680 69.809 2.871 25768 16891 1 19 . 1 1 93 93 THR H H 93 8.290 8.290 8.210 0.080 25768 16892 1 19 . 1 1 94 94 LEU N N 94 128.880 128.880 121.059 7.821 25768 16893 1 19 . 1 1 94 94 LEU C C 94 175.130 175.130 175.062 0.068 25768 16894 1 19 . 1 1 94 94 LEU CA C 94 53.520 53.520 53.391 0.129 25768 16895 1 19 . 1 1 94 94 LEU CB C 94 46.140 46.140 45.212 0.928 25768 16896 1 19 . 1 1 94 94 LEU H H 94 8.680 8.680 8.356 0.324 25768 16897 1 19 . 1 1 95 95 LEU N N 95 123.630 123.630 119.204 4.426 25768 16898 1 19 . 1 1 95 95 LEU C C 95 175.540 175.540 174.943 0.597 25768 16899 1 19 . 1 1 95 95 LEU CA C 95 55.190 55.190 53.669 1.521 25768 16900 1 19 . 1 1 95 95 LEU CB C 95 45.300 45.300 45.289 0.011 25768 16901 1 19 . 1 1 95 95 LEU H H 95 9.580 9.580 8.875 0.705 25768 16902 1 19 . 1 1 96 96 LEU N N 96 123.150 123.150 125.300 -2.150 25768 16903 1 19 . 1 1 96 96 LEU C C 96 174.960 174.960 174.933 0.027 25768 16904 1 19 . 1 1 96 96 LEU CA C 96 54.420 54.420 54.816 -0.396 25768 16905 1 19 . 1 1 96 96 LEU CB C 96 44.560 44.560 43.122 1.438 25768 16906 1 19 . 1 1 96 96 LEU H H 96 8.770 8.770 8.137 0.633 25768 16907 1 19 . 1 1 97 97 GLN N N 97 121.290 121.290 123.608 -2.318 25768 16908 1 19 . 1 1 97 97 GLN C C 97 174.380 174.380 174.066 0.314 25768 16909 1 19 . 1 1 97 97 GLN CA C 97 54.740 54.740 54.772 -0.032 25768 16910 1 19 . 1 1 97 97 GLN CB C 97 36.600 36.600 33.032 3.568 25768 16911 1 19 . 1 1 97 97 GLN H H 97 9.480 9.480 8.078 1.402 25768 16912 1 19 . 1 1 98 98 TYR N N 98 122.250 122.250 121.359 0.891 25768 16913 1 19 . 1 1 98 98 TYR C C 98 173.460 173.460 174.594 -1.134 25768 16914 1 19 . 1 1 98 98 TYR CA C 98 55.160 55.160 56.409 -1.249 25768 16915 1 19 . 1 1 98 98 TYR CB C 98 42.420 42.420 43.157 -0.737 25768 16916 1 19 . 1 1 98 98 TYR H H 98 9.010 9.010 8.805 0.205 25768 16917 1 19 . 1 1 99 99 TYR N N 99 126.860 126.860 123.122 3.738 25768 16918 1 19 . 1 1 99 99 TYR C C 99 175.380 175.380 173.835 1.545 25768 16919 1 19 . 1 1 99 99 TYR CA C 99 54.220 54.220 54.580 -0.360 25768 16920 1 19 . 1 1 99 99 TYR CB C 99 38.890 38.890 38.699 0.191 25768 16921 1 19 . 1 1 99 99 TYR H H 99 8.300 8.300 7.764 0.536 25768 16922 1 19 . 1 1 100 100 PRO C C 100 178.330 178.330 177.292 1.038 25768 16923 1 19 . 1 1 100 100 PRO CA C 100 64.750 64.750 64.545 0.205 25768 16924 1 19 . 1 1 100 100 PRO CB C 100 32.130 32.130 32.338 -0.208 25768 16925 1 19 . 1 1 101 101 MET N N 101 114.520 114.520 118.360 -3.840 25768 16926 1 19 . 1 1 101 101 MET C C 101 178.240 178.240 176.581 1.659 25768 16927 1 19 . 1 1 101 101 MET CA C 101 53.500 53.500 56.130 -2.630 25768 16928 1 19 . 1 1 101 101 MET CB C 101 30.160 30.160 33.100 -2.940 25768 16929 1 19 . 1 1 101 101 MET H H 101 9.390 9.390 8.015 1.375 25768 16930 1 19 . 1 1 102 102 GLY N N 102 117.500 117.500 107.316 10.184 25768 16931 1 19 . 1 1 102 102 GLY C C 102 175.690 175.690 174.245 1.445 25768 16932 1 19 . 1 1 102 102 GLY CA C 102 46.760 46.760 46.258 0.502 25768 16933 1 19 . 1 1 102 102 GLY H H 102 8.640 8.640 8.407 0.233 25768 16934 1 19 . 1 1 103 103 GLY N N 103 111.030 111.030 111.774 -0.744 25768 16935 1 19 . 1 1 103 103 GLY C C 103 174.070 174.070 173.309 0.761 25768 16936 1 19 . 1 1 103 103 GLY CA C 103 46.140 46.140 45.310 0.830 25768 16937 1 19 . 1 1 103 103 GLY H H 103 9.390 9.390 7.885 1.505 25768 16938 1 19 . 1 1 104 104 THR N N 104 109.290 109.290 114.058 -4.768 25768 16939 1 19 . 1 1 104 104 THR C C 104 174.290 174.290 174.239 0.051 25768 16940 1 19 . 1 1 104 104 THR CA C 104 60.900 60.900 59.772 1.128 25768 16941 1 19 . 1 1 104 104 THR CB C 104 72.070 72.070 70.799 1.270 25768 16942 1 19 . 1 1 104 104 THR H H 104 7.290 7.290 7.592 -0.302 25768 16943 1 19 . 1 1 105 105 ASN C C 105 175.050 175.050 175.131 -0.081 25768 16944 1 19 . 1 1 105 105 ASN CA C 105 52.880 52.880 52.980 -0.100 25768 16945 1 19 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.519 -0.259 25768 16946 1 19 . 1 1 106 106 SER N N 106 113.000 113.000 116.857 -3.857 25768 16947 1 19 . 1 1 106 106 SER C C 106 176.000 176.000 175.094 0.906 25768 16948 1 19 . 1 1 106 106 SER CA C 106 58.700 58.700 58.003 0.697 25768 16949 1 19 . 1 1 106 106 SER CB C 106 64.540 64.540 64.260 0.280 25768 16950 1 19 . 1 1 106 106 SER H H 106 7.450 7.450 7.762 -0.312 25768 16951 1 19 . 1 1 107 107 ALA N N 107 132.220 132.220 127.705 4.515 25768 16952 1 19 . 1 1 107 107 ALA C C 107 176.610 176.610 176.996 -0.386 25768 16953 1 19 . 1 1 107 107 ALA CA C 107 54.380 54.380 53.385 0.995 25768 16954 1 19 . 1 1 107 107 ALA CB C 107 18.690 18.690 19.139 -0.449 25768 16955 1 19 . 1 1 107 107 ALA H H 107 8.870 8.870 8.658 0.212 25768 16956 1 19 . 1 1 108 108 PHE N N 108 116.050 116.050 116.852 -0.802 25768 16957 1 19 . 1 1 108 108 PHE C C 108 174.270 174.270 174.890 -0.620 25768 16958 1 19 . 1 1 108 108 PHE CA C 108 56.140 56.140 57.810 -1.670 25768 16959 1 19 . 1 1 108 108 PHE CB C 108 40.520 40.520 39.661 0.859 25768 16960 1 19 . 1 1 108 108 PHE H H 108 7.550 7.550 7.737 -0.187 25768 16961 1 19 . 1 1 109 109 GLN N N 109 128.260 128.260 122.743 5.517 25768 16962 1 19 . 1 1 109 109 GLN C C 109 172.300 172.300 173.917 -1.617 25768 16963 1 19 . 1 1 109 109 GLN CA C 109 52.310 52.310 53.118 -0.808 25768 16964 1 19 . 1 1 109 109 GLN CB C 109 29.050 29.050 29.518 -0.468 25768 16965 1 19 . 1 1 109 109 GLN H H 109 9.060 9.060 8.612 0.448 25768 16966 1 19 . 1 1 110 110 PRO C C 110 175.020 175.020 175.744 -0.724 25768 16967 1 19 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.102 -0.552 25768 16968 1 19 . 1 1 110 110 PRO CB C 110 33.280 33.280 32.078 1.202 25768 16969 1 19 . 1 1 111 111 TYR N N 111 115.730 115.730 113.888 1.842 25768 16970 1 19 . 1 1 111 111 TYR C C 111 173.850 173.850 173.548 0.302 25768 16971 1 19 . 1 1 111 111 TYR CA C 111 56.470 56.470 56.907 -0.437 25768 16972 1 19 . 1 1 111 111 TYR CB C 111 38.650 38.650 39.620 -0.970 25768 16973 1 19 . 1 1 111 111 TYR H H 111 8.500 8.500 7.472 1.028 25768 16974 1 19 . 1 1 112 112 GLY N N 112 103.570 103.570 105.696 -2.126 25768 16975 1 19 . 1 1 112 112 GLY C C 112 172.020 172.020 172.792 -0.772 25768 16976 1 19 . 1 1 112 112 GLY CA C 112 43.950 43.950 45.946 -1.996 25768 16977 1 19 . 1 1 112 112 GLY H H 112 8.110 8.110 8.145 -0.035 25768 16978 1 19 . 1 1 113 113 GLY N N 113 108.510 108.510 107.410 1.100 25768 16979 1 19 . 1 1 113 113 GLY C C 113 171.540 171.540 172.330 -0.790 25768 16980 1 19 . 1 1 113 113 GLY CA C 113 46.120 46.120 46.043 0.077 25768 16981 1 19 . 1 1 113 113 GLY H H 113 9.080 9.080 8.255 0.825 25768 16982 1 19 . 1 1 114 114 LEU N N 114 120.270 120.270 120.442 -0.172 25768 16983 1 19 . 1 1 114 114 LEU C C 114 175.810 175.810 175.866 -0.056 25768 16984 1 19 . 1 1 114 114 LEU CA C 114 53.920 53.920 53.746 0.173 25768 16985 1 19 . 1 1 114 114 LEU CB C 114 47.940 47.940 46.487 1.453 25768 16986 1 19 . 1 1 114 114 LEU H H 114 8.620 8.620 8.349 0.271 25768 16987 1 19 . 1 1 115 115 GLY N N 115 110.620 110.620 108.582 2.038 25768 16988 1 19 . 1 1 115 115 GLY C C 115 171.560 171.560 172.641 -1.081 25768 16989 1 19 . 1 1 115 115 GLY CA C 115 46.940 46.940 43.330 3.610 25768 16990 1 19 . 1 1 115 115 GLY H H 115 9.000 9.000 8.939 0.061 25768 16991 1 19 . 1 1 116 116 VAL N N 116 113.600 113.600 114.107 -0.507 25768 16992 1 19 . 1 1 116 116 VAL C C 116 174.120 174.120 175.444 -1.324 25768 16993 1 19 . 1 1 116 116 VAL CA C 116 58.970 58.970 59.589 -0.619 25768 16994 1 19 . 1 1 116 116 VAL CB C 116 36.600 36.600 34.468 2.132 25768 16995 1 19 . 1 1 116 116 VAL H H 116 8.680 8.680 7.705 0.975 25768 16996 1 19 . 1 1 117 117 ASN N N 117 120.020 120.020 117.701 2.319 25768 16997 1 19 . 1 1 117 117 ASN CA C 117 52.190 52.190 53.232 -1.042 25768 16998 1 19 . 1 1 117 117 ASN CB C 117 42.450 42.450 41.403 1.047 25768 16999 1 19 . 1 1 117 117 ASN H H 117 8.840 8.840 8.524 0.316 25768 17000 1 19 . 1 1 119 119 THR C C 119 174.350 174.350 173.554 0.796 25768 17001 1 19 . 1 1 119 119 THR CA C 119 63.140 63.140 61.454 1.686 25768 17002 1 19 . 1 1 119 119 THR CB C 119 70.170 70.170 70.433 -0.264 25768 17003 1 19 . 1 1 120 120 THR N N 120 114.120 114.120 114.611 -0.491 25768 17004 1 19 . 1 1 120 120 THR C C 120 174.220 174.220 173.302 0.918 25768 17005 1 19 . 1 1 120 120 THR CA C 120 61.900 61.900 61.933 -0.033 25768 17006 1 19 . 1 1 120 120 THR CB C 120 70.140 70.140 69.428 0.712 25768 17007 1 19 . 1 1 120 120 THR H H 120 7.570 7.570 8.328 -0.758 25768 17008 1 19 . 1 1 121 121 PHE N N 121 121.230 121.230 122.341 -1.111 25768 17009 1 19 . 1 1 121 121 PHE C C 121 174.910 174.910 175.135 -0.225 25768 17010 1 19 . 1 1 121 121 PHE CA C 121 58.720 58.720 57.173 1.547 25768 17011 1 19 . 1 1 121 121 PHE CB C 121 40.470 40.470 39.534 0.936 25768 17012 1 19 . 1 1 121 121 PHE H H 121 7.830 7.830 8.063 -0.233 25768 17013 1 19 . 1 1 122 122 PHE C C 122 175.070 175.070 175.654 -0.584 25768 17014 1 19 . 1 1 122 122 PHE CA C 122 57.890 57.890 57.066 0.824 25768 17015 1 19 . 1 1 122 122 PHE CB C 122 39.870 39.870 39.462 0.408 25768 17016 1 19 . 1 1 123 123 ASP N N 123 122.170 122.170 119.882 2.288 25768 17017 1 19 . 1 1 123 123 ASP C C 123 176.150 176.150 177.809 -1.659 25768 17018 1 19 . 1 1 123 123 ASP CA C 123 54.530 54.530 55.892 -1.362 25768 17019 1 19 . 1 1 123 123 ASP CB C 123 41.830 41.830 41.096 0.734 25768 17020 1 19 . 1 1 123 123 ASP H H 123 7.950 7.950 8.345 -0.395 25768 17021 1 19 . 1 1 124 124 GLU N N 124 122.690 122.690 119.519 3.171 25768 17022 1 19 . 1 1 124 124 GLU C C 124 176.630 176.630 177.987 -1.357 25768 17023 1 19 . 1 1 124 124 GLU CA C 124 57.620 57.620 59.568 -1.948 25768 17024 1 19 . 1 1 124 124 GLU CB C 124 30.450 30.450 29.496 0.954 25768 17025 1 19 . 1 1 124 124 GLU H H 124 8.340 8.340 8.348 -0.008 25768 17026 1 19 . 1 1 125 125 ASP N N 125 121.280 121.280 118.509 2.771 25768 17027 1 19 . 1 1 125 125 ASP C C 125 176.940 176.940 177.959 -1.019 25768 17028 1 19 . 1 1 125 125 ASP CA C 125 55.180 55.180 56.817 -1.637 25768 17029 1 19 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.532 0.688 25768 17030 1 19 . 1 1 125 125 ASP H H 125 8.310 8.310 8.388 -0.078 25768 17031 1 19 . 1 1 126 126 LEU N N 126 122.830 122.830 119.283 3.547 25768 17032 1 19 . 1 1 126 126 LEU C C 126 178.020 178.020 177.882 0.138 25768 17033 1 19 . 1 1 126 126 LEU CA C 126 56.450 56.450 56.936 -0.486 25768 17034 1 19 . 1 1 126 126 LEU CB C 126 42.150 42.150 42.151 -0.001 25768 17035 1 19 . 1 1 126 126 LEU H H 126 8.010 8.010 7.619 0.391 25768 17036 1 19 . 1 1 127 127 ALA N N 127 122.660 122.660 120.068 2.592 25768 17037 1 19 . 1 1 127 127 ALA C C 127 178.600 178.600 178.666 -0.066 25768 17038 1 19 . 1 1 127 127 ALA CA C 127 53.780 53.780 53.901 -0.121 25768 17039 1 19 . 1 1 127 127 ALA CB C 127 19.000 19.000 19.218 -0.218 25768 17040 1 19 . 1 1 127 127 ALA H H 127 8.100 8.100 7.298 0.802 25768 17041 1 19 . 1 1 128 128 SER N N 128 113.740 113.740 115.687 -1.947 25768 17042 1 19 . 1 1 128 128 SER C C 128 175.010 175.010 173.074 1.936 25768 17043 1 19 . 1 1 128 128 SER CA C 128 59.580 59.580 58.933 0.647 25768 17044 1 19 . 1 1 128 128 SER CB C 128 63.800 63.800 62.237 1.563 25768 17045 1 19 . 1 1 128 128 SER H H 128 7.920 7.920 7.778 0.142 25768 17046 1 19 . 1 1 129 129 ASN N N 129 120.300 120.300 122.213 -1.913 25768 17047 1 19 . 1 1 129 129 ASN C C 129 175.590 175.590 174.377 1.213 25768 17048 1 19 . 1 1 129 129 ASN CA C 129 54.180 54.180 54.119 0.061 25768 17049 1 19 . 1 1 129 129 ASN CB C 129 38.900 38.900 39.876 -0.976 25768 17050 1 19 . 1 1 129 129 ASN H H 129 8.120 8.120 8.580 -0.460 25768 17051 1 19 . 1 1 130 130 ARG N N 130 120.630 120.630 121.199 -0.569 25768 17052 1 19 . 1 1 130 130 ARG C C 130 176.720 176.720 175.699 1.021 25768 17053 1 19 . 1 1 130 130 ARG CA C 130 57.240 57.240 57.148 0.092 25768 17054 1 19 . 1 1 130 130 ARG CB C 130 30.500 30.500 30.644 -0.144 25768 17055 1 19 . 1 1 130 130 ARG H H 130 8.050 8.050 8.154 -0.104 25768 17056 1 19 . 1 1 131 131 LYS N N 131 121.150 121.150 121.679 -0.529 25768 17057 1 19 . 1 1 131 131 LYS C C 131 176.750 176.750 175.808 0.942 25768 17058 1 19 . 1 1 131 131 LYS CA C 131 57.050 57.050 56.541 0.509 25768 17059 1 19 . 1 1 131 131 LYS CB C 131 32.870 32.870 32.848 0.022 25768 17060 1 19 . 1 1 131 131 LYS H H 131 8.020 8.020 8.101 -0.081 25768 17061 1 19 . 1 1 132 132 ALA N N 132 124.110 124.110 128.358 -4.248 25768 17062 1 19 . 1 1 132 132 ALA C C 132 177.680 177.680 176.838 0.842 25768 17063 1 19 . 1 1 132 132 ALA CA C 132 53.070 53.070 52.070 1.000 25768 17064 1 19 . 1 1 132 132 ALA CB C 132 19.250 19.250 18.538 0.712 25768 17065 1 19 . 1 1 132 132 ALA H H 132 8.010 8.010 8.475 -0.465 25768 17066 1 19 . 1 1 133 133 GLN N N 133 118.830 118.830 121.503 -2.673 25768 17067 1 19 . 1 1 133 133 GLN C C 133 176.380 176.380 176.891 -0.511 25768 17068 1 19 . 1 1 133 133 GLN CA C 133 56.400 56.400 55.656 0.744 25768 17069 1 19 . 1 1 133 133 GLN CB C 133 29.670 29.670 29.945 -0.275 25768 17070 1 19 . 1 1 133 133 GLN H H 133 8.070 8.070 8.885 -0.815 25768 17071 1 19 . 1 1 134 134 GLY N N 134 109.400 109.400 108.846 0.554 25768 17072 1 19 . 1 1 134 134 GLY C C 134 174.060 174.060 173.965 0.095 25768 17073 1 19 . 1 1 134 134 GLY CA C 134 45.690 45.690 44.589 1.101 25768 17074 1 19 . 1 1 134 134 GLY H H 134 8.150 8.150 8.009 0.141 25768 17075 1 19 . 1 1 135 135 PHE N N 135 120.480 120.480 120.240 0.240 25768 17076 1 19 . 1 1 135 135 PHE C C 135 176.000 176.000 175.524 0.476 25768 17077 1 19 . 1 1 135 135 PHE CA C 135 58.370 58.370 57.522 0.848 25768 17078 1 19 . 1 1 135 135 PHE CB C 135 39.710 39.710 39.142 0.568 25768 17079 1 19 . 1 1 135 135 PHE H H 135 8.060 8.060 8.445 -0.385 25768 17080 1 19 . 1 1 136 136 SER N N 136 116.740 116.740 116.708 0.032 25768 17081 1 19 . 1 1 136 136 SER C C 136 174.620 174.620 174.364 0.256 25768 17082 1 19 . 1 1 136 136 SER CA C 136 58.870 58.870 57.833 1.037 25768 17083 1 19 . 1 1 136 136 SER CB C 136 64.200 64.200 63.364 0.836 25768 17084 1 19 . 1 1 136 136 SER H H 136 8.160 8.160 8.239 -0.079 25768 17085 1 19 . 1 1 137 137 SER N N 137 117.650 117.650 115.226 2.424 25768 17086 1 19 . 1 1 137 137 SER C C 137 174.410 174.410 174.710 -0.300 25768 17087 1 19 . 1 1 137 137 SER CA C 137 58.880 58.880 58.147 0.733 25768 17088 1 19 . 1 1 137 137 SER CB C 137 64.140 64.140 63.656 0.484 25768 17089 1 19 . 1 1 137 137 SER H H 137 8.140 8.140 7.848 0.292 25768 17090 1 19 . 1 1 138 138 MET N N 138 121.980 121.980 119.063 2.917 25768 17091 1 19 . 1 1 138 138 MET C C 138 175.680 175.680 174.422 1.258 25768 17092 1 19 . 1 1 138 138 MET CA C 138 56.180 56.180 56.564 -0.384 25768 17093 1 19 . 1 1 138 138 MET CB C 138 33.240 33.240 33.182 0.058 25768 17094 1 19 . 1 1 138 138 MET H H 138 8.110 8.110 8.295 -0.185 25768 17095 1 19 . 1 1 139 139 LYS N N 139 122.110 122.110 120.609 1.501 25768 17096 1 19 . 1 1 139 139 LYS C C 139 176.220 176.220 176.068 0.152 25768 17097 1 19 . 1 1 139 139 LYS CA C 139 56.370 56.370 56.027 0.343 25768 17098 1 19 . 1 1 139 139 LYS CB C 139 33.220 33.220 33.037 0.183 25768 17099 1 19 . 1 1 139 139 LYS H H 139 8.140 8.140 8.326 -0.186 25768 17100 1 19 . 1 1 140 140 LEU N N 140 123.860 123.860 124.586 -0.726 25768 17101 1 19 . 1 1 140 140 LEU C C 140 177.100 177.100 177.045 0.055 25768 17102 1 19 . 1 1 140 140 LEU CA C 140 55.710 55.710 55.494 0.216 25768 17103 1 19 . 1 1 140 140 LEU CB C 140 42.460 42.460 43.273 -0.813 25768 17104 1 19 . 1 1 140 140 LEU H H 140 8.140 8.140 8.537 -0.397 25768 17105 1 19 . 1 1 141 141 GLN N N 141 120.350 120.350 119.643 0.707 25768 17106 1 19 . 1 1 141 141 GLN C C 141 175.170 175.170 175.947 -0.777 25768 17107 1 19 . 1 1 141 141 GLN CA C 141 56.200 56.200 57.087 -0.887 25768 17108 1 19 . 1 1 141 141 GLN CB C 141 29.950 29.950 29.442 0.508 25768 17109 1 19 . 1 1 141 141 GLN H H 141 8.210 8.210 7.885 0.325 25768 17110 1 19 . 1 1 142 142 ASP N N 142 120.950 120.950 120.213 0.737 25768 17111 1 19 . 1 1 142 142 ASP C C 142 175.840 175.840 175.772 0.068 25768 17112 1 19 . 1 1 142 142 ASP CA C 142 54.700 54.700 55.330 -0.629 25768 17113 1 19 . 1 1 142 142 ASP CB C 142 41.760 41.760 40.166 1.594 25768 17114 1 19 . 1 1 142 142 ASP H H 142 8.120 8.120 8.830 -0.710 25768 17115 1 19 . 1 1 143 143 SER N N 143 114.880 114.880 114.983 -0.103 25768 17116 1 19 . 1 1 143 143 SER C C 143 173.290 173.290 174.947 -1.657 25768 17117 1 19 . 1 1 143 143 SER CA C 143 58.450 58.450 60.846 -2.396 25768 17118 1 19 . 1 1 143 143 SER CB C 143 64.760 64.760 63.890 0.870 25768 17119 1 19 . 1 1 143 143 SER H H 143 7.960 7.960 8.582 -0.622 25768 17120 1 19 . 1 1 144 144 TRP N N 144 123.110 123.110 119.721 3.389 25768 17121 1 19 . 1 1 144 144 TRP C C 144 175.880 175.880 176.501 -0.621 25768 17122 1 19 . 1 1 144 144 TRP CA C 144 56.420 56.420 56.878 -0.458 25768 17123 1 19 . 1 1 144 144 TRP CB C 144 31.160 31.160 31.520 -0.360 25768 17124 1 19 . 1 1 144 144 TRP H H 144 8.080 8.080 8.161 -0.081 25768 17125 1 19 . 1 1 145 145 GLY N N 145 110.410 110.410 106.743 3.667 25768 17126 1 19 . 1 1 145 145 GLY C C 145 172.870 172.870 172.949 -0.079 25768 17127 1 19 . 1 1 145 145 GLY CA C 145 45.130 45.130 44.919 0.211 25768 17128 1 19 . 1 1 145 145 GLY H H 145 8.660 8.660 8.431 0.229 25768 17129 1 19 . 1 1 148 148 GLY C C 148 171.800 171.800 173.567 -1.767 25768 17130 1 19 . 1 1 148 148 GLY CA C 148 44.140 44.140 44.262 -0.122 25768 17131 1 19 . 1 1 149 149 GLU N N 149 123.070 123.070 121.624 1.446 25768 17132 1 19 . 1 1 149 149 GLU C C 149 174.210 174.210 173.833 0.377 25768 17133 1 19 . 1 1 149 149 GLU CA C 149 55.120 55.120 55.937 -0.817 25768 17134 1 19 . 1 1 149 149 GLU CB C 149 37.410 37.410 34.246 3.164 25768 17135 1 19 . 1 1 149 149 GLU H H 149 8.550 8.550 7.778 0.772 25768 17136 1 19 . 1 1 150 150 LEU N N 150 126.130 126.130 122.850 3.280 25768 17137 1 19 . 1 1 150 150 LEU C C 150 174.410 174.410 174.659 -0.249 25768 17138 1 19 . 1 1 150 150 LEU CA C 150 54.260 54.260 53.997 0.263 25768 17139 1 19 . 1 1 150 150 LEU CB C 150 47.510 47.510 46.614 0.896 25768 17140 1 19 . 1 1 150 150 LEU H H 150 8.550 8.550 8.096 0.454 25768 17141 1 19 . 1 1 151 151 GLY N N 151 109.500 109.500 107.790 1.710 25768 17142 1 19 . 1 1 151 151 GLY C C 151 170.610 170.610 171.664 -1.054 25768 17143 1 19 . 1 1 151 151 GLY CA C 151 45.980 45.980 44.630 1.350 25768 17144 1 19 . 1 1 151 151 GLY H H 151 8.090 8.090 8.146 -0.056 25768 17145 1 19 . 1 1 152 152 PHE N N 152 110.960 110.960 117.151 -6.191 25768 17146 1 19 . 1 1 152 152 PHE C C 152 171.510 171.510 173.758 -2.248 25768 17147 1 19 . 1 1 152 152 PHE CA C 152 58.170 58.170 57.299 0.871 25768 17148 1 19 . 1 1 152 152 PHE CB C 152 41.690 41.690 43.090 -1.400 25768 17149 1 19 . 1 1 152 152 PHE H H 152 8.380 8.380 7.701 0.679 25768 17150 1 19 . 1 1 153 153 ASP N N 153 118.880 118.880 124.204 -5.324 25768 17151 1 19 . 1 1 153 153 ASP C C 153 176.520 176.520 174.759 1.761 25768 17152 1 19 . 1 1 153 153 ASP CA C 153 52.940 52.940 52.466 0.474 25768 17153 1 19 . 1 1 153 153 ASP CB C 153 44.540 44.540 44.421 0.119 25768 17154 1 19 . 1 1 153 153 ASP H H 153 7.970 7.970 8.272 -0.302 25768 17155 1 19 . 1 1 154 154 TYR N N 154 123.630 123.630 119.768 3.862 25768 17156 1 19 . 1 1 154 154 TYR C C 154 175.610 175.610 173.876 1.734 25768 17157 1 19 . 1 1 154 154 TYR CA C 154 57.310 57.310 55.990 1.320 25768 17158 1 19 . 1 1 154 154 TYR CB C 154 42.040 42.040 40.471 1.569 25768 17159 1 19 . 1 1 154 154 TYR H H 154 9.730 9.730 8.193 1.537 25768 17160 1 19 . 1 1 155 155 MET N N 155 126.190 126.190 120.505 5.685 25768 17161 1 19 . 1 1 155 155 MET C C 155 174.970 174.970 175.797 -0.827 25768 17162 1 19 . 1 1 155 155 MET CA C 155 54.720 54.720 56.940 -2.220 25768 17163 1 19 . 1 1 155 155 MET CB C 155 28.300 28.300 33.228 -4.928 25768 17164 1 19 . 1 1 155 155 MET H H 155 8.600 8.600 9.149 -0.549 25768 17165 1 19 . 1 1 156 156 LEU N N 156 125.290 125.290 123.423 1.867 25768 17166 1 19 . 1 1 156 156 LEU C C 156 177.680 177.680 177.403 0.277 25768 17167 1 19 . 1 1 156 156 LEU CA C 156 56.040 56.040 55.076 0.964 25768 17168 1 19 . 1 1 156 156 LEU CB C 156 43.040 43.040 42.697 0.343 25768 17169 1 19 . 1 1 156 156 LEU H H 156 9.190 9.190 8.559 0.631 25768 17170 1 19 . 1 1 157 157 ASN N N 157 114.690 114.690 116.882 -2.192 25768 17171 1 19 . 1 1 157 157 ASN C C 157 173.640 173.640 177.021 -3.381 25768 17172 1 19 . 1 1 157 157 ASN CA C 157 52.650 52.650 56.273 -3.623 25768 17173 1 19 . 1 1 157 157 ASN CB C 157 37.270 37.270 36.608 0.662 25768 17174 1 19 . 1 1 157 157 ASN H H 157 8.060 8.060 8.187 -0.127 25768 17175 1 19 . 1 1 158 158 GLU N N 158 114.530 114.530 121.824 -7.294 25768 17176 1 19 . 1 1 158 158 GLU C C 158 176.090 176.090 177.270 -1.180 25768 17177 1 19 . 1 1 158 158 GLU CA C 158 60.010 60.010 58.396 1.614 25768 17178 1 19 . 1 1 158 158 GLU CB C 158 29.730 29.730 30.219 -0.489 25768 17179 1 19 . 1 1 158 158 GLU H H 158 8.560 8.560 8.391 0.169 25768 17180 1 19 . 1 1 159 159 HIS N N 159 110.480 110.480 116.714 -6.234 25768 17181 1 19 . 1 1 159 159 HIS C C 159 173.130 173.130 173.999 -0.869 25768 17182 1 19 . 1 1 159 159 HIS CA C 159 56.770 56.770 54.800 1.970 25768 17183 1 19 . 1 1 159 159 HIS CB C 159 32.630 32.630 29.443 3.187 25768 17184 1 19 . 1 1 159 159 HIS H H 159 8.190 8.190 7.939 0.251 25768 17185 1 19 . 1 1 160 160 ALA N N 160 122.890 122.890 121.014 1.876 25768 17186 1 19 . 1 1 160 160 ALA C C 160 176.200 176.200 175.635 0.565 25768 17187 1 19 . 1 1 160 160 ALA CA C 160 51.730 51.730 54.441 -2.711 25768 17188 1 19 . 1 1 160 160 ALA CB C 160 21.560 21.560 18.092 3.468 25768 17189 1 19 . 1 1 160 160 ALA H H 160 8.400 8.400 7.699 0.701 25768 17190 1 19 . 1 1 161 161 LEU N N 161 116.540 116.540 117.466 -0.926 25768 17191 1 19 . 1 1 161 161 LEU C C 161 174.930 174.930 175.193 -0.263 25768 17192 1 19 . 1 1 161 161 LEU CA C 161 54.280 54.280 54.231 0.049 25768 17193 1 19 . 1 1 161 161 LEU CB C 161 45.640 45.640 46.933 -1.293 25768 17194 1 19 . 1 1 161 161 LEU H H 161 8.590 8.590 8.078 0.512 25768 17195 1 19 . 1 1 162 162 PHE N N 162 121.780 121.780 120.892 0.888 25768 17196 1 19 . 1 1 162 162 PHE C C 162 171.960 171.960 173.163 -1.203 25768 17197 1 19 . 1 1 162 162 PHE CA C 162 56.420 56.420 55.840 0.580 25768 17198 1 19 . 1 1 162 162 PHE CB C 162 43.340 43.340 43.085 0.255 25768 17199 1 19 . 1 1 162 162 PHE H H 162 9.180 9.180 8.808 0.372 25768 17200 1 19 . 1 1 163 163 ASN N N 163 127.850 127.850 123.658 4.192 25768 17201 1 19 . 1 1 163 163 ASN C C 163 171.320 171.320 172.998 -1.678 25768 17202 1 19 . 1 1 163 163 ASN CA C 163 52.340 52.340 52.883 -0.543 25768 17203 1 19 . 1 1 163 163 ASN CB C 163 46.410 46.410 42.555 3.855 25768 17204 1 19 . 1 1 163 163 ASN H H 163 7.700 7.700 7.461 0.239 25768 17205 1 19 . 1 1 164 164 MET N N 164 119.950 119.950 122.662 -2.712 25768 17206 1 19 . 1 1 164 164 MET C C 164 172.830 172.830 173.791 -0.961 25768 17207 1 19 . 1 1 164 164 MET CA C 164 55.180 55.180 53.816 1.364 25768 17208 1 19 . 1 1 164 164 MET CB C 164 37.770 37.770 38.153 -0.383 25768 17209 1 19 . 1 1 164 164 MET H H 164 7.070 7.070 8.464 -1.394 25768 17210 1 19 . 1 1 165 165 ALA N N 165 120.600 120.600 123.627 -3.027 25768 17211 1 19 . 1 1 165 165 ALA C C 165 174.240 174.240 174.782 -0.542 25768 17212 1 19 . 1 1 165 165 ALA CA C 165 51.630 51.630 51.170 0.460 25768 17213 1 19 . 1 1 165 165 ALA CB C 165 22.330 22.330 22.569 -0.239 25768 17214 1 19 . 1 1 165 165 ALA H H 165 8.290 8.290 8.309 -0.019 25768 17215 1 19 . 1 1 166 166 VAL N N 166 117.900 117.900 120.421 -2.521 25768 17216 1 19 . 1 1 166 166 VAL C C 166 172.950 172.950 174.335 -1.385 25768 17217 1 19 . 1 1 166 166 VAL CA C 166 59.710 59.710 61.597 -1.887 25768 17218 1 19 . 1 1 166 166 VAL CB C 166 35.290 35.290 35.946 -0.655 25768 17219 1 19 . 1 1 166 166 VAL H H 166 8.720 8.720 8.887 -0.167 25768 17220 1 19 . 1 1 171 171 ILE C C 171 175.750 175.750 175.137 0.613 25768 17221 1 19 . 1 1 171 171 ILE CA C 171 61.720 61.720 62.697 -0.977 25768 17222 1 19 . 1 1 171 171 ILE CB C 171 39.300 39.300 39.633 -0.333 25768 17223 1 19 . 1 1 172 172 ASP N N 172 124.070 124.070 120.044 4.026 25768 17224 1 19 . 1 1 172 172 ASP C C 172 176.590 176.590 176.475 0.115 25768 17225 1 19 . 1 1 172 172 ASP CA C 172 54.460 54.460 55.370 -0.909 25768 17226 1 19 . 1 1 172 172 ASP CB C 172 41.410 41.410 41.068 0.342 25768 17227 1 19 . 1 1 172 172 ASP H H 172 8.460 8.460 8.316 0.144 25768 17228 1 19 . 1 1 173 173 THR N N 173 115.570 115.570 112.292 3.278 25768 17229 1 19 . 1 1 173 173 THR C C 173 175.030 175.030 174.219 0.811 25768 17230 1 19 . 1 1 173 173 THR CA C 173 62.680 62.680 61.182 1.498 25768 17231 1 19 . 1 1 173 173 THR CB C 173 69.840 69.840 70.125 -0.285 25768 17232 1 19 . 1 1 173 173 THR H H 173 8.080 8.080 7.653 0.427 25768 17233 1 19 . 1 1 174 174 LYS N N 174 122.680 122.680 122.738 -0.058 25768 17234 1 19 . 1 1 174 174 LYS C C 174 176.340 176.340 175.388 0.952 25768 17235 1 19 . 1 1 174 174 LYS CA C 174 56.820 56.820 55.613 1.207 25768 17236 1 19 . 1 1 174 174 LYS CB C 174 32.790 32.790 32.273 0.518 25768 17237 1 19 . 1 1 174 174 LYS H H 174 8.180 8.180 8.584 -0.404 25768 17238 1 19 . 1 1 175 175 ALA N N 175 124.050 124.050 123.337 0.713 25768 17239 1 19 . 1 1 175 175 ALA C C 175 177.550 177.550 175.607 1.943 25768 17240 1 19 . 1 1 175 175 ALA CA C 175 52.840 52.840 51.879 0.961 25768 17241 1 19 . 1 1 175 175 ALA CB C 175 19.580 19.580 20.267 -0.688 25768 17242 1 19 . 1 1 175 175 ALA H H 175 8.050 8.050 7.722 0.328 25768 17243 1 19 . 1 1 176 176 SER N N 176 114.920 114.920 115.901 -0.981 25768 17244 1 19 . 1 1 176 176 SER C C 176 174.240 174.240 173.049 1.191 25768 17245 1 19 . 1 1 176 176 SER CA C 176 58.390 58.390 58.428 -0.038 25768 17246 1 19 . 1 1 176 176 SER CB C 176 64.370 64.370 64.535 -0.165 25768 17247 1 19 . 1 1 176 176 SER H H 176 8.070 8.070 8.275 -0.205 25768 17248 1 19 . 1 1 177 177 ILE N N 177 121.650 121.650 123.487 -1.837 25768 17249 1 19 . 1 1 177 177 ILE C C 177 174.990 174.990 175.331 -0.341 25768 17250 1 19 . 1 1 177 177 ILE CA C 177 61.570 61.570 61.257 0.313 25768 17251 1 19 . 1 1 177 177 ILE CB C 177 39.100 39.100 39.443 -0.343 25768 17252 1 19 . 1 1 177 177 ILE H H 177 7.960 7.960 8.353 -0.393 25768 17253 1 19 . 1 1 178 178 ASN N N 178 127.040 127.040 125.228 1.812 25768 17254 1 19 . 1 1 178 178 ASN C C 178 179.160 179.160 174.870 4.290 25768 17255 1 19 . 1 1 178 178 ASN CA C 178 55.100 55.100 53.455 1.645 25768 17256 1 19 . 1 1 178 178 ASN CB C 178 41.300 41.300 39.001 2.299 25768 17257 1 19 . 1 1 178 178 ASN H H 178 7.850 7.850 8.768 -0.918 25768 17258 1 19 . 1 1 180 180 PRO C C 180 177.520 177.520 176.350 1.170 25768 17259 1 19 . 1 1 180 180 PRO CA C 180 63.980 63.980 62.406 1.574 25768 17260 1 19 . 1 1 180 180 PRO CB C 180 32.190 32.190 32.743 -0.553 25768 17261 1 19 . 1 1 181 181 SER N N 181 115.600 115.600 118.782 -3.182 25768 17262 1 19 . 1 1 181 181 SER C C 181 174.710 174.710 174.522 0.188 25768 17263 1 19 . 1 1 181 181 SER CA C 181 58.900 58.900 58.970 -0.070 25768 17264 1 19 . 1 1 181 181 SER CB C 181 64.070 64.070 63.544 0.526 25768 17265 1 19 . 1 1 181 181 SER H H 181 8.260 8.260 8.968 -0.708 25768 17266 1 19 . 1 1 182 182 ALA N N 182 125.880 125.880 122.760 3.120 25768 17267 1 19 . 1 1 182 182 ALA C C 182 177.560 177.560 177.402 0.158 25768 17268 1 19 . 1 1 182 182 ALA CA C 182 53.090 53.090 52.346 0.744 25768 17269 1 19 . 1 1 182 182 ALA CB C 182 19.310 19.310 19.035 0.275 25768 17270 1 19 . 1 1 182 182 ALA H H 182 8.130 8.130 8.436 -0.306 25768 17271 1 19 . 1 1 183 183 LEU N N 183 119.980 119.980 119.522 0.458 25768 17272 1 19 . 1 1 183 183 LEU C C 183 177.850 177.850 176.165 1.685 25768 17273 1 19 . 1 1 183 183 LEU CA C 183 55.650 55.650 54.237 1.413 25768 17274 1 19 . 1 1 183 183 LEU CB C 183 42.530 42.530 44.438 -1.908 25768 17275 1 19 . 1 1 183 183 LEU H H 183 7.940 7.940 8.138 -0.198 25768 17276 1 19 . 1 1 184 184 GLY N N 184 109.250 109.250 108.223 1.027 25768 17277 1 19 . 1 1 184 184 GLY C C 184 174.250 174.250 173.066 1.184 25768 17278 1 19 . 1 1 184 184 GLY CA C 184 45.830 45.830 44.403 1.427 25768 17279 1 19 . 1 1 184 184 GLY H H 184 8.150 8.150 8.055 0.095 25768 17280 1 19 . 1 1 185 185 VAL N N 185 118.830 118.830 119.420 -0.590 25768 17281 1 19 . 1 1 185 185 VAL C C 185 175.890 175.890 174.878 1.012 25768 17282 1 19 . 1 1 185 185 VAL CA C 185 62.740 62.740 62.158 0.582 25768 17283 1 19 . 1 1 185 185 VAL CB C 185 32.770 32.770 31.538 1.232 25768 17284 1 19 . 1 1 185 185 VAL H H 185 7.760 7.760 8.363 -0.603 25768 17285 1 19 . 1 1 186 186 ASN N N 186 121.850 121.850 125.526 -3.676 25768 17286 1 19 . 1 1 186 186 ASN C C 186 174.970 174.970 175.300 -0.330 25768 17287 1 19 . 1 1 186 186 ASN CA C 186 53.590 53.590 53.429 0.161 25768 17288 1 19 . 1 1 186 186 ASN CB C 186 39.160 39.160 39.342 -0.182 25768 17289 1 19 . 1 1 186 186 ASN H H 186 8.380 8.380 8.471 -0.091 25768 17290 1 19 . 1 1 187 187 LYS N N 187 122.120 122.120 122.941 -0.821 25768 17291 1 19 . 1 1 187 187 LYS C C 187 176.490 176.490 176.370 0.120 25768 17292 1 19 . 1 1 187 187 LYS CA C 187 56.750 56.750 56.887 -0.137 25768 17293 1 19 . 1 1 187 187 LYS CB C 187 33.250 33.250 31.739 1.510 25768 17294 1 19 . 1 1 187 187 LYS H H 187 8.140 8.140 8.389 -0.249 25768 17295 1 19 . 1 1 188 188 THR N N 188 115.250 115.250 117.624 -2.374 25768 17296 1 19 . 1 1 188 188 THR C C 188 174.250 174.250 173.630 0.620 25768 17297 1 19 . 1 1 188 188 THR CA C 188 62.360 62.360 61.505 0.855 25768 17298 1 19 . 1 1 188 188 THR CB C 188 70.280 70.280 70.463 -0.184 25768 17299 1 19 . 1 1 188 188 THR H H 188 8.100 8.100 7.967 0.133 25768 17300 1 19 . 1 1 189 189 LYS N N 189 123.780 123.780 122.331 1.449 25768 17301 1 19 . 1 1 189 189 LYS C C 189 176.090 176.090 175.790 0.300 25768 17302 1 19 . 1 1 189 189 LYS CA C 189 56.590 56.590 55.907 0.683 25768 17303 1 19 . 1 1 189 189 LYS CB C 189 33.350 33.350 33.281 0.070 25768 17304 1 19 . 1 1 189 189 LYS H H 189 8.110 8.110 8.429 -0.319 25768 17305 1 19 . 1 1 190 190 VAL N N 190 120.920 120.920 122.849 -1.929 25768 17306 1 19 . 1 1 190 190 VAL C C 190 175.590 175.590 175.923 -0.333 25768 17307 1 19 . 1 1 190 190 VAL CA C 190 62.400 62.400 62.831 -0.431 25768 17308 1 19 . 1 1 190 190 VAL CB C 190 32.990 32.990 32.794 0.196 25768 17309 1 19 . 1 1 190 190 VAL H H 190 8.040 8.040 8.628 -0.588 25768 17310 1 19 . 1 1 191 191 ASP N N 191 123.790 123.790 118.414 5.376 25768 17311 1 19 . 1 1 191 191 ASP C C 191 175.750 175.750 175.710 0.040 25768 17312 1 19 . 1 1 191 191 ASP CA C 191 54.650 54.650 54.519 0.131 25768 17313 1 19 . 1 1 191 191 ASP CB C 191 41.450 41.450 42.060 -0.610 25768 17314 1 19 . 1 1 191 191 ASP H H 191 8.240 8.240 8.046 0.194 25768 17315 1 19 . 1 1 192 192 VAL N N 192 118.850 118.850 121.088 -2.238 25768 17316 1 19 . 1 1 192 192 VAL C C 192 175.380 175.380 174.298 1.082 25768 17317 1 19 . 1 1 192 192 VAL CA C 192 62.110 62.110 63.981 -1.871 25768 17318 1 19 . 1 1 192 192 VAL CB C 192 33.290 33.290 30.721 2.568 25768 17319 1 19 . 1 1 192 192 VAL H H 192 7.860 7.860 8.106 -0.246 25768 17320 1 19 . 1 1 193 193 ASP N N 193 124.190 124.190 121.594 2.596 25768 17321 1 19 . 1 1 193 193 ASP C C 193 175.630 175.630 175.393 0.237 25768 17322 1 19 . 1 1 193 193 ASP CA C 193 54.540 54.540 54.187 0.353 25768 17323 1 19 . 1 1 193 193 ASP CB C 193 41.410 41.410 42.600 -1.190 25768 17324 1 19 . 1 1 193 193 ASP H H 193 8.310 8.310 8.191 0.119 25768 17325 1 19 . 1 1 194 194 VAL N N 194 119.580 119.580 117.355 2.225 25768 17326 1 19 . 1 1 194 194 VAL C C 194 174.950 174.950 174.329 0.621 25768 17327 1 19 . 1 1 194 194 VAL CA C 194 61.770 61.770 61.033 0.737 25768 17328 1 19 . 1 1 194 194 VAL CB C 194 33.680 33.680 36.085 -2.405 25768 17329 1 19 . 1 1 194 194 VAL H H 194 7.890 7.890 7.834 0.056 25768 17330 1 19 . 1 1 195 195 ASP N N 195 125.660 125.660 125.588 0.072 25768 17331 1 19 . 1 1 195 195 ASP C C 195 174.290 174.290 174.895 -0.605 25768 17332 1 19 . 1 1 195 195 ASP CA C 195 51.940 51.940 53.166 -1.226 25768 17333 1 19 . 1 1 195 195 ASP CB C 195 40.950 40.950 41.435 -0.485 25768 17334 1 19 . 1 1 195 195 ASP H H 195 8.410 8.410 8.489 -0.079 25768 17335 1 19 . 1 1 198 198 VAL C C 198 173.940 173.940 173.868 0.072 25768 17336 1 19 . 1 1 198 198 VAL CA C 198 61.270 61.270 59.712 1.558 25768 17337 1 19 . 1 1 198 198 VAL CB C 198 35.910 35.910 32.020 3.890 25768 17338 1 19 . 1 1 199 199 TYR N N 199 123.780 123.780 120.457 3.323 25768 17339 1 19 . 1 1 199 199 TYR C C 199 174.150 174.150 173.374 0.776 25768 17340 1 19 . 1 1 199 199 TYR CA C 199 56.220 56.220 55.543 0.677 25768 17341 1 19 . 1 1 199 199 TYR CB C 199 41.660 41.660 41.176 0.484 25768 17342 1 19 . 1 1 199 199 TYR H H 199 8.540 8.540 7.384 1.156 25768 17343 1 19 . 1 1 200 200 MET N N 200 123.920 123.920 119.911 4.009 25768 17344 1 19 . 1 1 200 200 MET C C 200 173.810 173.810 174.523 -0.713 25768 17345 1 19 . 1 1 200 200 MET CA C 200 54.710 54.710 55.276 -0.567 25768 17346 1 19 . 1 1 200 200 MET CB C 200 37.110 37.110 36.362 0.748 25768 17347 1 19 . 1 1 200 200 MET H H 200 9.130 9.130 8.241 0.889 25768 17348 1 19 . 1 1 201 201 ILE N N 201 123.670 123.670 121.754 1.916 25768 17349 1 19 . 1 1 201 201 ILE C C 201 174.030 174.030 174.888 -0.858 25768 17350 1 19 . 1 1 201 201 ILE CA C 201 59.820 59.820 59.313 0.507 25768 17351 1 19 . 1 1 201 201 ILE CB C 201 41.720 41.720 41.215 0.506 25768 17352 1 19 . 1 1 201 201 ILE H H 201 8.030 8.030 8.151 -0.121 25768 17353 1 19 . 1 1 202 202 GLY N N 202 112.910 112.910 111.933 0.977 25768 17354 1 19 . 1 1 202 202 GLY C C 202 170.280 170.280 171.462 -1.182 25768 17355 1 19 . 1 1 202 202 GLY CA C 202 46.800 46.800 45.364 1.436 25768 17356 1 19 . 1 1 202 202 GLY H H 202 8.580 8.580 7.335 1.245 25768 17357 1 19 . 1 1 203 203 PHE N N 203 116.240 116.240 116.555 -0.315 25768 17358 1 19 . 1 1 203 203 PHE C C 203 173.940 173.940 174.727 -0.787 25768 17359 1 19 . 1 1 203 203 PHE CA C 203 55.890 55.890 55.861 0.029 25768 17360 1 19 . 1 1 203 203 PHE CB C 203 45.060 45.060 43.269 1.791 25768 17361 1 19 . 1 1 203 203 PHE H H 203 8.620 8.620 8.124 0.496 25768 17362 1 19 . 1 1 204 204 GLY N N 204 105.610 105.610 106.586 -0.976 25768 17363 1 19 . 1 1 204 204 GLY C C 204 171.190 171.190 171.668 -0.478 25768 17364 1 19 . 1 1 204 204 GLY CA C 204 46.720 46.720 44.413 2.308 25768 17365 1 19 . 1 1 204 204 GLY H H 204 8.960 8.960 8.689 0.271 25768 17366 1 19 . 1 1 205 205 TYR N N 205 121.160 121.160 118.003 3.157 25768 17367 1 19 . 1 1 205 205 TYR C C 205 173.030 173.030 173.648 -0.618 25768 17368 1 19 . 1 1 205 205 TYR CA C 205 57.190 57.190 57.192 -0.002 25768 17369 1 19 . 1 1 205 205 TYR CB C 205 44.400 44.400 42.874 1.526 25768 17370 1 19 . 1 1 205 205 TYR H H 205 9.380 9.380 8.941 0.439 25768 17371 1 19 . 1 1 206 206 LYS N N 206 126.970 126.970 127.913 -0.943 25768 17372 1 19 . 1 1 206 206 LYS C C 206 174.210 174.210 175.174 -0.964 25768 17373 1 19 . 1 1 206 206 LYS CA C 206 54.770 54.770 55.567 -0.797 25768 17374 1 19 . 1 1 206 206 LYS CB C 206 34.440 34.440 33.696 0.744 25768 17375 1 19 . 1 1 206 206 LYS H H 206 8.380 8.380 8.172 0.208 25768 17376 1 19 . 1 1 207 207 PHE N N 207 126.330 126.330 127.515 -1.185 25768 17377 1 19 . 1 1 207 207 PHE C C 207 175.020 175.020 174.639 0.381 25768 17378 1 19 . 1 1 207 207 PHE CA C 207 58.170 58.170 57.161 1.009 25768 17379 1 19 . 1 1 207 207 PHE CB C 207 40.920 40.920 40.582 0.338 25768 17380 1 19 . 1 1 207 207 PHE H H 207 9.290 9.290 8.150 1.140 25768 17381 1 19 . 1 1 208 208 LEU N N 208 122.740 122.740 122.615 0.125 25768 17382 1 19 . 1 1 208 208 LEU C C 208 176.510 176.510 176.246 0.264 25768 17383 1 19 . 1 1 208 208 LEU CA C 208 54.910 54.910 54.548 0.362 25768 17384 1 19 . 1 1 208 208 LEU CB C 208 43.830 43.830 42.591 1.239 25768 17385 1 19 . 1 1 208 208 LEU H H 208 8.310 8.310 7.994 0.316 25768 17386 1 20 . 1 1 2 2 HIS C C 2 175.310 175.310 173.833 1.477 25768 17387 1 20 . 1 1 3 3 LYS N N 3 122.080 122.080 122.508 -0.428 25768 17388 1 20 . 1 1 3 3 LYS C C 3 173.490 173.490 174.385 -0.895 25768 17389 1 20 . 1 1 3 3 LYS CA C 3 55.050 55.050 54.872 0.178 25768 17390 1 20 . 1 1 3 3 LYS CB C 3 35.380 35.380 36.078 -0.698 25768 17391 1 20 . 1 1 3 3 LYS H H 3 8.620 8.620 8.307 0.313 25768 17392 1 20 . 1 1 4 4 ALA N N 4 120.860 120.860 121.547 -0.687 25768 17393 1 20 . 1 1 4 4 ALA C C 4 178.190 178.190 177.978 0.212 25768 17394 1 20 . 1 1 4 4 ALA CA C 4 53.480 53.480 52.825 0.655 25768 17395 1 20 . 1 1 4 4 ALA CB C 4 18.140 18.140 18.514 -0.374 25768 17396 1 20 . 1 1 4 4 ALA H H 4 8.580 8.580 8.214 0.366 25768 17397 1 20 . 1 1 5 5 GLY N N 5 112.890 112.890 111.880 1.010 25768 17398 1 20 . 1 1 5 5 GLY C C 5 173.830 173.830 173.837 -0.007 25768 17399 1 20 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.803 0.076 25768 17400 1 20 . 1 1 5 5 GLY H H 5 9.210 9.210 8.650 0.560 25768 17401 1 20 . 1 1 6 6 ASP N N 6 121.590 121.590 120.845 0.745 25768 17402 1 20 . 1 1 6 6 ASP C C 6 174.380 174.380 174.811 -0.431 25768 17403 1 20 . 1 1 6 6 ASP CA C 6 55.790 55.790 53.226 2.564 25768 17404 1 20 . 1 1 6 6 ASP CB C 6 41.760 41.760 42.845 -1.085 25768 17405 1 20 . 1 1 6 6 ASP H H 6 7.620 7.620 7.698 -0.078 25768 17406 1 20 . 1 1 7 7 PHE N N 7 120.860 120.860 114.005 6.855 25768 17407 1 20 . 1 1 7 7 PHE C C 7 174.050 174.050 173.304 0.746 25768 17408 1 20 . 1 1 7 7 PHE CA C 7 56.110 56.110 55.917 0.193 25768 17409 1 20 . 1 1 7 7 PHE CB C 7 42.550 42.550 41.958 0.592 25768 17410 1 20 . 1 1 7 7 PHE H H 7 8.250 8.250 8.073 0.177 25768 17411 1 20 . 1 1 8 8 ILE N N 8 127.950 127.950 119.142 8.808 25768 17412 1 20 . 1 1 8 8 ILE C C 8 174.000 174.000 174.872 -0.872 25768 17413 1 20 . 1 1 8 8 ILE CA C 8 61.160 61.160 59.917 1.243 25768 17414 1 20 . 1 1 8 8 ILE CB C 8 42.660 42.660 42.025 0.635 25768 17415 1 20 . 1 1 8 8 ILE H H 8 9.230 9.230 8.583 0.647 25768 17416 1 20 . 1 1 9 9 ILE N N 9 125.380 125.380 124.950 0.430 25768 17417 1 20 . 1 1 9 9 ILE C C 9 173.630 173.630 174.895 -1.265 25768 17418 1 20 . 1 1 9 9 ILE CA C 9 59.600 59.600 60.711 -1.111 25768 17419 1 20 . 1 1 9 9 ILE CB C 9 41.180 41.180 38.824 2.356 25768 17420 1 20 . 1 1 9 9 ILE H H 9 8.580 8.580 8.437 0.143 25768 17421 1 20 . 1 1 10 10 ARG N N 10 124.950 124.950 126.986 -2.036 25768 17422 1 20 . 1 1 10 10 ARG C C 10 175.030 175.030 175.859 -0.829 25768 17423 1 20 . 1 1 10 10 ARG CA C 10 53.920 53.920 53.902 0.018 25768 17424 1 20 . 1 1 10 10 ARG CB C 10 31.880 31.880 32.703 -0.823 25768 17425 1 20 . 1 1 10 10 ARG H H 10 9.230 9.230 8.555 0.675 25768 17426 1 20 . 1 1 11 11 GLY N N 11 105.650 105.650 106.628 -0.978 25768 17427 1 20 . 1 1 11 11 GLY C C 11 172.090 172.090 171.924 0.166 25768 17428 1 20 . 1 1 11 11 GLY CA C 11 44.460 44.460 45.441 -0.981 25768 17429 1 20 . 1 1 11 11 GLY H H 11 8.780 8.780 8.297 0.483 25768 17430 1 20 . 1 1 12 12 GLY N N 12 107.800 107.800 110.622 -2.822 25768 17431 1 20 . 1 1 12 12 GLY C C 12 171.460 171.460 171.717 -0.257 25768 17432 1 20 . 1 1 12 12 GLY CA C 12 46.630 46.630 44.336 2.294 25768 17433 1 20 . 1 1 12 12 GLY H H 12 8.510 8.510 7.754 0.756 25768 17434 1 20 . 1 1 13 13 PHE N N 13 119.900 119.900 118.419 1.481 25768 17435 1 20 . 1 1 13 13 PHE C C 13 174.190 174.190 173.610 0.580 25768 17436 1 20 . 1 1 13 13 PHE CA C 13 56.340 56.340 56.709 -0.369 25768 17437 1 20 . 1 1 13 13 PHE CB C 13 41.090 41.090 44.033 -2.943 25768 17438 1 20 . 1 1 13 13 PHE H H 13 8.610 8.610 8.613 -0.003 25768 17439 1 20 . 1 1 14 14 ALA N N 14 128.030 128.030 123.302 4.728 25768 17440 1 20 . 1 1 14 14 ALA C C 14 176.560 176.560 176.706 -0.146 25768 17441 1 20 . 1 1 14 14 ALA CA C 14 49.940 49.940 50.844 -0.904 25768 17442 1 20 . 1 1 14 14 ALA CB C 14 20.360 20.360 22.383 -2.022 25768 17443 1 20 . 1 1 14 14 ALA H H 14 9.220 9.220 8.834 0.387 25768 17444 1 20 . 1 1 15 15 THR N N 15 118.620 118.620 115.925 2.695 25768 17445 1 20 . 1 1 15 15 THR CA C 15 61.440 61.440 61.149 0.291 25768 17446 1 20 . 1 1 15 15 THR CB C 15 71.370 71.370 69.782 1.587 25768 17447 1 20 . 1 1 15 15 THR H H 15 9.220 9.220 8.361 0.859 25768 17448 1 20 . 1 1 18 18 PRO C C 18 176.690 176.690 176.832 -0.142 25768 17449 1 20 . 1 1 18 18 PRO CA C 18 63.610 63.610 64.140 -0.530 25768 17450 1 20 . 1 1 18 18 PRO CB C 18 32.440 32.440 32.060 0.380 25768 17451 1 20 . 1 1 19 19 ASP N N 19 120.320 120.320 115.587 4.733 25768 17452 1 20 . 1 1 19 19 ASP C C 19 175.950 175.950 175.503 0.447 25768 17453 1 20 . 1 1 19 19 ASP CA C 19 54.710 54.710 53.448 1.262 25768 17454 1 20 . 1 1 19 19 ASP CB C 19 41.450 41.450 42.422 -0.972 25768 17455 1 20 . 1 1 19 19 ASP H H 19 8.330 8.330 7.598 0.732 25768 17456 1 20 . 1 1 20 20 ASP N N 20 121.990 121.990 119.408 2.582 25768 17457 1 20 . 1 1 20 20 ASP C C 20 176.760 176.760 176.454 0.306 25768 17458 1 20 . 1 1 20 20 ASP CA C 20 54.470 54.470 55.660 -1.190 25768 17459 1 20 . 1 1 20 20 ASP CB C 20 41.310 41.310 41.705 -0.395 25768 17460 1 20 . 1 1 20 20 ASP H H 20 8.240 8.240 8.560 -0.320 25768 17461 1 20 . 1 1 21 21 SER N N 21 117.050 117.050 113.768 3.282 25768 17462 1 20 . 1 1 21 21 SER C C 21 175.170 175.170 173.944 1.226 25768 17463 1 20 . 1 1 21 21 SER CA C 21 59.490 59.490 58.471 1.020 25768 17464 1 20 . 1 1 21 21 SER CB C 21 64.080 64.080 64.560 -0.480 25768 17465 1 20 . 1 1 21 21 SER H H 21 8.360 8.360 8.334 0.026 25768 17466 1 20 . 1 1 22 22 SER N N 22 117.820 117.820 114.664 3.156 25768 17467 1 20 . 1 1 22 22 SER C C 22 174.940 174.940 173.003 1.937 25768 17468 1 20 . 1 1 22 22 SER CA C 22 59.160 59.160 58.939 0.221 25768 17469 1 20 . 1 1 22 22 SER CB C 22 64.110 64.110 62.478 1.632 25768 17470 1 20 . 1 1 22 22 SER H H 22 8.310 8.310 8.540 -0.230 25768 17471 1 20 . 1 1 23 23 SER N N 23 117.660 117.660 115.629 2.031 25768 17472 1 20 . 1 1 23 23 SER C C 23 174.340 174.340 174.815 -0.475 25768 17473 1 20 . 1 1 23 23 SER CA C 23 59.050 59.050 58.431 0.619 25768 17474 1 20 . 1 1 23 23 SER CB C 23 64.210 64.210 63.926 0.284 25768 17475 1 20 . 1 1 23 23 SER H H 23 8.120 8.120 7.848 0.272 25768 17476 1 20 . 1 1 24 24 ASP N N 24 122.590 122.590 126.036 -3.446 25768 17477 1 20 . 1 1 24 24 ASP C C 24 176.250 176.250 175.098 1.152 25768 17478 1 20 . 1 1 24 24 ASP CA C 24 54.910 54.910 54.018 0.892 25768 17479 1 20 . 1 1 24 24 ASP CB C 24 41.270 41.270 40.572 0.698 25768 17480 1 20 . 1 1 24 24 ASP H H 24 8.230 8.230 8.616 -0.386 25768 17481 1 20 . 1 1 25 25 ILE N N 25 120.650 120.650 121.961 -1.311 25768 17482 1 20 . 1 1 25 25 ILE C C 25 176.190 176.190 174.849 1.341 25768 17483 1 20 . 1 1 25 25 ILE CA C 25 61.880 61.880 60.306 1.574 25768 17484 1 20 . 1 1 25 25 ILE CB C 25 38.730 38.730 40.094 -1.365 25768 17485 1 20 . 1 1 25 25 ILE H H 25 7.860 7.860 7.745 0.115 25768 17486 1 20 . 1 1 26 26 LYS N N 26 124.420 124.420 126.414 -1.994 25768 17487 1 20 . 1 1 26 26 LYS C C 26 176.640 176.640 174.844 1.796 25768 17488 1 20 . 1 1 26 26 LYS CA C 26 56.520 56.520 56.042 0.478 25768 17489 1 20 . 1 1 26 26 LYS CB C 26 32.890 32.890 33.336 -0.446 25768 17490 1 20 . 1 1 26 26 LYS H H 26 8.140 8.140 8.421 -0.281 25768 17491 1 20 . 1 1 27 27 LEU N N 27 123.120 123.120 123.134 -0.014 25768 17492 1 20 . 1 1 27 27 LEU C C 27 177.110 177.110 176.144 0.966 25768 17493 1 20 . 1 1 27 27 LEU CA C 27 55.590 55.590 54.245 1.345 25768 17494 1 20 . 1 1 27 27 LEU CB C 27 42.500 42.500 43.849 -1.349 25768 17495 1 20 . 1 1 27 27 LEU H H 27 8.080 8.080 8.308 -0.228 25768 17496 1 20 . 1 1 28 28 ASP N N 28 120.850 120.850 121.849 -0.999 25768 17497 1 20 . 1 1 28 28 ASP C C 28 176.960 176.960 176.690 0.270 25768 17498 1 20 . 1 1 28 28 ASP CA C 28 54.800 54.800 54.260 0.540 25768 17499 1 20 . 1 1 28 28 ASP CB C 28 41.380 41.380 41.878 -0.498 25768 17500 1 20 . 1 1 28 28 ASP H H 28 8.180 8.180 8.586 -0.406 25768 17501 1 20 . 1 1 29 29 GLY N N 29 109.800 109.800 110.043 -0.243 25768 17502 1 20 . 1 1 29 29 GLY C C 29 174.370 174.370 174.178 0.192 25768 17503 1 20 . 1 1 29 29 GLY CA C 29 46.150 46.150 45.050 1.101 25768 17504 1 20 . 1 1 29 29 GLY H H 29 8.230 8.230 8.502 -0.272 25768 17505 1 20 . 1 1 30 30 ALA N N 30 123.880 123.880 121.143 2.737 25768 17506 1 20 . 1 1 30 30 ALA C C 30 178.040 178.040 176.523 1.517 25768 17507 1 20 . 1 1 30 30 ALA CA C 30 53.140 53.140 51.889 1.251 25768 17508 1 20 . 1 1 30 30 ALA CB C 30 19.350 19.350 20.747 -1.397 25768 17509 1 20 . 1 1 30 30 ALA H H 30 8.040 8.040 8.046 -0.006 25768 17510 1 20 . 1 1 31 31 LYS N N 31 119.800 119.800 120.923 -1.123 25768 17511 1 20 . 1 1 31 31 LYS C C 31 176.770 176.770 175.095 1.675 25768 17512 1 20 . 1 1 31 31 LYS CA C 31 56.870 56.870 55.646 1.224 25768 17513 1 20 . 1 1 31 31 LYS CB C 31 32.980 32.980 35.037 -2.057 25768 17514 1 20 . 1 1 31 31 LYS H H 31 8.060 8.060 8.235 -0.175 25768 17515 1 20 . 1 1 32 32 GLN N N 32 120.930 120.930 121.139 -0.209 25768 17516 1 20 . 1 1 32 32 GLN C C 32 176.000 176.000 174.883 1.117 25768 17517 1 20 . 1 1 32 32 GLN CA C 32 56.280 56.280 55.708 0.572 25768 17518 1 20 . 1 1 32 32 GLN CB C 32 29.580 29.580 29.404 0.176 25768 17519 1 20 . 1 1 32 32 GLN H H 32 8.170 8.170 8.593 -0.423 25768 17520 1 20 . 1 1 33 33 ARG N N 33 122.370 122.370 119.822 2.548 25768 17521 1 20 . 1 1 33 33 ARG C C 33 176.820 176.820 175.663 1.157 25768 17522 1 20 . 1 1 33 33 ARG CA C 33 56.680 56.680 56.400 0.280 25768 17523 1 20 . 1 1 33 33 ARG CB C 33 31.040 31.040 30.228 0.812 25768 17524 1 20 . 1 1 33 33 ARG H H 33 8.270 8.270 8.552 -0.282 25768 17525 1 20 . 1 1 34 34 GLY N N 34 110.210 110.210 106.345 3.865 25768 17526 1 20 . 1 1 34 34 GLY C C 34 174.280 174.280 173.311 0.969 25768 17527 1 20 . 1 1 34 34 GLY CA C 34 45.770 45.770 44.832 0.938 25768 17528 1 20 . 1 1 34 34 GLY H H 34 8.360 8.360 8.388 -0.028 25768 17529 1 20 . 1 1 35 35 THR N N 35 114.100 114.100 114.163 -0.063 25768 17530 1 20 . 1 1 35 35 THR C C 35 174.550 174.550 174.778 -0.228 25768 17531 1 20 . 1 1 35 35 THR CA C 35 62.140 62.140 62.480 -0.340 25768 17532 1 20 . 1 1 35 35 THR CB C 35 70.330 70.330 69.265 1.065 25768 17533 1 20 . 1 1 35 35 THR H H 35 7.970 7.970 8.065 -0.095 25768 17534 1 20 . 1 1 36 36 LYS N N 36 123.850 123.850 123.458 0.392 25768 17535 1 20 . 1 1 36 36 LYS C C 36 176.040 176.040 175.769 0.271 25768 17536 1 20 . 1 1 36 36 LYS CA C 36 56.600 56.600 56.105 0.495 25768 17537 1 20 . 1 1 36 36 LYS CB C 36 33.280 33.280 32.943 0.337 25768 17538 1 20 . 1 1 36 36 LYS H H 36 8.230 8.230 8.651 -0.421 25768 17539 1 20 . 1 1 37 37 ALA N N 37 125.650 125.650 123.912 1.738 25768 17540 1 20 . 1 1 37 37 ALA C C 37 177.570 177.570 176.693 0.877 25768 17541 1 20 . 1 1 37 37 ALA CA C 37 52.860 52.860 51.736 1.124 25768 17542 1 20 . 1 1 37 37 ALA CB C 37 19.610 19.610 18.534 1.076 25768 17543 1 20 . 1 1 37 37 ALA H H 37 8.290 8.290 7.738 0.552 25768 17544 1 20 . 1 1 38 38 THR N N 38 113.350 113.350 111.383 1.967 25768 17545 1 20 . 1 1 38 38 THR C C 38 174.540 174.540 173.699 0.841 25768 17546 1 20 . 1 1 38 38 THR CA C 38 62.010 62.010 62.598 -0.588 25768 17547 1 20 . 1 1 38 38 THR CB C 38 70.350 70.350 68.760 1.591 25768 17548 1 20 . 1 1 38 38 THR H H 38 7.970 7.970 7.600 0.370 25768 17549 1 20 . 1 1 39 39 VAL N N 39 120.790 120.790 114.988 5.802 25768 17550 1 20 . 1 1 39 39 VAL C C 39 175.620 175.620 175.433 0.187 25768 17551 1 20 . 1 1 39 39 VAL CA C 39 62.470 62.470 62.544 -0.074 25768 17552 1 20 . 1 1 39 39 VAL CB C 39 32.940 32.940 32.358 0.582 25768 17553 1 20 . 1 1 39 39 VAL H H 39 8.020 8.020 8.113 -0.093 25768 17554 1 20 . 1 1 40 40 ASP N N 40 123.690 123.690 120.884 2.806 25768 17555 1 20 . 1 1 40 40 ASP C C 40 176.190 176.190 175.621 0.569 25768 17556 1 20 . 1 1 40 40 ASP CA C 40 54.780 54.780 55.103 -0.323 25768 17557 1 20 . 1 1 40 40 ASP CB C 40 41.590 41.590 40.830 0.760 25768 17558 1 20 . 1 1 40 40 ASP H H 40 8.310 8.310 8.289 0.021 25768 17559 1 20 . 1 1 41 41 SER N N 41 115.470 115.470 116.431 -0.961 25768 17560 1 20 . 1 1 41 41 SER C C 41 174.170 174.170 174.584 -0.414 25768 17561 1 20 . 1 1 41 41 SER CA C 41 59.000 59.000 60.312 -1.312 25768 17562 1 20 . 1 1 41 41 SER CB C 41 64.420 64.420 63.173 1.247 25768 17563 1 20 . 1 1 41 41 SER H H 41 8.130 8.130 8.472 -0.342 25768 17564 1 20 . 1 1 42 42 ASP N N 42 122.430 122.430 118.275 4.155 25768 17565 1 20 . 1 1 42 42 ASP C C 42 175.740 175.740 174.636 1.104 25768 17566 1 20 . 1 1 42 42 ASP CA C 42 54.780 54.780 55.350 -0.570 25768 17567 1 20 . 1 1 42 42 ASP CB C 42 41.620 41.620 40.369 1.251 25768 17568 1 20 . 1 1 42 42 ASP H H 42 8.410 8.410 8.385 0.025 25768 17569 1 20 . 1 1 43 43 THR N N 43 117.580 117.580 109.361 8.219 25768 17570 1 20 . 1 1 43 43 THR C C 43 173.630 173.630 173.688 -0.058 25768 17571 1 20 . 1 1 43 43 THR CA C 43 63.120 63.120 61.024 2.096 25768 17572 1 20 . 1 1 43 43 THR CB C 43 70.650 70.650 70.033 0.617 25768 17573 1 20 . 1 1 43 43 THR H H 43 8.010 8.010 7.681 0.329 25768 17574 1 20 . 1 1 44 44 GLN N N 44 125.420 125.420 123.729 1.691 25768 17575 1 20 . 1 1 44 44 GLN C C 44 174.080 174.080 174.375 -0.295 25768 17576 1 20 . 1 1 44 44 GLN CA C 44 55.110 55.110 54.260 0.850 25768 17577 1 20 . 1 1 44 44 GLN CB C 44 31.570 31.570 31.100 0.470 25768 17578 1 20 . 1 1 44 44 GLN H H 44 9.260 9.260 8.413 0.847 25768 17579 1 20 . 1 1 45 45 LEU N N 45 124.190 124.190 126.301 -2.111 25768 17580 1 20 . 1 1 45 45 LEU C C 45 175.970 175.970 176.599 -0.629 25768 17581 1 20 . 1 1 45 45 LEU CA C 45 54.690 54.690 54.299 0.391 25768 17582 1 20 . 1 1 45 45 LEU CB C 45 42.270 42.270 42.803 -0.533 25768 17583 1 20 . 1 1 45 45 LEU H H 45 8.550 8.550 8.359 0.191 25768 17584 1 20 . 1 1 46 46 GLY N N 46 113.310 113.310 113.884 -0.574 25768 17585 1 20 . 1 1 46 46 GLY C C 46 171.180 171.180 172.711 -1.531 25768 17586 1 20 . 1 1 46 46 GLY CA C 46 44.400 44.400 44.513 -0.113 25768 17587 1 20 . 1 1 46 46 GLY H H 46 8.810 8.810 8.388 0.422 25768 17588 1 20 . 1 1 47 47 LEU N N 47 123.890 123.890 125.883 -1.993 25768 17589 1 20 . 1 1 47 47 LEU C C 47 175.400 175.400 174.925 0.475 25768 17590 1 20 . 1 1 47 47 LEU CA C 47 53.750 53.750 53.812 -0.062 25768 17591 1 20 . 1 1 47 47 LEU CB C 47 46.800 46.800 45.949 0.851 25768 17592 1 20 . 1 1 47 47 LEU H H 47 8.590 8.590 8.764 -0.174 25768 17593 1 20 . 1 1 48 48 THR N N 48 111.210 111.210 119.575 -8.365 25768 17594 1 20 . 1 1 48 48 THR C C 48 172.520 172.520 172.997 -0.477 25768 17595 1 20 . 1 1 48 48 THR CA C 48 58.950 58.950 61.181 -2.231 25768 17596 1 20 . 1 1 48 48 THR CB C 48 72.360 72.360 71.866 0.494 25768 17597 1 20 . 1 1 48 48 THR H H 48 8.620 8.620 7.821 0.799 25768 17598 1 20 . 1 1 49 49 PHE N N 49 118.810 118.810 125.474 -6.664 25768 17599 1 20 . 1 1 49 49 PHE C C 49 174.700 174.700 175.814 -1.114 25768 17600 1 20 . 1 1 49 49 PHE CA C 49 55.080 55.080 56.674 -1.594 25768 17601 1 20 . 1 1 49 49 PHE CB C 49 42.360 42.360 41.140 1.220 25768 17602 1 20 . 1 1 49 49 PHE H H 49 8.410 8.410 8.315 0.095 25768 17603 1 20 . 1 1 50 50 THR N N 50 121.230 121.230 120.602 0.628 25768 17604 1 20 . 1 1 50 50 THR C C 50 173.250 173.250 173.893 -0.643 25768 17605 1 20 . 1 1 50 50 THR CA C 50 62.740 62.740 61.443 1.297 25768 17606 1 20 . 1 1 50 50 THR CB C 50 73.740 73.740 70.786 2.954 25768 17607 1 20 . 1 1 50 50 THR H H 50 9.330 9.330 9.181 0.149 25768 17608 1 20 . 1 1 51 51 TYR N N 51 126.010 126.010 127.561 -1.551 25768 17609 1 20 . 1 1 51 51 TYR C C 51 174.850 174.850 174.348 0.502 25768 17610 1 20 . 1 1 51 51 TYR CA C 51 56.240 56.240 56.771 -0.531 25768 17611 1 20 . 1 1 51 51 TYR CB C 51 41.630 41.630 40.664 0.966 25768 17612 1 20 . 1 1 51 51 TYR H H 51 9.150 9.150 8.697 0.453 25768 17613 1 20 . 1 1 52 52 MET N N 52 127.390 127.390 126.938 0.452 25768 17614 1 20 . 1 1 52 52 MET C C 52 174.490 174.490 174.252 0.238 25768 17615 1 20 . 1 1 52 52 MET CA C 52 52.450 52.450 56.460 -4.010 25768 17616 1 20 . 1 1 52 52 MET CB C 52 28.590 28.590 33.483 -4.893 25768 17617 1 20 . 1 1 52 52 MET H H 52 7.950 7.950 8.969 -1.019 25768 17618 1 20 . 1 1 53 53 PHE N N 53 123.830 123.830 127.563 -3.733 25768 17619 1 20 . 1 1 53 53 PHE C C 53 173.720 173.720 173.566 0.154 25768 17620 1 20 . 1 1 53 53 PHE CA C 53 57.110 57.110 56.359 0.750 25768 17621 1 20 . 1 1 53 53 PHE CB C 53 39.420 39.420 41.185 -1.765 25768 17622 1 20 . 1 1 53 53 PHE H H 53 7.720 7.720 8.229 -0.509 25768 17623 1 20 . 1 1 54 54 ALA N N 54 125.650 125.650 129.181 -3.531 25768 17624 1 20 . 1 1 54 54 ALA C C 54 175.020 175.020 176.074 -1.054 25768 17625 1 20 . 1 1 54 54 ALA CA C 54 50.740 50.740 52.955 -2.215 25768 17626 1 20 . 1 1 54 54 ALA CB C 54 22.700 22.700 18.616 4.084 25768 17627 1 20 . 1 1 54 54 ALA H H 54 8.360 8.360 8.087 0.273 25768 17628 1 20 . 1 1 55 55 ASP N N 55 118.790 118.790 120.780 -1.990 25768 17629 1 20 . 1 1 55 55 ASP C C 55 174.780 174.780 175.861 -1.081 25768 17630 1 20 . 1 1 55 55 ASP CA C 55 58.590 58.590 54.648 3.942 25768 17631 1 20 . 1 1 55 55 ASP CB C 55 40.430 40.430 40.364 0.066 25768 17632 1 20 . 1 1 55 55 ASP H H 55 8.590 8.590 8.559 0.031 25768 17633 1 20 . 1 1 56 56 LYS N N 56 106.200 106.200 117.624 -11.424 25768 17634 1 20 . 1 1 56 56 LYS C C 56 174.940 174.940 175.290 -0.350 25768 17635 1 20 . 1 1 56 56 LYS CA C 56 55.260 55.260 56.698 -1.438 25768 17636 1 20 . 1 1 56 56 LYS CB C 56 34.510 34.510 35.155 -0.645 25768 17637 1 20 . 1 1 56 56 LYS H H 56 7.260 7.260 7.296 -0.036 25768 17638 1 20 . 1 1 57 57 TRP N N 57 115.680 115.680 121.306 -5.626 25768 17639 1 20 . 1 1 57 57 TRP C C 57 173.940 173.940 175.635 -1.695 25768 17640 1 20 . 1 1 57 57 TRP CA C 57 55.410 55.410 56.751 -1.341 25768 17641 1 20 . 1 1 57 57 TRP CB C 57 34.470 34.470 31.186 3.284 25768 17642 1 20 . 1 1 57 57 TRP H H 57 6.570 6.570 8.083 -1.513 25768 17643 1 20 . 1 1 58 58 GLY N N 58 107.610 107.610 108.124 -0.514 25768 17644 1 20 . 1 1 58 58 GLY C C 58 172.730 172.730 171.975 0.755 25768 17645 1 20 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.584 -0.534 25768 17646 1 20 . 1 1 58 58 GLY H H 58 9.260 9.260 8.378 0.882 25768 17647 1 20 . 1 1 59 59 VAL N N 59 118.130 118.130 122.893 -4.763 25768 17648 1 20 . 1 1 59 59 VAL C C 59 173.000 173.000 174.112 -1.112 25768 17649 1 20 . 1 1 59 59 VAL CA C 59 59.950 59.950 61.700 -1.750 25768 17650 1 20 . 1 1 59 59 VAL CB C 59 35.170 35.170 34.863 0.307 25768 17651 1 20 . 1 1 59 59 VAL H H 59 9.030 9.030 8.279 0.751 25768 17652 1 20 . 1 1 60 60 GLU N N 60 127.900 127.900 126.728 1.172 25768 17653 1 20 . 1 1 60 60 GLU C C 60 174.470 174.470 174.582 -0.112 25768 17654 1 20 . 1 1 60 60 GLU CA C 60 52.940 52.940 54.838 -1.898 25768 17655 1 20 . 1 1 60 60 GLU CB C 60 35.100 35.100 33.161 1.939 25768 17656 1 20 . 1 1 60 60 GLU H H 60 9.440 9.440 8.572 0.868 25768 17657 1 20 . 1 1 61 61 LEU N N 61 127.410 127.410 125.631 1.779 25768 17658 1 20 . 1 1 61 61 LEU C C 61 174.950 174.950 175.836 -0.886 25768 17659 1 20 . 1 1 61 61 LEU CA C 61 53.390 53.390 53.434 -0.044 25768 17660 1 20 . 1 1 61 61 LEU CB C 61 45.980 45.980 44.665 1.315 25768 17661 1 20 . 1 1 61 61 LEU H H 61 8.740 8.740 8.499 0.241 25768 17662 1 20 . 1 1 62 62 VAL N N 62 125.750 125.750 120.344 5.406 25768 17663 1 20 . 1 1 62 62 VAL C C 62 173.960 173.960 174.306 -0.346 25768 17664 1 20 . 1 1 62 62 VAL CA C 62 61.350 61.350 61.158 0.192 25768 17665 1 20 . 1 1 62 62 VAL CB C 62 34.740 34.740 33.885 0.855 25768 17666 1 20 . 1 1 62 62 VAL H H 62 8.790 8.790 7.855 0.935 25768 17667 1 20 . 1 1 63 63 ALA N N 63 127.230 127.230 128.779 -1.549 25768 17668 1 20 . 1 1 63 63 ALA C C 63 173.930 173.930 175.015 -1.085 25768 17669 1 20 . 1 1 63 63 ALA CA C 63 51.140 51.140 51.371 -0.231 25768 17670 1 20 . 1 1 63 63 ALA CB C 63 22.500 22.500 22.297 0.203 25768 17671 1 20 . 1 1 63 63 ALA H H 63 8.740 8.740 8.711 0.029 25768 17672 1 20 . 1 1 64 64 ALA N N 64 120.410 120.410 124.848 -4.438 25768 17673 1 20 . 1 1 64 64 ALA C C 64 176.770 176.770 176.705 0.065 25768 17674 1 20 . 1 1 64 64 ALA CA C 64 51.420 51.420 50.435 0.985 25768 17675 1 20 . 1 1 64 64 ALA CB C 64 22.590 22.590 22.082 0.508 25768 17676 1 20 . 1 1 64 64 ALA H H 64 8.290 8.290 8.209 0.081 25768 17677 1 20 . 1 1 65 65 THR N N 65 116.130 116.130 112.159 3.971 25768 17678 1 20 . 1 1 65 65 THR C C 65 171.220 171.220 172.837 -1.617 25768 17679 1 20 . 1 1 65 65 THR CA C 65 58.860 58.860 58.836 0.024 25768 17680 1 20 . 1 1 65 65 THR CB C 65 72.020 72.020 68.129 3.891 25768 17681 1 20 . 1 1 65 65 THR H H 65 8.760 8.760 8.417 0.343 25768 17682 1 20 . 1 1 66 66 PRO C C 66 176.720 176.720 176.512 0.208 25768 17683 1 20 . 1 1 66 66 PRO CA C 66 63.610 63.610 62.691 0.919 25768 17684 1 20 . 1 1 66 66 PRO CB C 66 32.550 32.550 32.517 0.033 25768 17685 1 20 . 1 1 67 67 PHE N N 67 120.360 120.360 120.239 0.121 25768 17686 1 20 . 1 1 67 67 PHE C C 67 175.480 175.480 175.430 0.050 25768 17687 1 20 . 1 1 67 67 PHE CA C 67 58.840 58.840 57.904 0.936 25768 17688 1 20 . 1 1 67 67 PHE CB C 67 40.170 40.170 41.252 -1.081 25768 17689 1 20 . 1 1 67 67 PHE H H 67 8.590 8.590 8.476 0.114 25768 17690 1 20 . 1 1 68 68 ASN N N 68 119.030 119.030 120.342 -1.312 25768 17691 1 20 . 1 1 68 68 ASN C C 68 174.740 174.740 174.327 0.413 25768 17692 1 20 . 1 1 68 68 ASN CA C 68 53.430 53.430 52.977 0.453 25768 17693 1 20 . 1 1 68 68 ASN CB C 68 39.420 39.420 39.566 -0.145 25768 17694 1 20 . 1 1 68 68 ASN H H 68 8.340 8.340 8.437 -0.097 25768 17695 1 20 . 1 1 69 69 HIS N N 69 119.590 119.590 119.329 0.261 25768 17696 1 20 . 1 1 69 69 HIS C C 69 174.370 174.370 174.214 0.156 25768 17697 1 20 . 1 1 69 69 HIS CA C 69 55.950 55.950 56.054 -0.104 25768 17698 1 20 . 1 1 69 69 HIS CB C 69 29.960 29.960 30.142 -0.182 25768 17699 1 20 . 1 1 69 69 HIS H H 69 8.350 8.350 8.117 0.233 25768 17700 1 20 . 1 1 70 70 GLN N N 70 121.980 121.980 124.001 -2.021 25768 17701 1 20 . 1 1 70 70 GLN C C 70 175.740 175.740 175.775 -0.035 25768 17702 1 20 . 1 1 70 70 GLN CA C 70 56.340 56.340 56.687 -0.347 25768 17703 1 20 . 1 1 70 70 GLN CB C 70 29.660 29.660 29.904 -0.244 25768 17704 1 20 . 1 1 70 70 GLN H H 70 8.350 8.350 8.338 0.012 25768 17705 1 20 . 1 1 71 71 VAL N N 71 120.530 120.530 118.622 1.908 25768 17706 1 20 . 1 1 71 71 VAL C C 71 175.500 175.500 175.101 0.399 25768 17707 1 20 . 1 1 71 71 VAL CA C 71 62.540 62.540 62.538 0.002 25768 17708 1 20 . 1 1 71 71 VAL CB C 71 33.090 33.090 32.385 0.705 25768 17709 1 20 . 1 1 71 71 VAL H H 71 8.020 8.020 8.335 -0.315 25768 17710 1 20 . 1 1 72 72 ASP N N 72 123.910 123.910 121.908 2.002 25768 17711 1 20 . 1 1 72 72 ASP C C 72 176.300 176.300 175.860 0.440 25768 17712 1 20 . 1 1 72 72 ASP CA C 72 54.340 54.340 54.053 0.287 25768 17713 1 20 . 1 1 72 72 ASP CB C 72 41.480 41.480 41.967 -0.487 25768 17714 1 20 . 1 1 72 72 ASP H H 72 8.280 8.280 8.206 0.074 25768 17715 1 20 . 1 1 73 73 VAL N N 73 120.580 120.580 120.255 0.325 25768 17716 1 20 . 1 1 73 73 VAL C C 73 176.350 176.350 174.714 1.636 25768 17717 1 20 . 1 1 73 73 VAL CA C 73 62.970 62.970 62.482 0.488 25768 17718 1 20 . 1 1 73 73 VAL CB C 73 32.550 32.550 32.377 0.173 25768 17719 1 20 . 1 1 73 73 VAL H H 73 7.960 7.960 8.305 -0.345 25768 17720 1 20 . 1 1 74 74 LYS N N 74 123.620 123.620 126.215 -2.595 25768 17721 1 20 . 1 1 74 74 LYS C C 74 177.130 177.130 175.863 1.267 25768 17722 1 20 . 1 1 74 74 LYS CA C 74 57.060 57.060 56.312 0.748 25768 17723 1 20 . 1 1 74 74 LYS CB C 74 32.860 32.860 34.373 -1.513 25768 17724 1 20 . 1 1 74 74 LYS H H 74 8.230 8.230 8.222 0.008 25768 17725 1 20 . 1 1 75 75 GLY N N 75 109.370 109.370 112.355 -2.985 25768 17726 1 20 . 1 1 75 75 GLY C C 75 174.030 174.030 174.190 -0.160 25768 17727 1 20 . 1 1 75 75 GLY CA C 75 45.800 45.800 45.130 0.670 25768 17728 1 20 . 1 1 75 75 GLY H H 75 8.160 8.160 8.384 -0.224 25768 17729 1 20 . 1 1 76 76 LEU N N 76 121.660 121.660 121.394 0.266 25768 17730 1 20 . 1 1 76 76 LEU C C 76 177.410 177.410 177.089 0.321 25768 17731 1 20 . 1 1 76 76 LEU CA C 76 55.410 55.410 55.743 -0.333 25768 17732 1 20 . 1 1 76 76 LEU CB C 76 42.790 42.790 42.476 0.314 25768 17733 1 20 . 1 1 76 76 LEU H H 76 8.030 8.030 7.824 0.206 25768 17734 1 20 . 1 1 77 77 GLY N N 77 109.330 109.330 107.202 2.128 25768 17735 1 20 . 1 1 77 77 GLY C C 77 171.800 171.800 173.213 -1.413 25768 17736 1 20 . 1 1 77 77 GLY CA C 77 44.990 44.990 44.367 0.623 25768 17737 1 20 . 1 1 77 77 GLY H H 77 8.100 8.100 7.928 0.172 25768 17738 1 20 . 1 1 78 78 PRO C C 78 177.740 177.740 177.299 0.441 25768 17739 1 20 . 1 1 78 78 PRO CA C 78 63.890 63.890 63.878 0.012 25768 17740 1 20 . 1 1 78 78 PRO CB C 78 32.170 32.170 32.202 -0.032 25768 17741 1 20 . 1 1 79 79 GLY N N 79 109.530 109.530 104.399 5.131 25768 17742 1 20 . 1 1 79 79 GLY C C 79 174.460 174.460 172.472 1.988 25768 17743 1 20 . 1 1 79 79 GLY CA C 79 45.780 45.780 44.703 1.077 25768 17744 1 20 . 1 1 79 79 GLY H H 79 8.410 8.410 7.684 0.726 25768 17745 1 20 . 1 1 80 80 LEU N N 80 121.880 121.880 121.548 0.332 25768 17746 1 20 . 1 1 80 80 LEU C C 80 177.100 177.100 176.525 0.575 25768 17747 1 20 . 1 1 80 80 LEU CA C 80 55.720 55.720 54.906 0.814 25768 17748 1 20 . 1 1 80 80 LEU CB C 80 42.580 42.580 42.507 0.073 25768 17749 1 20 . 1 1 80 80 LEU H H 80 8.010 8.010 8.250 -0.240 25768 17750 1 20 . 1 1 81 81 ASP N N 81 119.990 119.990 122.931 -2.941 25768 17751 1 20 . 1 1 81 81 ASP C C 81 176.880 176.880 176.287 0.593 25768 17752 1 20 . 1 1 81 81 ASP CA C 81 54.770 54.770 53.597 1.173 25768 17753 1 20 . 1 1 81 81 ASP CB C 81 41.390 41.390 43.588 -2.198 25768 17754 1 20 . 1 1 81 81 ASP H H 81 8.220 8.220 8.710 -0.490 25768 17755 1 20 . 1 1 82 82 GLY N N 82 109.270 109.270 108.883 0.387 25768 17756 1 20 . 1 1 82 82 GLY C C 82 174.190 174.190 174.387 -0.197 25768 17757 1 20 . 1 1 82 82 GLY CA C 82 45.990 45.990 45.270 0.720 25768 17758 1 20 . 1 1 82 82 GLY H H 82 8.170 8.170 8.240 -0.070 25768 17759 1 20 . 1 1 83 83 LYS N N 83 121.000 121.000 120.173 0.827 25768 17760 1 20 . 1 1 83 83 LYS C C 83 176.610 176.610 177.530 -0.920 25768 17761 1 20 . 1 1 83 83 LYS CA C 83 56.620 56.620 57.895 -1.275 25768 17762 1 20 . 1 1 83 83 LYS CB C 83 33.020 33.020 32.816 0.204 25768 17763 1 20 . 1 1 83 83 LYS H H 83 7.970 7.970 7.972 -0.002 25768 17764 1 20 . 1 1 84 84 LEU N N 84 123.120 123.120 118.760 4.360 25768 17765 1 20 . 1 1 84 84 LEU C C 84 176.920 176.920 176.057 0.863 25768 17766 1 20 . 1 1 84 84 LEU CA C 84 55.550 55.550 55.294 0.256 25768 17767 1 20 . 1 1 84 84 LEU CB C 84 42.430 42.430 42.753 -0.323 25768 17768 1 20 . 1 1 84 84 LEU H H 84 8.130 8.130 8.150 -0.020 25768 17769 1 20 . 1 1 85 85 ALA N N 85 123.930 123.930 121.368 2.562 25768 17770 1 20 . 1 1 85 85 ALA C C 85 177.060 177.060 177.279 -0.219 25768 17771 1 20 . 1 1 85 85 ALA CA C 85 52.790 52.790 52.435 0.355 25768 17772 1 20 . 1 1 85 85 ALA CB C 85 19.670 19.670 18.453 1.217 25768 17773 1 20 . 1 1 85 85 ALA H H 85 8.040 8.040 7.713 0.327 25768 17774 1 20 . 1 1 86 86 ASP N N 86 119.760 119.760 119.054 0.706 25768 17775 1 20 . 1 1 86 86 ASP C C 86 175.820 175.820 175.999 -0.179 25768 17776 1 20 . 1 1 86 86 ASP CA C 86 54.520 54.520 54.499 0.021 25768 17777 1 20 . 1 1 86 86 ASP CB C 86 41.390 41.390 41.719 -0.330 25768 17778 1 20 . 1 1 86 86 ASP H H 86 8.110 8.110 8.967 -0.857 25768 17779 1 20 . 1 1 87 87 ILE N N 87 120.620 120.620 118.018 2.602 25768 17780 1 20 . 1 1 87 87 ILE C C 87 175.740 175.740 174.364 1.376 25768 17781 1 20 . 1 1 87 87 ILE CA C 87 61.160 61.160 61.931 -0.771 25768 17782 1 20 . 1 1 87 87 ILE CB C 87 39.260 39.260 39.000 0.260 25768 17783 1 20 . 1 1 87 87 ILE H H 87 7.800 7.800 8.138 -0.338 25768 17784 1 20 . 1 1 88 88 LYS N N 88 125.820 125.820 126.533 -0.713 25768 17785 1 20 . 1 1 88 88 LYS C C 88 175.340 175.340 176.223 -0.883 25768 17786 1 20 . 1 1 88 88 LYS CA C 88 56.300 56.300 56.607 -0.307 25768 17787 1 20 . 1 1 88 88 LYS CB C 88 32.900 32.900 32.980 -0.080 25768 17788 1 20 . 1 1 88 88 LYS H H 88 8.250 8.250 8.640 -0.390 25768 17789 1 20 . 1 1 89 89 GLN N N 89 121.750 121.750 120.325 1.425 25768 17790 1 20 . 1 1 89 89 GLN C C 89 175.000 175.000 174.987 0.013 25768 17791 1 20 . 1 1 89 89 GLN CA C 89 55.210 55.210 55.141 0.069 25768 17792 1 20 . 1 1 89 89 GLN CB C 89 30.570 30.570 28.464 2.106 25768 17793 1 20 . 1 1 89 89 GLN H H 89 8.000 8.000 8.154 -0.154 25768 17794 1 20 . 1 1 90 90 LEU N N 90 126.660 126.660 127.641 -0.981 25768 17795 1 20 . 1 1 90 90 LEU C C 90 174.240 174.240 175.576 -1.336 25768 17796 1 20 . 1 1 90 90 LEU CA C 90 52.720 52.720 53.855 -1.135 25768 17797 1 20 . 1 1 90 90 LEU CB C 90 42.350 42.350 42.526 -0.176 25768 17798 1 20 . 1 1 90 90 LEU H H 90 8.630 8.630 8.270 0.360 25768 17799 1 20 . 1 1 92 92 PRO C C 92 173.900 173.900 176.868 -2.968 25768 17800 1 20 . 1 1 92 92 PRO CA C 92 63.320 63.320 62.416 0.904 25768 17801 1 20 . 1 1 92 92 PRO CB C 92 31.920 31.920 32.617 -0.697 25768 17802 1 20 . 1 1 93 93 THR N N 93 119.770 119.770 119.131 0.639 25768 17803 1 20 . 1 1 93 93 THR C C 93 171.360 171.360 174.033 -2.673 25768 17804 1 20 . 1 1 93 93 THR CA C 93 62.610 62.610 63.217 -0.607 25768 17805 1 20 . 1 1 93 93 THR CB C 93 72.680 72.680 69.382 3.298 25768 17806 1 20 . 1 1 93 93 THR H H 93 8.290 8.290 8.497 -0.207 25768 17807 1 20 . 1 1 94 94 LEU N N 94 128.880 128.880 127.541 1.339 25768 17808 1 20 . 1 1 94 94 LEU C C 94 175.130 175.130 175.241 -0.111 25768 17809 1 20 . 1 1 94 94 LEU CA C 94 53.520 53.520 54.830 -1.310 25768 17810 1 20 . 1 1 94 94 LEU CB C 94 46.140 46.140 42.876 3.264 25768 17811 1 20 . 1 1 94 94 LEU H H 94 8.680 8.680 8.806 -0.126 25768 17812 1 20 . 1 1 95 95 LEU N N 95 123.630 123.630 123.046 0.584 25768 17813 1 20 . 1 1 95 95 LEU C C 95 175.540 175.540 174.899 0.641 25768 17814 1 20 . 1 1 95 95 LEU CA C 95 55.190 55.190 53.762 1.428 25768 17815 1 20 . 1 1 95 95 LEU CB C 95 45.300 45.300 46.641 -1.341 25768 17816 1 20 . 1 1 95 95 LEU H H 95 9.580 9.580 8.134 1.446 25768 17817 1 20 . 1 1 96 96 LEU N N 96 123.150 123.150 123.960 -0.810 25768 17818 1 20 . 1 1 96 96 LEU C C 96 174.960 174.960 175.642 -0.682 25768 17819 1 20 . 1 1 96 96 LEU CA C 96 54.420 54.420 53.757 0.663 25768 17820 1 20 . 1 1 96 96 LEU CB C 96 44.560 44.560 43.495 1.065 25768 17821 1 20 . 1 1 96 96 LEU H H 96 8.770 8.770 9.280 -0.510 25768 17822 1 20 . 1 1 97 97 GLN N N 97 121.290 121.290 123.054 -1.764 25768 17823 1 20 . 1 1 97 97 GLN C C 97 174.380 174.380 175.004 -0.624 25768 17824 1 20 . 1 1 97 97 GLN CA C 97 54.740 54.740 54.662 0.078 25768 17825 1 20 . 1 1 97 97 GLN CB C 97 36.600 36.600 31.160 5.439 25768 17826 1 20 . 1 1 97 97 GLN H H 97 9.480 9.480 9.035 0.445 25768 17827 1 20 . 1 1 98 98 TYR N N 98 122.250 122.250 123.138 -0.888 25768 17828 1 20 . 1 1 98 98 TYR C C 98 173.460 173.460 175.506 -2.046 25768 17829 1 20 . 1 1 98 98 TYR CA C 98 55.160 55.160 55.928 -0.768 25768 17830 1 20 . 1 1 98 98 TYR CB C 98 42.420 42.420 42.353 0.067 25768 17831 1 20 . 1 1 98 98 TYR H H 98 9.010 9.010 9.345 -0.335 25768 17832 1 20 . 1 1 99 99 TYR N N 99 126.860 126.860 121.371 5.489 25768 17833 1 20 . 1 1 99 99 TYR C C 99 175.380 175.380 174.974 0.406 25768 17834 1 20 . 1 1 99 99 TYR CA C 99 54.220 54.220 55.816 -1.596 25768 17835 1 20 . 1 1 99 99 TYR CB C 99 38.890 38.890 38.009 0.881 25768 17836 1 20 . 1 1 99 99 TYR H H 99 8.300 8.300 8.507 -0.207 25768 17837 1 20 . 1 1 100 100 PRO C C 100 178.330 178.330 177.030 1.300 25768 17838 1 20 . 1 1 100 100 PRO CA C 100 64.750 64.750 65.394 -0.644 25768 17839 1 20 . 1 1 100 100 PRO CB C 100 32.130 32.130 31.940 0.190 25768 17840 1 20 . 1 1 101 101 MET N N 101 114.520 114.520 116.697 -2.177 25768 17841 1 20 . 1 1 101 101 MET C C 101 178.240 178.240 175.647 2.593 25768 17842 1 20 . 1 1 101 101 MET CA C 101 53.500 53.500 54.427 -0.927 25768 17843 1 20 . 1 1 101 101 MET CB C 101 30.160 30.160 32.301 -2.141 25768 17844 1 20 . 1 1 101 101 MET H H 101 9.390 9.390 8.031 1.359 25768 17845 1 20 . 1 1 102 102 GLY N N 102 117.500 117.500 109.124 8.376 25768 17846 1 20 . 1 1 102 102 GLY C C 102 175.690 175.690 174.385 1.305 25768 17847 1 20 . 1 1 102 102 GLY CA C 102 46.760 46.760 46.201 0.559 25768 17848 1 20 . 1 1 102 102 GLY H H 102 8.640 8.640 7.782 0.858 25768 17849 1 20 . 1 1 103 103 GLY N N 103 111.030 111.030 111.967 -0.937 25768 17850 1 20 . 1 1 103 103 GLY C C 103 174.070 174.070 173.834 0.236 25768 17851 1 20 . 1 1 103 103 GLY CA C 103 46.140 46.140 44.889 1.252 25768 17852 1 20 . 1 1 103 103 GLY H H 103 9.390 9.390 7.872 1.518 25768 17853 1 20 . 1 1 104 104 THR N N 104 109.290 109.290 112.981 -3.691 25768 17854 1 20 . 1 1 104 104 THR C C 104 174.290 174.290 174.078 0.212 25768 17855 1 20 . 1 1 104 104 THR CA C 104 60.900 60.900 59.948 0.952 25768 17856 1 20 . 1 1 104 104 THR CB C 104 72.070 72.070 70.283 1.787 25768 17857 1 20 . 1 1 104 104 THR H H 104 7.290 7.290 7.500 -0.210 25768 17858 1 20 . 1 1 105 105 ASN C C 105 175.050 175.050 174.540 0.510 25768 17859 1 20 . 1 1 105 105 ASN CA C 105 52.880 52.880 52.777 0.103 25768 17860 1 20 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.211 0.049 25768 17861 1 20 . 1 1 106 106 SER N N 106 113.000 113.000 117.264 -4.264 25768 17862 1 20 . 1 1 106 106 SER C C 106 176.000 176.000 174.145 1.855 25768 17863 1 20 . 1 1 106 106 SER CA C 106 58.700 58.700 57.874 0.826 25768 17864 1 20 . 1 1 106 106 SER CB C 106 64.540 64.540 64.073 0.467 25768 17865 1 20 . 1 1 106 106 SER H H 106 7.450 7.450 7.447 0.003 25768 17866 1 20 . 1 1 107 107 ALA N N 107 132.220 132.220 128.185 4.035 25768 17867 1 20 . 1 1 107 107 ALA C C 107 176.610 176.610 177.636 -1.026 25768 17868 1 20 . 1 1 107 107 ALA CA C 107 54.380 54.380 53.429 0.951 25768 17869 1 20 . 1 1 107 107 ALA CB C 107 18.690 18.690 19.122 -0.432 25768 17870 1 20 . 1 1 107 107 ALA H H 107 8.870 8.870 8.229 0.641 25768 17871 1 20 . 1 1 108 108 PHE N N 108 116.050 116.050 116.121 -0.071 25768 17872 1 20 . 1 1 108 108 PHE C C 108 174.270 174.270 175.708 -1.438 25768 17873 1 20 . 1 1 108 108 PHE CA C 108 56.140 56.140 55.913 0.227 25768 17874 1 20 . 1 1 108 108 PHE CB C 108 40.520 40.520 39.435 1.085 25768 17875 1 20 . 1 1 108 108 PHE H H 108 7.550 7.550 7.218 0.332 25768 17876 1 20 . 1 1 109 109 GLN N N 109 128.260 128.260 122.599 5.661 25768 17877 1 20 . 1 1 109 109 GLN C C 109 172.300 172.300 174.294 -1.994 25768 17878 1 20 . 1 1 109 109 GLN CA C 109 52.310 52.310 53.318 -1.008 25768 17879 1 20 . 1 1 109 109 GLN CB C 109 29.050 29.050 29.580 -0.530 25768 17880 1 20 . 1 1 109 109 GLN H H 109 9.060 9.060 8.837 0.223 25768 17881 1 20 . 1 1 110 110 PRO C C 110 175.020 175.020 176.128 -1.108 25768 17882 1 20 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.624 -1.074 25768 17883 1 20 . 1 1 110 110 PRO CB C 110 33.280 33.280 32.937 0.343 25768 17884 1 20 . 1 1 111 111 TYR N N 111 115.730 115.730 113.376 2.354 25768 17885 1 20 . 1 1 111 111 TYR C C 111 173.850 173.850 174.589 -0.739 25768 17886 1 20 . 1 1 111 111 TYR CA C 111 56.470 56.470 56.179 0.291 25768 17887 1 20 . 1 1 111 111 TYR CB C 111 38.650 38.650 39.257 -0.607 25768 17888 1 20 . 1 1 111 111 TYR H H 111 8.500 8.500 7.603 0.897 25768 17889 1 20 . 1 1 112 112 GLY N N 112 103.570 103.570 110.129 -6.559 25768 17890 1 20 . 1 1 112 112 GLY C C 112 172.020 172.020 173.417 -1.397 25768 17891 1 20 . 1 1 112 112 GLY CA C 112 43.950 43.950 44.740 -0.790 25768 17892 1 20 . 1 1 112 112 GLY H H 112 8.110 8.110 8.932 -0.822 25768 17893 1 20 . 1 1 113 113 GLY N N 113 108.510 108.510 111.980 -3.470 25768 17894 1 20 . 1 1 113 113 GLY C C 113 171.540 171.540 172.029 -0.489 25768 17895 1 20 . 1 1 113 113 GLY CA C 113 46.120 46.120 43.848 2.272 25768 17896 1 20 . 1 1 113 113 GLY H H 113 9.080 9.080 9.136 -0.056 25768 17897 1 20 . 1 1 114 114 LEU N N 114 120.270 120.270 127.105 -6.835 25768 17898 1 20 . 1 1 114 114 LEU C C 114 175.810 175.810 175.738 0.072 25768 17899 1 20 . 1 1 114 114 LEU CA C 114 53.920 53.920 53.289 0.631 25768 17900 1 20 . 1 1 114 114 LEU CB C 114 47.940 47.940 46.378 1.562 25768 17901 1 20 . 1 1 114 114 LEU H H 114 8.620 8.620 8.855 -0.235 25768 17902 1 20 . 1 1 115 115 GLY N N 115 110.620 110.620 113.403 -2.783 25768 17903 1 20 . 1 1 115 115 GLY C C 115 171.560 171.560 173.028 -1.468 25768 17904 1 20 . 1 1 115 115 GLY CA C 115 46.940 46.940 44.394 2.546 25768 17905 1 20 . 1 1 115 115 GLY H H 115 9.000 9.000 8.288 0.712 25768 17906 1 20 . 1 1 116 116 VAL N N 116 113.600 113.600 116.255 -2.655 25768 17907 1 20 . 1 1 116 116 VAL C C 116 174.120 174.120 174.144 -0.024 25768 17908 1 20 . 1 1 116 116 VAL CA C 116 58.970 58.970 59.280 -0.310 25768 17909 1 20 . 1 1 116 116 VAL CB C 116 36.600 36.600 34.685 1.915 25768 17910 1 20 . 1 1 116 116 VAL H H 116 8.680 8.680 7.837 0.843 25768 17911 1 20 . 1 1 117 117 ASN N N 117 120.020 120.020 120.827 -0.807 25768 17912 1 20 . 1 1 117 117 ASN CA C 117 52.190 52.190 53.690 -1.500 25768 17913 1 20 . 1 1 117 117 ASN CB C 117 42.450 42.450 41.339 1.111 25768 17914 1 20 . 1 1 117 117 ASN H H 117 8.840 8.840 8.895 -0.055 25768 17915 1 20 . 1 1 119 119 THR C C 119 174.350 174.350 174.074 0.276 25768 17916 1 20 . 1 1 119 119 THR CA C 119 63.140 63.140 63.023 0.117 25768 17917 1 20 . 1 1 119 119 THR CB C 119 70.170 70.170 68.813 1.357 25768 17918 1 20 . 1 1 120 120 THR N N 120 114.120 114.120 117.928 -3.808 25768 17919 1 20 . 1 1 120 120 THR C C 120 174.220 174.220 173.486 0.734 25768 17920 1 20 . 1 1 120 120 THR CA C 120 61.900 61.900 62.328 -0.428 25768 17921 1 20 . 1 1 120 120 THR CB C 120 70.140 70.140 69.221 0.919 25768 17922 1 20 . 1 1 120 120 THR H H 120 7.570 7.570 8.531 -0.961 25768 17923 1 20 . 1 1 121 121 PHE N N 121 121.230 121.230 123.255 -2.025 25768 17924 1 20 . 1 1 121 121 PHE C C 121 174.910 174.910 175.343 -0.433 25768 17925 1 20 . 1 1 121 121 PHE CA C 121 58.720 58.720 56.427 2.293 25768 17926 1 20 . 1 1 121 121 PHE CB C 121 40.470 40.470 39.280 1.190 25768 17927 1 20 . 1 1 121 121 PHE H H 121 7.830 7.830 7.939 -0.109 25768 17928 1 20 . 1 1 122 122 PHE C C 122 175.070 175.070 175.926 -0.856 25768 17929 1 20 . 1 1 122 122 PHE CA C 122 57.890 57.890 59.772 -1.882 25768 17930 1 20 . 1 1 122 122 PHE CB C 122 39.870 39.870 38.388 1.482 25768 17931 1 20 . 1 1 123 123 ASP N N 123 122.170 122.170 119.625 2.545 25768 17932 1 20 . 1 1 123 123 ASP C C 123 176.150 176.150 175.641 0.509 25768 17933 1 20 . 1 1 123 123 ASP CA C 123 54.530 54.530 55.674 -1.144 25768 17934 1 20 . 1 1 123 123 ASP CB C 123 41.830 41.830 40.529 1.302 25768 17935 1 20 . 1 1 123 123 ASP H H 123 7.950 7.950 8.717 -0.767 25768 17936 1 20 . 1 1 124 124 GLU N N 124 122.690 122.690 118.227 4.463 25768 17937 1 20 . 1 1 124 124 GLU C C 124 176.630 176.630 177.993 -1.363 25768 17938 1 20 . 1 1 124 124 GLU CA C 124 57.620 57.620 57.441 0.179 25768 17939 1 20 . 1 1 124 124 GLU CB C 124 30.450 30.450 29.494 0.956 25768 17940 1 20 . 1 1 124 124 GLU H H 124 8.340 8.340 8.290 0.050 25768 17941 1 20 . 1 1 125 125 ASP N N 125 121.280 121.280 120.105 1.175 25768 17942 1 20 . 1 1 125 125 ASP C C 125 176.940 176.940 178.741 -1.801 25768 17943 1 20 . 1 1 125 125 ASP CA C 125 55.180 55.180 56.678 -1.498 25768 17944 1 20 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.653 0.567 25768 17945 1 20 . 1 1 125 125 ASP H H 125 8.310 8.310 8.600 -0.290 25768 17946 1 20 . 1 1 126 126 LEU N N 126 122.830 122.830 119.855 2.975 25768 17947 1 20 . 1 1 126 126 LEU C C 126 178.020 178.020 177.826 0.194 25768 17948 1 20 . 1 1 126 126 LEU CA C 126 56.450 56.450 56.693 -0.243 25768 17949 1 20 . 1 1 126 126 LEU CB C 126 42.150 42.150 41.162 0.988 25768 17950 1 20 . 1 1 126 126 LEU H H 126 8.010 8.010 8.441 -0.431 25768 17951 1 20 . 1 1 127 127 ALA N N 127 122.660 122.660 118.036 4.624 25768 17952 1 20 . 1 1 127 127 ALA C C 127 178.600 178.600 177.840 0.760 25768 17953 1 20 . 1 1 127 127 ALA CA C 127 53.780 53.780 53.547 0.233 25768 17954 1 20 . 1 1 127 127 ALA CB C 127 19.000 19.000 19.067 -0.067 25768 17955 1 20 . 1 1 127 127 ALA H H 127 8.100 8.100 7.897 0.203 25768 17956 1 20 . 1 1 128 128 SER N N 128 113.740 113.740 115.661 -1.921 25768 17957 1 20 . 1 1 128 128 SER C C 128 175.010 175.010 173.566 1.444 25768 17958 1 20 . 1 1 128 128 SER CA C 128 59.580 59.580 59.350 0.230 25768 17959 1 20 . 1 1 128 128 SER CB C 128 63.800 63.800 62.854 0.946 25768 17960 1 20 . 1 1 128 128 SER H H 128 7.920 7.920 7.654 0.266 25768 17961 1 20 . 1 1 129 129 ASN N N 129 120.300 120.300 125.570 -5.270 25768 17962 1 20 . 1 1 129 129 ASN C C 129 175.590 175.590 175.074 0.516 25768 17963 1 20 . 1 1 129 129 ASN CA C 129 54.180 54.180 53.622 0.558 25768 17964 1 20 . 1 1 129 129 ASN CB C 129 38.900 38.900 39.110 -0.210 25768 17965 1 20 . 1 1 129 129 ASN H H 129 8.120 8.120 8.609 -0.489 25768 17966 1 20 . 1 1 130 130 ARG N N 130 120.630 120.630 125.337 -4.707 25768 17967 1 20 . 1 1 130 130 ARG C C 130 176.720 176.720 176.013 0.707 25768 17968 1 20 . 1 1 130 130 ARG CA C 130 57.240 57.240 56.473 0.767 25768 17969 1 20 . 1 1 130 130 ARG CB C 130 30.500 30.500 31.397 -0.897 25768 17970 1 20 . 1 1 130 130 ARG H H 130 8.050 8.050 8.540 -0.490 25768 17971 1 20 . 1 1 131 131 LYS N N 131 121.150 121.150 121.999 -0.849 25768 17972 1 20 . 1 1 131 131 LYS C C 131 176.750 176.750 174.910 1.840 25768 17973 1 20 . 1 1 131 131 LYS CA C 131 57.050 57.050 56.120 0.930 25768 17974 1 20 . 1 1 131 131 LYS CB C 131 32.870 32.870 31.358 1.512 25768 17975 1 20 . 1 1 131 131 LYS H H 131 8.020 8.020 8.336 -0.316 25768 17976 1 20 . 1 1 132 132 ALA N N 132 124.110 124.110 125.644 -1.534 25768 17977 1 20 . 1 1 132 132 ALA C C 132 177.680 177.680 176.443 1.237 25768 17978 1 20 . 1 1 132 132 ALA CA C 132 53.070 53.070 52.702 0.368 25768 17979 1 20 . 1 1 132 132 ALA CB C 132 19.250 19.250 19.983 -0.733 25768 17980 1 20 . 1 1 132 132 ALA H H 132 8.010 8.010 8.145 -0.135 25768 17981 1 20 . 1 1 133 133 GLN N N 133 118.830 118.830 121.196 -2.366 25768 17982 1 20 . 1 1 133 133 GLN C C 133 176.380 176.380 176.276 0.104 25768 17983 1 20 . 1 1 133 133 GLN CA C 133 56.400 56.400 56.158 0.242 25768 17984 1 20 . 1 1 133 133 GLN CB C 133 29.670 29.670 30.425 -0.755 25768 17985 1 20 . 1 1 133 133 GLN H H 133 8.070 8.070 8.758 -0.688 25768 17986 1 20 . 1 1 134 134 GLY N N 134 109.400 109.400 108.070 1.330 25768 17987 1 20 . 1 1 134 134 GLY C C 134 174.060 174.060 172.979 1.081 25768 17988 1 20 . 1 1 134 134 GLY CA C 134 45.690 45.690 45.012 0.678 25768 17989 1 20 . 1 1 134 134 GLY H H 134 8.150 8.150 8.030 0.120 25768 17990 1 20 . 1 1 135 135 PHE N N 135 120.480 120.480 121.068 -0.588 25768 17991 1 20 . 1 1 135 135 PHE C C 135 176.000 176.000 175.389 0.611 25768 17992 1 20 . 1 1 135 135 PHE CA C 135 58.370 58.370 57.372 0.998 25768 17993 1 20 . 1 1 135 135 PHE CB C 135 39.710 39.710 41.333 -1.623 25768 17994 1 20 . 1 1 135 135 PHE H H 135 8.060 8.060 8.058 0.002 25768 17995 1 20 . 1 1 136 136 SER N N 136 116.740 116.740 119.438 -2.698 25768 17996 1 20 . 1 1 136 136 SER C C 136 174.620 174.620 173.644 0.976 25768 17997 1 20 . 1 1 136 136 SER CA C 136 58.870 58.870 58.184 0.686 25768 17998 1 20 . 1 1 136 136 SER CB C 136 64.200 64.200 63.795 0.405 25768 17999 1 20 . 1 1 136 136 SER H H 136 8.160 8.160 8.797 -0.637 25768 18000 1 20 . 1 1 137 137 SER N N 137 117.650 117.650 119.063 -1.413 25768 18001 1 20 . 1 1 137 137 SER C C 137 174.410 174.410 174.866 -0.456 25768 18002 1 20 . 1 1 137 137 SER CA C 137 58.880 58.880 57.913 0.967 25768 18003 1 20 . 1 1 137 137 SER CB C 137 64.140 64.140 63.912 0.228 25768 18004 1 20 . 1 1 137 137 SER H H 137 8.140 8.140 8.541 -0.401 25768 18005 1 20 . 1 1 138 138 MET N N 138 121.980 121.980 126.208 -4.228 25768 18006 1 20 . 1 1 138 138 MET C C 138 175.680 175.680 177.216 -1.536 25768 18007 1 20 . 1 1 138 138 MET CA C 138 56.180 56.180 56.844 -0.664 25768 18008 1 20 . 1 1 138 138 MET CB C 138 33.240 33.240 32.680 0.560 25768 18009 1 20 . 1 1 138 138 MET H H 138 8.110 8.110 8.550 -0.440 25768 18010 1 20 . 1 1 139 139 LYS N N 139 122.110 122.110 118.169 3.941 25768 18011 1 20 . 1 1 139 139 LYS C C 139 176.220 176.220 175.705 0.515 25768 18012 1 20 . 1 1 139 139 LYS CA C 139 56.370 56.370 56.223 0.147 25768 18013 1 20 . 1 1 139 139 LYS CB C 139 33.220 33.220 32.321 0.899 25768 18014 1 20 . 1 1 139 139 LYS H H 139 8.140 8.140 8.208 -0.068 25768 18015 1 20 . 1 1 140 140 LEU N N 140 123.860 123.860 117.978 5.882 25768 18016 1 20 . 1 1 140 140 LEU C C 140 177.100 177.100 176.871 0.229 25768 18017 1 20 . 1 1 140 140 LEU CA C 140 55.710 55.710 56.782 -1.072 25768 18018 1 20 . 1 1 140 140 LEU CB C 140 42.460 42.460 41.637 0.823 25768 18019 1 20 . 1 1 140 140 LEU H H 140 8.140 8.140 7.734 0.406 25768 18020 1 20 . 1 1 141 141 GLN N N 141 120.350 120.350 116.745 3.605 25768 18021 1 20 . 1 1 141 141 GLN C C 141 175.170 175.170 174.303 0.867 25768 18022 1 20 . 1 1 141 141 GLN CA C 141 56.200 56.200 57.102 -0.902 25768 18023 1 20 . 1 1 141 141 GLN CB C 141 29.950 29.950 28.314 1.636 25768 18024 1 20 . 1 1 141 141 GLN H H 141 8.210 8.210 8.555 -0.345 25768 18025 1 20 . 1 1 142 142 ASP N N 142 120.950 120.950 118.034 2.916 25768 18026 1 20 . 1 1 142 142 ASP C C 142 175.840 175.840 174.671 1.169 25768 18027 1 20 . 1 1 142 142 ASP CA C 142 54.700 54.700 53.434 1.266 25768 18028 1 20 . 1 1 142 142 ASP CB C 142 41.760 41.760 41.376 0.384 25768 18029 1 20 . 1 1 142 142 ASP H H 142 8.120 8.120 8.247 -0.127 25768 18030 1 20 . 1 1 143 143 SER N N 143 114.880 114.880 115.710 -0.830 25768 18031 1 20 . 1 1 143 143 SER C C 143 173.290 173.290 174.489 -1.199 25768 18032 1 20 . 1 1 143 143 SER CA C 143 58.450 58.450 57.023 1.427 25768 18033 1 20 . 1 1 143 143 SER CB C 143 64.760 64.760 64.044 0.716 25768 18034 1 20 . 1 1 143 143 SER H H 143 7.960 7.960 7.716 0.244 25768 18035 1 20 . 1 1 144 144 TRP N N 144 123.110 123.110 124.647 -1.537 25768 18036 1 20 . 1 1 144 144 TRP C C 144 175.880 175.880 175.959 -0.079 25768 18037 1 20 . 1 1 144 144 TRP CA C 144 56.420 56.420 56.811 -0.391 25768 18038 1 20 . 1 1 144 144 TRP CB C 144 31.160 31.160 29.073 2.087 25768 18039 1 20 . 1 1 144 144 TRP H H 144 8.080 8.080 7.980 0.100 25768 18040 1 20 . 1 1 145 145 GLY N N 145 110.410 110.410 107.706 2.704 25768 18041 1 20 . 1 1 145 145 GLY C C 145 172.870 172.870 172.818 0.052 25768 18042 1 20 . 1 1 145 145 GLY CA C 145 45.130 45.130 44.535 0.595 25768 18043 1 20 . 1 1 145 145 GLY H H 145 8.660 8.660 8.659 0.001 25768 18044 1 20 . 1 1 148 148 GLY C C 148 171.800 171.800 172.274 -0.474 25768 18045 1 20 . 1 1 148 148 GLY CA C 148 44.140 44.140 44.462 -0.322 25768 18046 1 20 . 1 1 149 149 GLU N N 149 123.070 123.070 126.029 -2.959 25768 18047 1 20 . 1 1 149 149 GLU C C 149 174.210 174.210 174.051 0.159 25768 18048 1 20 . 1 1 149 149 GLU CA C 149 55.120 55.120 54.427 0.693 25768 18049 1 20 . 1 1 149 149 GLU CB C 149 37.410 37.410 34.718 2.692 25768 18050 1 20 . 1 1 149 149 GLU H H 149 8.550 8.550 8.821 -0.271 25768 18051 1 20 . 1 1 150 150 LEU N N 150 126.130 126.130 120.788 5.342 25768 18052 1 20 . 1 1 150 150 LEU C C 150 174.410 174.410 174.472 -0.062 25768 18053 1 20 . 1 1 150 150 LEU CA C 150 54.260 54.260 52.671 1.589 25768 18054 1 20 . 1 1 150 150 LEU CB C 150 47.510 47.510 44.557 2.953 25768 18055 1 20 . 1 1 150 150 LEU H H 150 8.550 8.550 8.537 0.013 25768 18056 1 20 . 1 1 151 151 GLY N N 151 109.500 109.500 107.914 1.586 25768 18057 1 20 . 1 1 151 151 GLY C C 151 170.610 170.610 171.367 -0.757 25768 18058 1 20 . 1 1 151 151 GLY CA C 151 45.980 45.980 42.892 3.087 25768 18059 1 20 . 1 1 151 151 GLY H H 151 8.090 8.090 7.315 0.775 25768 18060 1 20 . 1 1 152 152 PHE N N 152 110.960 110.960 116.647 -5.687 25768 18061 1 20 . 1 1 152 152 PHE C C 152 171.510 171.510 174.111 -2.601 25768 18062 1 20 . 1 1 152 152 PHE CA C 152 58.170 58.170 55.950 2.220 25768 18063 1 20 . 1 1 152 152 PHE CB C 152 41.690 41.690 41.698 -0.008 25768 18064 1 20 . 1 1 152 152 PHE H H 152 8.380 8.380 8.243 0.137 25768 18065 1 20 . 1 1 153 153 ASP N N 153 118.880 118.880 125.310 -6.430 25768 18066 1 20 . 1 1 153 153 ASP C C 153 176.520 176.520 175.068 1.452 25768 18067 1 20 . 1 1 153 153 ASP CA C 153 52.940 52.940 53.918 -0.978 25768 18068 1 20 . 1 1 153 153 ASP CB C 153 44.540 44.540 42.621 1.919 25768 18069 1 20 . 1 1 153 153 ASP H H 153 7.970 7.970 8.789 -0.819 25768 18070 1 20 . 1 1 154 154 TYR N N 154 123.630 123.630 127.121 -3.491 25768 18071 1 20 . 1 1 154 154 TYR C C 154 175.610 175.610 173.860 1.750 25768 18072 1 20 . 1 1 154 154 TYR CA C 154 57.310 57.310 57.375 -0.065 25768 18073 1 20 . 1 1 154 154 TYR CB C 154 42.040 42.040 41.864 0.176 25768 18074 1 20 . 1 1 154 154 TYR H H 154 9.730 9.730 9.388 0.342 25768 18075 1 20 . 1 1 155 155 MET N N 155 126.190 126.190 124.246 1.944 25768 18076 1 20 . 1 1 155 155 MET C C 155 174.970 174.970 175.370 -0.400 25768 18077 1 20 . 1 1 155 155 MET CA C 155 54.720 54.720 55.532 -0.812 25768 18078 1 20 . 1 1 155 155 MET CB C 155 28.300 28.300 33.860 -5.560 25768 18079 1 20 . 1 1 155 155 MET H H 155 8.600 8.600 8.724 -0.124 25768 18080 1 20 . 1 1 156 156 LEU N N 156 125.290 125.290 125.547 -0.257 25768 18081 1 20 . 1 1 156 156 LEU C C 156 177.680 177.680 177.784 -0.104 25768 18082 1 20 . 1 1 156 156 LEU CA C 156 56.040 56.040 55.126 0.914 25768 18083 1 20 . 1 1 156 156 LEU CB C 156 43.040 43.040 43.074 -0.034 25768 18084 1 20 . 1 1 156 156 LEU H H 156 9.190 9.190 8.541 0.649 25768 18085 1 20 . 1 1 157 157 ASN N N 157 114.690 114.690 114.758 -0.068 25768 18086 1 20 . 1 1 157 157 ASN C C 157 173.640 173.640 175.760 -2.120 25768 18087 1 20 . 1 1 157 157 ASN CA C 157 52.650 52.650 55.153 -2.503 25768 18088 1 20 . 1 1 157 157 ASN CB C 157 37.270 37.270 37.304 -0.034 25768 18089 1 20 . 1 1 157 157 ASN H H 157 8.060 8.060 8.154 -0.094 25768 18090 1 20 . 1 1 158 158 GLU N N 158 114.530 114.530 117.885 -3.355 25768 18091 1 20 . 1 1 158 158 GLU C C 158 176.090 176.090 177.011 -0.921 25768 18092 1 20 . 1 1 158 158 GLU CA C 158 60.010 60.010 57.809 2.201 25768 18093 1 20 . 1 1 158 158 GLU CB C 158 29.730 29.730 30.054 -0.324 25768 18094 1 20 . 1 1 158 158 GLU H H 158 8.560 8.560 8.728 -0.168 25768 18095 1 20 . 1 1 159 159 HIS N N 159 110.480 110.480 115.222 -4.742 25768 18096 1 20 . 1 1 159 159 HIS C C 159 173.130 173.130 173.897 -0.767 25768 18097 1 20 . 1 1 159 159 HIS CA C 159 56.770 56.770 56.043 0.727 25768 18098 1 20 . 1 1 159 159 HIS CB C 159 32.630 32.630 31.986 0.644 25768 18099 1 20 . 1 1 159 159 HIS H H 159 8.190 8.190 7.873 0.317 25768 18100 1 20 . 1 1 160 160 ALA N N 160 122.890 122.890 119.560 3.330 25768 18101 1 20 . 1 1 160 160 ALA C C 160 176.200 176.200 174.465 1.735 25768 18102 1 20 . 1 1 160 160 ALA CA C 160 51.730 51.730 51.464 0.266 25768 18103 1 20 . 1 1 160 160 ALA CB C 160 21.560 21.560 20.046 1.514 25768 18104 1 20 . 1 1 160 160 ALA H H 160 8.400 8.400 7.383 1.017 25768 18105 1 20 . 1 1 161 161 LEU N N 161 116.540 116.540 117.485 -0.945 25768 18106 1 20 . 1 1 161 161 LEU C C 161 174.930 174.930 175.330 -0.400 25768 18107 1 20 . 1 1 161 161 LEU CA C 161 54.280 54.280 54.051 0.229 25768 18108 1 20 . 1 1 161 161 LEU CB C 161 45.640 45.640 44.458 1.182 25768 18109 1 20 . 1 1 161 161 LEU H H 161 8.590 8.590 8.504 0.086 25768 18110 1 20 . 1 1 162 162 PHE N N 162 121.780 121.780 124.290 -2.510 25768 18111 1 20 . 1 1 162 162 PHE C C 162 171.960 171.960 173.419 -1.459 25768 18112 1 20 . 1 1 162 162 PHE CA C 162 56.420 56.420 56.925 -0.505 25768 18113 1 20 . 1 1 162 162 PHE CB C 162 43.340 43.340 43.078 0.262 25768 18114 1 20 . 1 1 162 162 PHE H H 162 9.180 9.180 9.525 -0.345 25768 18115 1 20 . 1 1 163 163 ASN N N 163 127.850 127.850 124.271 3.579 25768 18116 1 20 . 1 1 163 163 ASN C C 163 171.320 171.320 173.681 -2.361 25768 18117 1 20 . 1 1 163 163 ASN CA C 163 52.340 52.340 52.246 0.094 25768 18118 1 20 . 1 1 163 163 ASN CB C 163 46.410 46.410 42.610 3.800 25768 18119 1 20 . 1 1 163 163 ASN H H 163 7.700 7.700 8.514 -0.814 25768 18120 1 20 . 1 1 164 164 MET N N 164 119.950 119.950 122.498 -2.548 25768 18121 1 20 . 1 1 164 164 MET C C 164 172.830 172.830 174.512 -1.682 25768 18122 1 20 . 1 1 164 164 MET CA C 164 55.180 55.180 55.078 0.102 25768 18123 1 20 . 1 1 164 164 MET CB C 164 37.770 37.770 36.798 0.972 25768 18124 1 20 . 1 1 164 164 MET H H 164 7.070 7.070 8.855 -1.785 25768 18125 1 20 . 1 1 165 165 ALA N N 165 120.600 120.600 123.563 -2.963 25768 18126 1 20 . 1 1 165 165 ALA C C 165 174.240 174.240 174.740 -0.500 25768 18127 1 20 . 1 1 165 165 ALA CA C 165 51.630 51.630 51.032 0.598 25768 18128 1 20 . 1 1 165 165 ALA CB C 165 22.330 22.330 22.032 0.298 25768 18129 1 20 . 1 1 165 165 ALA H H 165 8.290 8.290 8.487 -0.197 25768 18130 1 20 . 1 1 166 166 VAL N N 166 117.900 117.900 115.651 2.249 25768 18131 1 20 . 1 1 166 166 VAL C C 166 172.950 172.950 173.734 -0.784 25768 18132 1 20 . 1 1 166 166 VAL CA C 166 59.710 59.710 61.493 -1.784 25768 18133 1 20 . 1 1 166 166 VAL CB C 166 35.290 35.290 34.867 0.423 25768 18134 1 20 . 1 1 166 166 VAL H H 166 8.720 8.720 8.068 0.652 25768 18135 1 20 . 1 1 171 171 ILE C C 171 175.750 175.750 176.004 -0.254 25768 18136 1 20 . 1 1 171 171 ILE CA C 171 61.720 61.720 61.428 0.292 25768 18137 1 20 . 1 1 171 171 ILE CB C 171 39.300 39.300 39.197 0.103 25768 18138 1 20 . 1 1 172 172 ASP N N 172 124.070 124.070 120.274 3.796 25768 18139 1 20 . 1 1 172 172 ASP C C 172 176.590 176.590 175.889 0.701 25768 18140 1 20 . 1 1 172 172 ASP CA C 172 54.460 54.460 53.295 1.165 25768 18141 1 20 . 1 1 172 172 ASP CB C 172 41.410 41.410 43.475 -2.066 25768 18142 1 20 . 1 1 172 172 ASP H H 172 8.460 8.460 7.912 0.548 25768 18143 1 20 . 1 1 173 173 THR N N 173 115.570 115.570 115.107 0.463 25768 18144 1 20 . 1 1 173 173 THR C C 173 175.030 175.030 174.615 0.415 25768 18145 1 20 . 1 1 173 173 THR CA C 173 62.680 62.680 62.846 -0.166 25768 18146 1 20 . 1 1 173 173 THR CB C 173 69.840 69.840 69.372 0.468 25768 18147 1 20 . 1 1 173 173 THR H H 173 8.080 8.080 8.204 -0.124 25768 18148 1 20 . 1 1 174 174 LYS N N 174 122.680 122.680 120.577 2.103 25768 18149 1 20 . 1 1 174 174 LYS C C 174 176.340 176.340 175.037 1.303 25768 18150 1 20 . 1 1 174 174 LYS CA C 174 56.820 56.820 56.229 0.591 25768 18151 1 20 . 1 1 174 174 LYS CB C 174 32.790 32.790 31.868 0.922 25768 18152 1 20 . 1 1 174 174 LYS H H 174 8.180 8.180 7.930 0.250 25768 18153 1 20 . 1 1 175 175 ALA N N 175 124.050 124.050 126.159 -2.109 25768 18154 1 20 . 1 1 175 175 ALA C C 175 177.550 177.550 177.307 0.243 25768 18155 1 20 . 1 1 175 175 ALA CA C 175 52.840 52.840 52.236 0.604 25768 18156 1 20 . 1 1 175 175 ALA CB C 175 19.580 19.580 19.037 0.543 25768 18157 1 20 . 1 1 175 175 ALA H H 175 8.050 8.050 8.362 -0.312 25768 18158 1 20 . 1 1 176 176 SER N N 176 114.920 114.920 118.046 -3.126 25768 18159 1 20 . 1 1 176 176 SER C C 176 174.240 174.240 173.697 0.543 25768 18160 1 20 . 1 1 176 176 SER CA C 176 58.390 58.390 57.666 0.724 25768 18161 1 20 . 1 1 176 176 SER CB C 176 64.370 64.370 64.866 -0.496 25768 18162 1 20 . 1 1 176 176 SER H H 176 8.070 8.070 8.440 -0.370 25768 18163 1 20 . 1 1 177 177 ILE N N 177 121.650 121.650 119.683 1.967 25768 18164 1 20 . 1 1 177 177 ILE C C 177 174.990 174.990 175.470 -0.480 25768 18165 1 20 . 1 1 177 177 ILE CA C 177 61.570 61.570 60.536 1.034 25768 18166 1 20 . 1 1 177 177 ILE CB C 177 39.100 39.100 38.977 0.123 25768 18167 1 20 . 1 1 177 177 ILE H H 177 7.960 7.960 8.122 -0.162 25768 18168 1 20 . 1 1 178 178 ASN N N 178 127.040 127.040 122.267 4.773 25768 18169 1 20 . 1 1 178 178 ASN C C 178 179.160 179.160 175.076 4.084 25768 18170 1 20 . 1 1 178 178 ASN CA C 178 55.100 55.100 53.787 1.313 25768 18171 1 20 . 1 1 178 178 ASN CB C 178 41.300 41.300 38.476 2.824 25768 18172 1 20 . 1 1 178 178 ASN H H 178 7.850 7.850 8.589 -0.739 25768 18173 1 20 . 1 1 180 180 PRO C C 180 177.520 177.520 175.827 1.693 25768 18174 1 20 . 1 1 180 180 PRO CA C 180 63.980 63.980 63.157 0.823 25768 18175 1 20 . 1 1 180 180 PRO CB C 180 32.190 32.190 32.503 -0.313 25768 18176 1 20 . 1 1 181 181 SER N N 181 115.600 115.600 118.480 -2.880 25768 18177 1 20 . 1 1 181 181 SER C C 181 174.710 174.710 173.983 0.727 25768 18178 1 20 . 1 1 181 181 SER CA C 181 58.900 58.900 58.969 -0.069 25768 18179 1 20 . 1 1 181 181 SER CB C 181 64.070 64.070 64.113 -0.043 25768 18180 1 20 . 1 1 181 181 SER H H 181 8.260 8.260 8.818 -0.558 25768 18181 1 20 . 1 1 182 182 ALA N N 182 125.880 125.880 124.081 1.799 25768 18182 1 20 . 1 1 182 182 ALA C C 182 177.560 177.560 178.568 -1.008 25768 18183 1 20 . 1 1 182 182 ALA CA C 182 53.090 53.090 53.011 0.079 25768 18184 1 20 . 1 1 182 182 ALA CB C 182 19.310 19.310 18.692 0.618 25768 18185 1 20 . 1 1 182 182 ALA H H 182 8.130 8.130 8.378 -0.248 25768 18186 1 20 . 1 1 183 183 LEU N N 183 119.980 119.980 121.282 -1.302 25768 18187 1 20 . 1 1 183 183 LEU C C 183 177.850 177.850 178.142 -0.292 25768 18188 1 20 . 1 1 183 183 LEU CA C 183 55.650 55.650 55.276 0.374 25768 18189 1 20 . 1 1 183 183 LEU CB C 183 42.530 42.530 42.287 0.243 25768 18190 1 20 . 1 1 183 183 LEU H H 183 7.940 7.940 7.970 -0.030 25768 18191 1 20 . 1 1 184 184 GLY N N 184 109.250 109.250 108.022 1.228 25768 18192 1 20 . 1 1 184 184 GLY C C 184 174.250 174.250 174.832 -0.582 25768 18193 1 20 . 1 1 184 184 GLY CA C 184 45.830 45.830 44.592 1.238 25768 18194 1 20 . 1 1 184 184 GLY H H 184 8.150 8.150 8.390 -0.240 25768 18195 1 20 . 1 1 185 185 VAL N N 185 118.830 118.830 116.644 2.186 25768 18196 1 20 . 1 1 185 185 VAL C C 185 175.890 175.890 175.556 0.334 25768 18197 1 20 . 1 1 185 185 VAL CA C 185 62.740 62.740 62.408 0.332 25768 18198 1 20 . 1 1 185 185 VAL CB C 185 32.770 32.770 32.269 0.501 25768 18199 1 20 . 1 1 185 185 VAL H H 185 7.760 7.760 7.963 -0.203 25768 18200 1 20 . 1 1 186 186 ASN N N 186 121.850 121.850 119.928 1.922 25768 18201 1 20 . 1 1 186 186 ASN C C 186 174.970 174.970 174.188 0.782 25768 18202 1 20 . 1 1 186 186 ASN CA C 186 53.590 53.590 52.976 0.614 25768 18203 1 20 . 1 1 186 186 ASN CB C 186 39.160 39.160 39.447 -0.287 25768 18204 1 20 . 1 1 186 186 ASN H H 186 8.380 8.380 8.662 -0.282 25768 18205 1 20 . 1 1 187 187 LYS N N 187 122.120 122.120 118.748 3.372 25768 18206 1 20 . 1 1 187 187 LYS C C 187 176.490 176.490 174.963 1.527 25768 18207 1 20 . 1 1 187 187 LYS CA C 187 56.750 56.750 55.822 0.929 25768 18208 1 20 . 1 1 187 187 LYS CB C 187 33.250 33.250 34.069 -0.819 25768 18209 1 20 . 1 1 187 187 LYS H H 187 8.140 8.140 8.313 -0.173 25768 18210 1 20 . 1 1 188 188 THR N N 188 115.250 115.250 115.552 -0.302 25768 18211 1 20 . 1 1 188 188 THR C C 188 174.250 174.250 174.180 0.070 25768 18212 1 20 . 1 1 188 188 THR CA C 188 62.360 62.360 61.732 0.628 25768 18213 1 20 . 1 1 188 188 THR CB C 188 70.280 70.280 70.534 -0.255 25768 18214 1 20 . 1 1 188 188 THR H H 188 8.100 8.100 8.079 0.021 25768 18215 1 20 . 1 1 189 189 LYS N N 189 123.780 123.780 122.650 1.130 25768 18216 1 20 . 1 1 189 189 LYS C C 189 176.090 176.090 176.050 0.040 25768 18217 1 20 . 1 1 189 189 LYS CA C 189 56.590 56.590 57.788 -1.198 25768 18218 1 20 . 1 1 189 189 LYS CB C 189 33.350 33.350 32.522 0.828 25768 18219 1 20 . 1 1 189 189 LYS H H 189 8.110 8.110 8.592 -0.482 25768 18220 1 20 . 1 1 190 190 VAL N N 190 120.920 120.920 115.055 5.865 25768 18221 1 20 . 1 1 190 190 VAL C C 190 175.590 175.590 174.601 0.989 25768 18222 1 20 . 1 1 190 190 VAL CA C 190 62.400 62.400 59.860 2.540 25768 18223 1 20 . 1 1 190 190 VAL CB C 190 32.990 32.990 33.222 -0.232 25768 18224 1 20 . 1 1 190 190 VAL H H 190 8.040 8.040 7.445 0.595 25768 18225 1 20 . 1 1 191 191 ASP N N 191 123.790 123.790 118.738 5.052 25768 18226 1 20 . 1 1 191 191 ASP C C 191 175.750 175.750 175.478 0.272 25768 18227 1 20 . 1 1 191 191 ASP CA C 191 54.650 54.650 54.936 -0.286 25768 18228 1 20 . 1 1 191 191 ASP CB C 191 41.450 41.450 42.858 -1.408 25768 18229 1 20 . 1 1 191 191 ASP H H 191 8.240 8.240 8.356 -0.116 25768 18230 1 20 . 1 1 192 192 VAL N N 192 118.850 118.850 120.123 -1.273 25768 18231 1 20 . 1 1 192 192 VAL C C 192 175.380 175.380 174.046 1.334 25768 18232 1 20 . 1 1 192 192 VAL CA C 192 62.110 62.110 62.395 -0.285 25768 18233 1 20 . 1 1 192 192 VAL CB C 192 33.290 33.290 32.920 0.370 25768 18234 1 20 . 1 1 192 192 VAL H H 192 7.860 7.860 7.711 0.149 25768 18235 1 20 . 1 1 193 193 ASP N N 193 124.190 124.190 122.116 2.074 25768 18236 1 20 . 1 1 193 193 ASP C C 193 175.630 175.630 176.999 -1.369 25768 18237 1 20 . 1 1 193 193 ASP CA C 193 54.540 54.540 55.361 -0.821 25768 18238 1 20 . 1 1 193 193 ASP CB C 193 41.410 41.410 42.023 -0.613 25768 18239 1 20 . 1 1 193 193 ASP H H 193 8.310 8.310 8.323 -0.013 25768 18240 1 20 . 1 1 194 194 VAL N N 194 119.580 119.580 119.046 0.534 25768 18241 1 20 . 1 1 194 194 VAL C C 194 174.950 174.950 175.308 -0.358 25768 18242 1 20 . 1 1 194 194 VAL CA C 194 61.770 61.770 62.408 -0.638 25768 18243 1 20 . 1 1 194 194 VAL CB C 194 33.680 33.680 32.558 1.122 25768 18244 1 20 . 1 1 194 194 VAL H H 194 7.890 7.890 7.728 0.162 25768 18245 1 20 . 1 1 195 195 ASP N N 195 125.660 125.660 122.291 3.369 25768 18246 1 20 . 1 1 195 195 ASP C C 195 174.290 174.290 175.289 -0.999 25768 18247 1 20 . 1 1 195 195 ASP CA C 195 51.940 51.940 53.081 -1.141 25768 18248 1 20 . 1 1 195 195 ASP CB C 195 40.950 40.950 41.709 -0.759 25768 18249 1 20 . 1 1 195 195 ASP H H 195 8.410 8.410 7.907 0.503 25768 18250 1 20 . 1 1 198 198 VAL C C 198 173.940 173.940 173.354 0.586 25768 18251 1 20 . 1 1 198 198 VAL CA C 198 61.270 61.270 61.647 -0.376 25768 18252 1 20 . 1 1 198 198 VAL CB C 198 35.910 35.910 33.770 2.140 25768 18253 1 20 . 1 1 199 199 TYR N N 199 123.780 123.780 125.178 -1.398 25768 18254 1 20 . 1 1 199 199 TYR C C 199 174.150 174.150 174.290 -0.140 25768 18255 1 20 . 1 1 199 199 TYR CA C 199 56.220 56.220 57.503 -1.283 25768 18256 1 20 . 1 1 199 199 TYR CB C 199 41.660 41.660 42.265 -0.605 25768 18257 1 20 . 1 1 199 199 TYR H H 199 8.540 8.540 8.063 0.477 25768 18258 1 20 . 1 1 200 200 MET N N 200 123.920 123.920 124.917 -0.997 25768 18259 1 20 . 1 1 200 200 MET C C 200 173.810 173.810 174.627 -0.817 25768 18260 1 20 . 1 1 200 200 MET CA C 200 54.710 54.710 54.716 -0.006 25768 18261 1 20 . 1 1 200 200 MET CB C 200 37.110 37.110 34.360 2.750 25768 18262 1 20 . 1 1 200 200 MET H H 200 9.130 9.130 8.296 0.834 25768 18263 1 20 . 1 1 201 201 ILE N N 201 123.670 123.670 117.461 6.209 25768 18264 1 20 . 1 1 201 201 ILE C C 201 174.030 174.030 173.912 0.118 25768 18265 1 20 . 1 1 201 201 ILE CA C 201 59.820 59.820 59.523 0.297 25768 18266 1 20 . 1 1 201 201 ILE CB C 201 41.720 41.720 41.712 0.008 25768 18267 1 20 . 1 1 201 201 ILE H H 201 8.030 8.030 8.220 -0.190 25768 18268 1 20 . 1 1 202 202 GLY N N 202 112.910 112.910 109.857 3.053 25768 18269 1 20 . 1 1 202 202 GLY C C 202 170.280 170.280 171.549 -1.269 25768 18270 1 20 . 1 1 202 202 GLY CA C 202 46.800 46.800 45.491 1.309 25768 18271 1 20 . 1 1 202 202 GLY H H 202 8.580 8.580 7.466 1.114 25768 18272 1 20 . 1 1 203 203 PHE N N 203 116.240 116.240 116.630 -0.390 25768 18273 1 20 . 1 1 203 203 PHE C C 203 173.940 173.940 174.217 -0.277 25768 18274 1 20 . 1 1 203 203 PHE CA C 203 55.890 55.890 54.297 1.593 25768 18275 1 20 . 1 1 203 203 PHE CB C 203 45.060 45.060 41.541 3.519 25768 18276 1 20 . 1 1 203 203 PHE H H 203 8.620 8.620 7.194 1.426 25768 18277 1 20 . 1 1 204 204 GLY N N 204 105.610 105.610 105.709 -0.099 25768 18278 1 20 . 1 1 204 204 GLY C C 204 171.190 171.190 171.479 -0.289 25768 18279 1 20 . 1 1 204 204 GLY CA C 204 46.720 46.720 46.082 0.638 25768 18280 1 20 . 1 1 204 204 GLY H H 204 8.960 8.960 8.893 0.067 25768 18281 1 20 . 1 1 205 205 TYR N N 205 121.160 121.160 119.585 1.575 25768 18282 1 20 . 1 1 205 205 TYR C C 205 173.030 173.030 173.975 -0.945 25768 18283 1 20 . 1 1 205 205 TYR CA C 205 57.190 57.190 56.585 0.605 25768 18284 1 20 . 1 1 205 205 TYR CB C 205 44.400 44.400 43.248 1.152 25768 18285 1 20 . 1 1 205 205 TYR H H 205 9.380 9.380 8.519 0.861 25768 18286 1 20 . 1 1 206 206 LYS N N 206 126.970 126.970 125.819 1.151 25768 18287 1 20 . 1 1 206 206 LYS C C 206 174.210 174.210 175.180 -0.970 25768 18288 1 20 . 1 1 206 206 LYS CA C 206 54.770 54.770 55.691 -0.920 25768 18289 1 20 . 1 1 206 206 LYS CB C 206 34.440 34.440 34.139 0.301 25768 18290 1 20 . 1 1 206 206 LYS H H 206 8.380 8.380 8.695 -0.315 25768 18291 1 20 . 1 1 207 207 PHE N N 207 126.330 126.330 126.463 -0.133 25768 18292 1 20 . 1 1 207 207 PHE C C 207 175.020 175.020 174.522 0.498 25768 18293 1 20 . 1 1 207 207 PHE CA C 207 58.170 58.170 58.244 -0.074 25768 18294 1 20 . 1 1 207 207 PHE CB C 207 40.920 40.920 39.284 1.636 25768 18295 1 20 . 1 1 207 207 PHE H H 207 9.290 9.290 7.875 1.415 25768 18296 1 20 . 1 1 208 208 LEU N N 208 122.740 122.740 126.906 -4.166 25768 18297 1 20 . 1 1 208 208 LEU C C 208 176.510 176.510 176.676 -0.166 25768 18298 1 20 . 1 1 208 208 LEU CA C 208 54.910 54.910 53.932 0.978 25768 18299 1 20 . 1 1 208 208 LEU CB C 208 43.830 43.830 43.096 0.734 25768 18300 1 20 . 1 1 208 208 LEU H H 208 8.310 8.310 7.991 0.319 25768 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Entity_delta_chem_shifts_ID _SPARTA_output.Conformer_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Data_low_range _SPARTA_output.Data_high_range _SPARTA_output.Entry_ID 1 1 1 "Average Difference" N 180 3.251 -0.026 3.260 25768 2 1 1 "Average Difference" HA 0 0.000 0.000 0.000 25768 3 1 1 "Average Difference" C 192 1.128 -0.006 1.131 25768 4 1 1 "Average Difference" CA 193 1.133 -0.165 1.124 25768 5 1 1 "Average Difference" CB 170 1.586 -0.345 1.553 25768 6 1 1 "Average Difference" HN 180 0.577 -0.089 0.572 25768 7 1 2 "Average Difference" N 180 3.356 0.040 3.365 25768 8 1 2 "Average Difference" HA 0 0.000 0.000 0.000 25768 9 1 2 "Average Difference" C 192 1.046 -0.020 1.049 25768 10 1 2 "Average Difference" CA 193 1.153 -0.288 1.119 25768 11 1 2 "Average Difference" CB 170 1.490 -0.394 1.441 25768 12 1 2 "Average Difference" HN 180 0.527 -0.083 0.522 25768 13 1 3 "Average Difference" N 180 3.164 0.034 3.173 25768 14 1 3 "Average Difference" HA 0 0.000 0.000 0.000 25768 15 1 3 "Average Difference" C 192 1.014 -0.017 1.017 25768 16 1 3 "Average Difference" CA 193 1.220 -0.217 1.204 25768 17 1 3 "Average Difference" CB 170 1.536 -0.382 1.492 25768 18 1 3 "Average Difference" HN 180 0.540 -0.075 0.537 25768 19 1 4 "Average Difference" N 180 3.282 0.097 3.289 25768 20 1 4 "Average Difference" HA 0 0.000 0.000 0.000 25768 21 1 4 "Average Difference" C 192 1.097 -0.091 1.096 25768 22 1 4 "Average Difference" CA 193 1.116 -0.165 1.107 25768 23 1 4 "Average Difference" CB 170 1.485 -0.357 1.446 25768 24 1 4 "Average Difference" HN 180 0.482 -0.069 0.478 25768 25 1 5 "Average Difference" N 180 3.380 -0.021 3.390 25768 26 1 5 "Average Difference" HA 0 0.000 0.000 0.000 25768 27 1 5 "Average Difference" C 192 1.102 0.082 1.102 25768 28 1 5 "Average Difference" CA 193 1.122 -0.165 1.112 25768 29 1 5 "Average Difference" CB 170 1.594 -0.406 1.546 25768 30 1 5 "Average Difference" HN 180 0.497 -0.061 0.494 25768 31 1 6 "Average Difference" N 180 3.242 0.300 3.237 25768 32 1 6 "Average Difference" HA 0 0.000 0.000 0.000 25768 33 1 6 "Average Difference" C 192 1.135 0.034 1.138 25768 34 1 6 "Average Difference" CA 193 1.106 -0.184 1.093 25768 35 1 6 "Average Difference" CB 170 1.596 -0.438 1.540 25768 36 1 6 "Average Difference" HN 180 0.500 -0.062 0.498 25768 37 1 7 "Average Difference" N 180 3.144 -0.356 3.132 25768 38 1 7 "Average Difference" HA 0 0.000 0.000 0.000 25768 39 1 7 "Average Difference" C 192 1.075 -0.051 1.077 25768 40 1 7 "Average Difference" CA 193 1.162 -0.179 1.152 25768 41 1 7 "Average Difference" CB 170 1.458 -0.312 1.429 25768 42 1 7 "Average Difference" HN 180 0.514 -0.065 0.511 25768 43 1 8 "Average Difference" N 180 3.313 0.061 3.322 25768 44 1 8 "Average Difference" HA 0 0.000 0.000 0.000 25768 45 1 8 "Average Difference" C 192 1.100 0.004 1.103 25768 46 1 8 "Average Difference" CA 193 1.138 -0.169 1.128 25768 47 1 8 "Average Difference" CB 170 1.603 -0.432 1.549 25768 48 1 8 "Average Difference" HN 180 0.521 -0.076 0.517 25768 49 1 9 "Average Difference" N 180 3.117 0.313 3.110 25768 50 1 9 "Average Difference" HA 0 0.000 0.000 0.000 25768 51 1 9 "Average Difference" C 192 1.131 -0.075 1.131 25768 52 1 9 "Average Difference" CA 193 1.125 -0.203 1.109 25768 53 1 9 "Average Difference" CB 170 1.600 -0.372 1.561 25768 54 1 9 "Average Difference" HN 180 0.503 -0.057 0.501 25768 55 1 10 "Average Difference" N 180 3.350 0.208 3.353 25768 56 1 10 "Average Difference" HA 0 0.000 0.000 0.000 25768 57 1 10 "Average Difference" C 192 1.135 0.012 1.138 25768 58 1 10 "Average Difference" CA 193 1.115 -0.233 1.093 25768 59 1 10 "Average Difference" CB 170 1.502 -0.357 1.463 25768 60 1 10 "Average Difference" HN 180 0.534 -0.059 0.532 25768 61 1 11 "Average Difference" N 180 3.470 -0.263 3.469 25768 62 1 11 "Average Difference" HA 0 0.000 0.000 0.000 25768 63 1 11 "Average Difference" C 192 1.114 0.009 1.117 25768 64 1 11 "Average Difference" CA 193 1.200 -0.195 1.187 25768 65 1 11 "Average Difference" CB 170 1.571 -0.512 1.490 25768 66 1 11 "Average Difference" HN 180 0.544 -0.057 0.542 25768 67 1 12 "Average Difference" N 180 3.413 0.048 3.422 25768 68 1 12 "Average Difference" HA 0 0.000 0.000 0.000 25768 69 1 12 "Average Difference" C 192 1.103 -0.043 1.105 25768 70 1 12 "Average Difference" CA 193 1.151 -0.232 1.130 25768 71 1 12 "Average Difference" CB 170 1.566 -0.446 1.506 25768 72 1 12 "Average Difference" HN 180 0.550 -0.050 0.549 25768 73 1 13 "Average Difference" N 180 3.265 -0.070 3.273 25768 74 1 13 "Average Difference" HA 0 0.000 0.000 0.000 25768 75 1 13 "Average Difference" C 192 1.075 -0.051 1.077 25768 76 1 13 "Average Difference" CA 193 1.070 -0.211 1.052 25768 77 1 13 "Average Difference" CB 170 1.549 -0.413 1.497 25768 78 1 13 "Average Difference" HN 180 0.528 -0.096 0.520 25768 79 1 14 "Average Difference" N 180 3.223 -0.113 3.230 25768 80 1 14 "Average Difference" HA 0 0.000 0.000 0.000 25768 81 1 14 "Average Difference" C 192 1.077 0.033 1.080 25768 82 1 14 "Average Difference" CA 193 1.101 -0.176 1.089 25768 83 1 14 "Average Difference" CB 170 1.505 -0.305 1.479 25768 84 1 14 "Average Difference" HN 180 0.508 -0.085 0.502 25768 85 1 15 "Average Difference" N 180 3.099 -0.262 3.096 25768 86 1 15 "Average Difference" HA 0 0.000 0.000 0.000 25768 87 1 15 "Average Difference" C 192 1.055 0.009 1.058 25768 88 1 15 "Average Difference" CA 193 1.157 -0.140 1.151 25768 89 1 15 "Average Difference" CB 170 1.538 -0.476 1.466 25768 90 1 15 "Average Difference" HN 180 0.515 -0.100 0.506 25768 91 1 16 "Average Difference" N 180 3.165 -0.048 3.174 25768 92 1 16 "Average Difference" HA 0 0.000 0.000 0.000 25768 93 1 16 "Average Difference" C 192 1.078 0.024 1.080 25768 94 1 16 "Average Difference" CA 193 1.190 -0.098 1.189 25768 95 1 16 "Average Difference" CB 170 1.633 -0.560 1.539 25768 96 1 16 "Average Difference" HN 180 0.541 -0.052 0.540 25768 97 1 17 "Average Difference" N 180 2.989 0.072 2.996 25768 98 1 17 "Average Difference" HA 0 0.000 0.000 0.000 25768 99 1 17 "Average Difference" C 192 1.022 -0.068 1.022 25768 100 1 17 "Average Difference" CA 193 1.131 -0.193 1.118 25768 101 1 17 "Average Difference" CB 170 1.464 -0.447 1.398 25768 102 1 17 "Average Difference" HN 180 0.541 -0.105 0.532 25768 103 1 18 "Average Difference" N 180 3.714 0.125 3.723 25768 104 1 18 "Average Difference" HA 0 0.000 0.000 0.000 25768 105 1 18 "Average Difference" C 192 1.124 -0.001 1.127 25768 106 1 18 "Average Difference" CA 193 1.135 -0.217 1.117 25768 107 1 18 "Average Difference" CB 170 1.536 -0.385 1.492 25768 108 1 18 "Average Difference" HN 180 0.538 -0.005 0.539 25768 109 1 19 "Average Difference" N 180 3.007 -0.095 3.014 25768 110 1 19 "Average Difference" HA 0 0.000 0.000 0.000 25768 111 1 19 "Average Difference" C 192 0.994 0.016 0.996 25768 112 1 19 "Average Difference" CA 193 1.110 -0.161 1.102 25768 113 1 19 "Average Difference" CB 170 1.383 -0.346 1.343 25768 114 1 19 "Average Difference" HN 180 0.527 -0.099 0.519 25768 115 1 20 "Average Difference" N 180 3.298 -0.212 3.300 25768 116 1 20 "Average Difference" HA 0 0.000 0.000 0.000 25768 117 1 20 "Average Difference" C 192 1.051 -0.015 1.054 25768 118 1 20 "Average Difference" CA 193 1.097 -0.191 1.083 25768 119 1 20 "Average Difference" CB 170 1.485 -0.412 1.431 25768 120 1 20 "Average Difference" HN 180 0.523 -0.063 0.521 25768 stop_ save_ save_delta_chem_shifts_average _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average _Entity_delta_chem_shifts.Model_type average _Entity_delta_chem_shifts.Entry_ID 25768 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 HIS C C 2 175.310 175.310 174.311 0.999 25768 2 1 . 1 1 3 3 LYS N N 3 122.080 122.080 122.615 -0.535 25768 3 1 . 1 1 3 3 LYS C C 3 173.490 173.490 174.709 -1.219 25768 4 1 . 1 1 3 3 LYS CA C 3 55.050 55.050 55.190 -0.140 25768 5 1 . 1 1 3 3 LYS CB C 3 35.380 35.380 35.686 -0.306 25768 6 1 . 1 1 3 3 LYS H H 3 8.620 8.620 8.324 0.296 25768 7 1 . 1 1 4 4 ALA N N 4 120.860 120.860 123.272 -2.412 25768 8 1 . 1 1 4 4 ALA C C 4 178.190 178.190 178.057 0.133 25768 9 1 . 1 1 4 4 ALA CA C 4 53.480 53.480 52.698 0.782 25768 10 1 . 1 1 4 4 ALA CB C 4 18.140 18.140 18.257 -0.117 25768 11 1 . 1 1 4 4 ALA H H 4 8.580 8.580 8.318 0.262 25768 12 1 . 1 1 5 5 GLY N N 5 112.890 112.890 112.515 0.375 25768 13 1 . 1 1 5 5 GLY C C 5 173.830 173.830 173.691 0.140 25768 14 1 . 1 1 5 5 GLY CA C 5 44.880 44.880 44.506 0.374 25768 15 1 . 1 1 5 5 GLY H H 5 9.210 9.210 8.416 0.794 25768 16 1 . 1 1 6 6 ASP N N 6 121.590 121.590 120.904 0.686 25768 17 1 . 1 1 6 6 ASP C C 6 174.380 174.380 174.811 -0.431 25768 18 1 . 1 1 6 6 ASP CA C 6 55.790 55.790 54.619 1.171 25768 19 1 . 1 1 6 6 ASP CB C 6 41.760 41.760 42.028 -0.268 25768 20 1 . 1 1 6 6 ASP H H 6 7.620 7.620 7.504 0.117 25768 21 1 . 1 1 7 7 PHE N N 7 120.860 120.860 121.545 -0.685 25768 22 1 . 1 1 7 7 PHE C C 7 174.050 174.050 174.494 -0.444 25768 23 1 . 1 1 7 7 PHE CA C 7 56.110 56.110 57.414 -1.304 25768 24 1 . 1 1 7 7 PHE CB C 7 42.550 42.550 41.346 1.204 25768 25 1 . 1 1 7 7 PHE H H 7 8.250 8.250 8.487 -0.237 25768 26 1 . 1 1 8 8 ILE N N 8 127.950 127.950 122.395 5.555 25768 27 1 . 1 1 8 8 ILE C C 8 174.000 174.000 174.310 -0.310 25768 28 1 . 1 1 8 8 ILE CA C 8 61.160 61.160 59.917 1.243 25768 29 1 . 1 1 8 8 ILE CB C 8 42.660 42.660 41.808 0.852 25768 30 1 . 1 1 8 8 ILE H H 8 9.230 9.230 8.262 0.968 25768 31 1 . 1 1 9 9 ILE N N 9 125.380 125.380 122.993 2.387 25768 32 1 . 1 1 9 9 ILE C C 9 173.630 173.630 174.560 -0.930 25768 33 1 . 1 1 9 9 ILE CA C 9 59.600 59.600 59.955 -0.355 25768 34 1 . 1 1 9 9 ILE CB C 9 41.180 41.180 40.549 0.631 25768 35 1 . 1 1 9 9 ILE H H 9 8.580 8.580 8.626 -0.046 25768 36 1 . 1 1 10 10 ARG N N 10 124.950 124.950 124.101 0.849 25768 37 1 . 1 1 10 10 ARG C C 10 175.030 175.030 174.527 0.503 25768 38 1 . 1 1 10 10 ARG CA C 10 53.920 53.920 54.792 -0.872 25768 39 1 . 1 1 10 10 ARG CB C 10 31.880 31.880 34.729 -2.849 25768 40 1 . 1 1 10 10 ARG H H 10 9.230 9.230 8.531 0.699 25768 41 1 . 1 1 11 11 GLY N N 11 105.650 105.650 109.020 -3.370 25768 42 1 . 1 1 11 11 GLY C C 11 172.090 172.090 172.055 0.035 25768 43 1 . 1 1 11 11 GLY CA C 11 44.460 44.460 44.476 -0.016 25768 44 1 . 1 1 11 11 GLY H H 11 8.780 8.780 8.474 0.306 25768 45 1 . 1 1 12 12 GLY N N 12 107.800 107.800 107.950 -0.150 25768 46 1 . 1 1 12 12 GLY C C 12 171.460 171.460 171.726 -0.266 25768 47 1 . 1 1 12 12 GLY CA C 12 46.630 46.630 44.604 2.026 25768 48 1 . 1 1 12 12 GLY H H 12 8.510 8.510 8.210 0.300 25768 49 1 . 1 1 13 13 PHE N N 13 119.900 119.900 118.805 1.095 25768 50 1 . 1 1 13 13 PHE C C 13 174.190 174.190 173.676 0.514 25768 51 1 . 1 1 13 13 PHE CA C 13 56.340 56.340 56.611 -0.271 25768 52 1 . 1 1 13 13 PHE CB C 13 41.090 41.090 43.422 -2.332 25768 53 1 . 1 1 13 13 PHE H H 13 8.610 8.610 8.530 0.080 25768 54 1 . 1 1 14 14 ALA N N 14 128.030 128.030 125.054 2.976 25768 55 1 . 1 1 14 14 ALA C C 14 176.560 176.560 176.884 -0.324 25768 56 1 . 1 1 14 14 ALA CA C 14 49.940 49.940 50.826 -0.886 25768 57 1 . 1 1 14 14 ALA CB C 14 20.360 20.360 21.085 -0.725 25768 58 1 . 1 1 14 14 ALA H H 14 9.220 9.220 8.594 0.626 25768 59 1 . 1 1 15 15 THR N N 15 118.620 118.620 117.438 1.182 25768 60 1 . 1 1 15 15 THR CA C 15 61.440 61.440 61.830 -0.390 25768 61 1 . 1 1 15 15 THR CB C 15 71.370 71.370 69.952 1.418 25768 62 1 . 1 1 15 15 THR H H 15 9.220 9.220 8.230 0.990 25768 63 1 . 1 1 18 18 PRO C C 18 176.690 176.690 176.283 0.407 25768 64 1 . 1 1 18 18 PRO CA C 18 63.610 63.610 63.543 0.067 25768 65 1 . 1 1 18 18 PRO CB C 18 32.440 32.440 32.113 0.327 25768 66 1 . 1 1 19 19 ASP N N 19 120.320 120.320 119.778 0.542 25768 67 1 . 1 1 19 19 ASP C C 19 175.950 175.950 175.973 -0.023 25768 68 1 . 1 1 19 19 ASP CA C 19 54.710 54.710 54.396 0.314 25768 69 1 . 1 1 19 19 ASP CB C 19 41.450 41.450 41.802 -0.352 25768 70 1 . 1 1 19 19 ASP H H 19 8.330 8.330 8.244 0.086 25768 71 1 . 1 1 20 20 ASP N N 20 121.990 121.990 120.655 1.335 25768 72 1 . 1 1 20 20 ASP C C 20 176.760 176.760 176.591 0.169 25768 73 1 . 1 1 20 20 ASP CA C 20 54.470 54.470 55.299 -0.830 25768 74 1 . 1 1 20 20 ASP CB C 20 41.310 41.310 41.465 -0.155 25768 75 1 . 1 1 20 20 ASP H H 20 8.240 8.240 8.387 -0.147 25768 76 1 . 1 1 21 21 SER N N 21 117.050 117.050 114.205 2.845 25768 77 1 . 1 1 21 21 SER C C 21 175.170 175.170 173.788 1.382 25768 78 1 . 1 1 21 21 SER CA C 21 59.490 59.490 58.476 1.014 25768 79 1 . 1 1 21 21 SER CB C 21 64.080 64.080 63.457 0.623 25768 80 1 . 1 1 21 21 SER H H 21 8.360 8.360 8.120 0.240 25768 81 1 . 1 1 22 22 SER N N 22 117.820 117.820 118.093 -0.273 25768 82 1 . 1 1 22 22 SER C C 22 174.940 174.940 173.907 1.033 25768 83 1 . 1 1 22 22 SER CA C 22 59.160 59.160 58.329 0.831 25768 84 1 . 1 1 22 22 SER CB C 22 64.110 64.110 63.855 0.255 25768 85 1 . 1 1 22 22 SER H H 22 8.310 8.310 8.317 -0.007 25768 86 1 . 1 1 23 23 SER N N 23 117.660 117.660 117.598 0.062 25768 87 1 . 1 1 23 23 SER C C 23 174.340 174.340 173.685 0.655 25768 88 1 . 1 1 23 23 SER CA C 23 59.050 59.050 58.388 0.662 25768 89 1 . 1 1 23 23 SER CB C 23 64.210 64.210 63.935 0.275 25768 90 1 . 1 1 23 23 SER H H 23 8.120 8.120 8.261 -0.141 25768 91 1 . 1 1 24 24 ASP N N 24 122.590 122.590 122.283 0.307 25768 92 1 . 1 1 24 24 ASP C C 24 176.250 176.250 175.337 0.913 25768 93 1 . 1 1 24 24 ASP CA C 24 54.910 54.910 54.475 0.435 25768 94 1 . 1 1 24 24 ASP CB C 24 41.270 41.270 41.552 -0.282 25768 95 1 . 1 1 24 24 ASP H H 24 8.230 8.230 8.400 -0.170 25768 96 1 . 1 1 25 25 ILE N N 25 120.650 120.650 119.281 1.369 25768 97 1 . 1 1 25 25 ILE C C 25 176.190 176.190 175.411 0.779 25768 98 1 . 1 1 25 25 ILE CA C 25 61.880 61.880 61.086 0.794 25768 99 1 . 1 1 25 25 ILE CB C 25 38.730 38.730 38.777 -0.047 25768 100 1 . 1 1 25 25 ILE H H 25 7.860 7.860 8.052 -0.192 25768 101 1 . 1 1 26 26 LYS N N 26 124.420 124.420 123.998 0.422 25768 102 1 . 1 1 26 26 LYS C C 26 176.640 176.640 175.718 0.922 25768 103 1 . 1 1 26 26 LYS CA C 26 56.520 56.520 56.027 0.493 25768 104 1 . 1 1 26 26 LYS CB C 26 32.890 32.890 33.373 -0.483 25768 105 1 . 1 1 26 26 LYS H H 26 8.140 8.140 8.192 -0.052 25768 106 1 . 1 1 27 27 LEU N N 27 123.120 123.120 121.789 1.331 25768 107 1 . 1 1 27 27 LEU C C 27 177.110 177.110 176.154 0.956 25768 108 1 . 1 1 27 27 LEU CA C 27 55.590 55.590 55.232 0.358 25768 109 1 . 1 1 27 27 LEU CB C 27 42.500 42.500 42.447 0.053 25768 110 1 . 1 1 27 27 LEU H H 27 8.080 8.080 8.324 -0.244 25768 111 1 . 1 1 28 28 ASP N N 28 120.850 120.850 120.940 -0.090 25768 112 1 . 1 1 28 28 ASP C C 28 176.960 176.960 176.159 0.801 25768 113 1 . 1 1 28 28 ASP CA C 28 54.800 54.800 54.392 0.408 25768 114 1 . 1 1 28 28 ASP CB C 28 41.380 41.380 41.516 -0.136 25768 115 1 . 1 1 28 28 ASP H H 28 8.180 8.180 8.353 -0.173 25768 116 1 . 1 1 29 29 GLY N N 29 109.800 109.800 109.018 0.782 25768 117 1 . 1 1 29 29 GLY C C 29 174.370 174.370 173.678 0.692 25768 118 1 . 1 1 29 29 GLY CA C 29 46.150 46.150 45.003 1.147 25768 119 1 . 1 1 29 29 GLY H H 29 8.230 8.230 8.194 0.036 25768 120 1 . 1 1 30 30 ALA N N 30 123.880 123.880 123.407 0.473 25768 121 1 . 1 1 30 30 ALA C C 30 178.040 178.040 176.977 1.063 25768 122 1 . 1 1 30 30 ALA CA C 30 53.140 53.140 52.230 0.910 25768 123 1 . 1 1 30 30 ALA CB C 30 19.350 19.350 19.670 -0.320 25768 124 1 . 1 1 30 30 ALA H H 30 8.040 8.040 8.132 -0.092 25768 125 1 . 1 1 31 31 LYS N N 31 119.800 119.800 121.209 -1.409 25768 126 1 . 1 1 31 31 LYS C C 31 176.770 176.770 175.761 1.008 25768 127 1 . 1 1 31 31 LYS CA C 31 56.870 56.870 56.010 0.860 25768 128 1 . 1 1 31 31 LYS CB C 31 32.980 32.980 32.850 0.130 25768 129 1 . 1 1 31 31 LYS H H 31 8.060 8.060 8.199 -0.139 25768 130 1 . 1 1 32 32 GLN N N 32 120.930 120.930 121.133 -0.203 25768 131 1 . 1 1 32 32 GLN C C 32 176.000 176.000 175.492 0.508 25768 132 1 . 1 1 32 32 GLN CA C 32 56.280 56.280 56.085 0.195 25768 133 1 . 1 1 32 32 GLN CB C 32 29.580 29.580 29.551 0.029 25768 134 1 . 1 1 32 32 GLN H H 32 8.170 8.170 8.454 -0.284 25768 135 1 . 1 1 33 33 ARG N N 33 122.370 122.370 122.076 0.294 25768 136 1 . 1 1 33 33 ARG C C 33 176.820 176.820 176.000 0.820 25768 137 1 . 1 1 33 33 ARG CA C 33 56.680 56.680 56.213 0.467 25768 138 1 . 1 1 33 33 ARG CB C 33 31.040 31.040 31.070 -0.029 25768 139 1 . 1 1 33 33 ARG H H 33 8.270 8.270 8.563 -0.293 25768 140 1 . 1 1 34 34 GLY N N 34 110.210 110.210 109.153 1.057 25768 141 1 . 1 1 34 34 GLY C C 34 174.280 174.280 173.913 0.367 25768 142 1 . 1 1 34 34 GLY CA C 34 45.770 45.770 44.924 0.846 25768 143 1 . 1 1 34 34 GLY H H 34 8.360 8.360 8.280 0.080 25768 144 1 . 1 1 35 35 THR N N 35 114.100 114.100 113.573 0.527 25768 145 1 . 1 1 35 35 THR C C 35 174.550 174.550 174.197 0.353 25768 146 1 . 1 1 35 35 THR CA C 35 62.140 62.140 62.314 -0.174 25768 147 1 . 1 1 35 35 THR CB C 35 70.330 70.330 69.488 0.842 25768 148 1 . 1 1 35 35 THR H H 35 7.970 7.970 8.004 -0.034 25768 149 1 . 1 1 36 36 LYS N N 36 123.850 123.850 123.025 0.825 25768 150 1 . 1 1 36 36 LYS C C 36 176.040 176.040 175.688 0.352 25768 151 1 . 1 1 36 36 LYS CA C 36 56.600 56.600 56.235 0.365 25768 152 1 . 1 1 36 36 LYS CB C 36 33.280 33.280 33.134 0.146 25768 153 1 . 1 1 36 36 LYS H H 36 8.230 8.230 8.302 -0.072 25768 154 1 . 1 1 37 37 ALA N N 37 125.650 125.650 124.927 0.723 25768 155 1 . 1 1 37 37 ALA C C 37 177.570 177.570 176.866 0.704 25768 156 1 . 1 1 37 37 ALA CA C 37 52.860 52.860 52.446 0.414 25768 157 1 . 1 1 37 37 ALA CB C 37 19.610 19.610 19.363 0.247 25768 158 1 . 1 1 37 37 ALA H H 37 8.290 8.290 8.322 -0.032 25768 159 1 . 1 1 38 38 THR N N 38 113.350 113.350 113.508 -0.158 25768 160 1 . 1 1 38 38 THR C C 38 174.540 174.540 174.455 0.085 25768 161 1 . 1 1 38 38 THR CA C 38 62.010 62.010 62.410 -0.400 25768 162 1 . 1 1 38 38 THR CB C 38 70.350 70.350 69.232 1.118 25768 163 1 . 1 1 38 38 THR H H 38 7.970 7.970 7.927 0.043 25768 164 1 . 1 1 39 39 VAL N N 39 120.790 120.790 121.072 -0.282 25768 165 1 . 1 1 39 39 VAL C C 39 175.620 175.620 175.430 0.190 25768 166 1 . 1 1 39 39 VAL CA C 39 62.470 62.470 62.418 0.052 25768 167 1 . 1 1 39 39 VAL CB C 39 32.940 32.940 32.428 0.512 25768 168 1 . 1 1 39 39 VAL H H 39 8.020 8.020 8.222 -0.202 25768 169 1 . 1 1 40 40 ASP N N 40 123.690 123.690 121.474 2.216 25768 170 1 . 1 1 40 40 ASP C C 40 176.190 176.190 176.037 0.153 25768 171 1 . 1 1 40 40 ASP CA C 40 54.780 54.780 54.423 0.358 25768 172 1 . 1 1 40 40 ASP CB C 40 41.590 41.590 41.201 0.389 25768 173 1 . 1 1 40 40 ASP H H 40 8.310 8.310 8.237 0.073 25768 174 1 . 1 1 41 41 SER N N 41 115.470 115.470 116.956 -1.486 25768 175 1 . 1 1 41 41 SER C C 41 174.170 174.170 174.590 -0.420 25768 176 1 . 1 1 41 41 SER CA C 41 59.000 59.000 59.265 -0.265 25768 177 1 . 1 1 41 41 SER CB C 41 64.420 64.420 63.914 0.506 25768 178 1 . 1 1 41 41 SER H H 41 8.130 8.130 8.461 -0.331 25768 179 1 . 1 1 42 42 ASP N N 42 122.430 122.430 120.746 1.684 25768 180 1 . 1 1 42 42 ASP C C 42 175.740 175.740 175.008 0.732 25768 181 1 . 1 1 42 42 ASP CA C 42 54.780 54.780 54.609 0.171 25768 182 1 . 1 1 42 42 ASP CB C 42 41.620 41.620 40.934 0.686 25768 183 1 . 1 1 42 42 ASP H H 42 8.410 8.410 8.301 0.109 25768 184 1 . 1 1 43 43 THR N N 43 117.580 117.580 114.250 3.330 25768 185 1 . 1 1 43 43 THR C C 43 173.630 173.630 173.750 -0.120 25768 186 1 . 1 1 43 43 THR CA C 43 63.120 63.120 61.470 1.650 25768 187 1 . 1 1 43 43 THR CB C 43 70.650 70.650 70.173 0.477 25768 188 1 . 1 1 43 43 THR H H 43 8.010 8.010 7.974 0.036 25768 189 1 . 1 1 44 44 GLN N N 44 125.420 125.420 122.878 2.542 25768 190 1 . 1 1 44 44 GLN C C 44 174.080 174.080 174.804 -0.724 25768 191 1 . 1 1 44 44 GLN CA C 44 55.110 55.110 54.868 0.242 25768 192 1 . 1 1 44 44 GLN CB C 44 31.570 31.570 30.824 0.746 25768 193 1 . 1 1 44 44 GLN H H 44 9.260 9.260 8.461 0.799 25768 194 1 . 1 1 45 45 LEU N N 45 124.190 124.190 125.270 -1.080 25768 195 1 . 1 1 45 45 LEU C C 45 175.970 175.970 176.631 -0.660 25768 196 1 . 1 1 45 45 LEU CA C 45 54.690 54.690 55.135 -0.445 25768 197 1 . 1 1 45 45 LEU CB C 45 42.270 42.270 42.583 -0.313 25768 198 1 . 1 1 45 45 LEU H H 45 8.550 8.550 8.423 0.127 25768 199 1 . 1 1 46 46 GLY N N 46 113.310 113.310 112.700 0.610 25768 200 1 . 1 1 46 46 GLY C C 46 171.180 171.180 172.784 -1.604 25768 201 1 . 1 1 46 46 GLY CA C 46 44.400 44.400 44.347 0.054 25768 202 1 . 1 1 46 46 GLY H H 46 8.810 8.810 8.316 0.494 25768 203 1 . 1 1 47 47 LEU N N 47 123.890 123.890 127.758 -3.868 25768 204 1 . 1 1 47 47 LEU C C 47 175.400 175.400 175.284 0.116 25768 205 1 . 1 1 47 47 LEU CA C 47 53.750 53.750 54.083 -0.333 25768 206 1 . 1 1 47 47 LEU CB C 47 46.800 46.800 45.146 1.654 25768 207 1 . 1 1 47 47 LEU H H 47 8.590 8.590 8.489 0.101 25768 208 1 . 1 1 48 48 THR N N 48 111.210 111.210 116.444 -5.234 25768 209 1 . 1 1 48 48 THR C C 48 172.520 172.520 172.939 -0.419 25768 210 1 . 1 1 48 48 THR CA C 48 58.950 58.950 60.665 -1.715 25768 211 1 . 1 1 48 48 THR CB C 48 72.360 72.360 71.739 0.621 25768 212 1 . 1 1 48 48 THR H H 48 8.620 8.620 8.564 0.056 25768 213 1 . 1 1 49 49 PHE N N 49 118.810 118.810 124.026 -5.216 25768 214 1 . 1 1 49 49 PHE C C 49 174.700 174.700 175.304 -0.604 25768 215 1 . 1 1 49 49 PHE CA C 49 55.080 55.080 56.404 -1.324 25768 216 1 . 1 1 49 49 PHE CB C 49 42.360 42.360 41.441 0.919 25768 217 1 . 1 1 49 49 PHE H H 49 8.410 8.410 8.449 -0.039 25768 218 1 . 1 1 50 50 THR N N 50 121.230 121.230 121.036 0.194 25768 219 1 . 1 1 50 50 THR C C 50 173.250 173.250 173.235 0.015 25768 220 1 . 1 1 50 50 THR CA C 50 62.740 62.740 61.604 1.136 25768 221 1 . 1 1 50 50 THR CB C 50 73.740 73.740 69.895 3.845 25768 222 1 . 1 1 50 50 THR H H 50 9.330 9.330 8.598 0.732 25768 223 1 . 1 1 51 51 TYR N N 51 126.010 126.010 126.858 -0.848 25768 224 1 . 1 1 51 51 TYR C C 51 174.850 174.850 175.011 -0.161 25768 225 1 . 1 1 51 51 TYR CA C 51 56.240 56.240 56.480 -0.240 25768 226 1 . 1 1 51 51 TYR CB C 51 41.630 41.630 39.813 1.817 25768 227 1 . 1 1 51 51 TYR H H 51 9.150 9.150 9.244 -0.094 25768 228 1 . 1 1 52 52 MET N N 52 127.390 127.390 124.865 2.525 25768 229 1 . 1 1 52 52 MET C C 52 174.490 174.490 174.545 -0.055 25768 230 1 . 1 1 52 52 MET CA C 52 52.450 52.450 56.231 -3.781 25768 231 1 . 1 1 52 52 MET CB C 52 28.590 28.590 33.372 -4.782 25768 232 1 . 1 1 52 52 MET H H 52 7.950 7.950 8.312 -0.362 25768 233 1 . 1 1 53 53 PHE N N 53 123.830 123.830 126.475 -2.645 25768 234 1 . 1 1 53 53 PHE C C 53 173.720 173.720 173.868 -0.148 25768 235 1 . 1 1 53 53 PHE CA C 53 57.110 57.110 56.820 0.290 25768 236 1 . 1 1 53 53 PHE CB C 53 39.420 39.420 41.122 -1.702 25768 237 1 . 1 1 53 53 PHE H H 53 7.720 7.720 8.387 -0.667 25768 238 1 . 1 1 54 54 ALA N N 54 125.650 125.650 127.924 -2.274 25768 239 1 . 1 1 54 54 ALA C C 54 175.020 175.020 175.857 -0.837 25768 240 1 . 1 1 54 54 ALA CA C 54 50.740 50.740 52.958 -2.218 25768 241 1 . 1 1 54 54 ALA CB C 54 22.700 22.700 18.670 4.030 25768 242 1 . 1 1 54 54 ALA H H 54 8.360 8.360 8.195 0.165 25768 243 1 . 1 1 55 55 ASP N N 55 118.790 118.790 120.528 -1.738 25768 244 1 . 1 1 55 55 ASP C C 55 174.780 174.780 175.826 -1.046 25768 245 1 . 1 1 55 55 ASP CA C 55 58.590 58.590 54.623 3.967 25768 246 1 . 1 1 55 55 ASP CB C 55 40.430 40.430 40.228 0.202 25768 247 1 . 1 1 55 55 ASP H H 55 8.590 8.590 8.568 0.022 25768 248 1 . 1 1 56 56 LYS N N 56 106.200 106.200 116.850 -10.650 25768 249 1 . 1 1 56 56 LYS C C 56 174.940 174.940 175.157 -0.217 25768 250 1 . 1 1 56 56 LYS CA C 56 55.260 55.260 56.622 -1.362 25768 251 1 . 1 1 56 56 LYS CB C 56 34.510 34.510 34.856 -0.346 25768 252 1 . 1 1 56 56 LYS H H 56 7.260 7.260 7.356 -0.096 25768 253 1 . 1 1 57 57 TRP N N 57 115.680 115.680 121.602 -5.922 25768 254 1 . 1 1 57 57 TRP C C 57 173.940 173.940 175.498 -1.558 25768 255 1 . 1 1 57 57 TRP CA C 57 55.410 55.410 57.400 -1.990 25768 256 1 . 1 1 57 57 TRP CB C 57 34.470 34.470 31.851 2.620 25768 257 1 . 1 1 57 57 TRP H H 57 6.570 6.570 8.122 -1.553 25768 258 1 . 1 1 58 58 GLY N N 58 107.610 107.610 108.958 -1.348 25768 259 1 . 1 1 58 58 GLY C C 58 172.730 172.730 172.027 0.703 25768 260 1 . 1 1 58 58 GLY CA C 58 45.050 45.050 45.562 -0.512 25768 261 1 . 1 1 58 58 GLY H H 58 9.260 9.260 8.254 1.006 25768 262 1 . 1 1 59 59 VAL N N 59 118.130 118.130 121.762 -3.632 25768 263 1 . 1 1 59 59 VAL C C 59 173.000 173.000 174.163 -1.163 25768 264 1 . 1 1 59 59 VAL CA C 59 59.950 59.950 60.360 -0.410 25768 265 1 . 1 1 59 59 VAL CB C 59 35.170 35.170 34.249 0.921 25768 266 1 . 1 1 59 59 VAL H H 59 9.030 9.030 8.281 0.749 25768 267 1 . 1 1 60 60 GLU N N 60 127.900 127.900 124.900 3.000 25768 268 1 . 1 1 60 60 GLU C C 60 174.470 174.470 174.582 -0.112 25768 269 1 . 1 1 60 60 GLU CA C 60 52.940 52.940 54.503 -1.563 25768 270 1 . 1 1 60 60 GLU CB C 60 35.100 35.100 33.940 1.160 25768 271 1 . 1 1 60 60 GLU H H 60 9.440 9.440 8.664 0.776 25768 272 1 . 1 1 61 61 LEU N N 61 127.410 127.410 124.044 3.366 25768 273 1 . 1 1 61 61 LEU C C 61 174.950 174.950 175.364 -0.414 25768 274 1 . 1 1 61 61 LEU CA C 61 53.390 53.390 53.940 -0.550 25768 275 1 . 1 1 61 61 LEU CB C 61 45.980 45.980 45.112 0.868 25768 276 1 . 1 1 61 61 LEU H H 61 8.740 8.740 8.393 0.347 25768 277 1 . 1 1 62 62 VAL N N 62 125.750 125.750 120.414 5.336 25768 278 1 . 1 1 62 62 VAL C C 62 173.960 173.960 174.365 -0.405 25768 279 1 . 1 1 62 62 VAL CA C 62 61.350 61.350 60.337 1.013 25768 280 1 . 1 1 62 62 VAL CB C 62 34.740 34.740 34.246 0.494 25768 281 1 . 1 1 62 62 VAL H H 62 8.790 8.790 8.124 0.666 25768 282 1 . 1 1 63 63 ALA N N 63 127.230 127.230 126.420 0.810 25768 283 1 . 1 1 63 63 ALA C C 63 173.930 173.930 175.017 -1.087 25768 284 1 . 1 1 63 63 ALA CA C 63 51.140 51.140 51.773 -0.633 25768 285 1 . 1 1 63 63 ALA CB C 63 22.500 22.500 21.922 0.578 25768 286 1 . 1 1 63 63 ALA H H 63 8.740 8.740 8.313 0.427 25768 287 1 . 1 1 64 64 ALA N N 64 120.410 120.410 124.299 -3.889 25768 288 1 . 1 1 64 64 ALA C C 64 176.770 176.770 176.826 -0.056 25768 289 1 . 1 1 64 64 ALA CA C 64 51.420 51.420 50.688 0.732 25768 290 1 . 1 1 64 64 ALA CB C 64 22.590 22.590 21.899 0.691 25768 291 1 . 1 1 64 64 ALA H H 64 8.290 8.290 8.301 -0.011 25768 292 1 . 1 1 65 65 THR N N 65 116.130 116.130 114.640 1.490 25768 293 1 . 1 1 65 65 THR C C 65 171.220 171.220 173.027 -1.807 25768 294 1 . 1 1 65 65 THR CA C 65 58.860 58.860 59.381 -0.521 25768 295 1 . 1 1 65 65 THR CB C 65 72.020 72.020 68.898 3.122 25768 296 1 . 1 1 65 65 THR H H 65 8.760 8.760 8.251 0.509 25768 297 1 . 1 1 66 66 PRO C C 66 176.720 176.720 176.146 0.574 25768 298 1 . 1 1 66 66 PRO CA C 66 63.610 63.610 63.187 0.423 25768 299 1 . 1 1 66 66 PRO CB C 66 32.550 32.550 31.979 0.570 25768 300 1 . 1 1 67 67 PHE N N 67 120.360 120.360 118.254 2.106 25768 301 1 . 1 1 67 67 PHE C C 67 175.480 175.480 174.833 0.647 25768 302 1 . 1 1 67 67 PHE CA C 67 58.840 58.840 57.956 0.884 25768 303 1 . 1 1 67 67 PHE CB C 67 40.170 40.170 39.957 0.213 25768 304 1 . 1 1 67 67 PHE H H 67 8.590 8.590 8.079 0.511 25768 305 1 . 1 1 68 68 ASN N N 68 119.030 119.030 120.576 -1.546 25768 306 1 . 1 1 68 68 ASN C C 68 174.740 174.740 174.348 0.392 25768 307 1 . 1 1 68 68 ASN CA C 68 53.430 53.430 53.200 0.230 25768 308 1 . 1 1 68 68 ASN CB C 68 39.420 39.420 39.647 -0.227 25768 309 1 . 1 1 68 68 ASN H H 68 8.340 8.340 8.397 -0.057 25768 310 1 . 1 1 69 69 HIS N N 69 119.590 119.590 119.544 0.046 25768 311 1 . 1 1 69 69 HIS C C 69 174.370 174.370 174.739 -0.369 25768 312 1 . 1 1 69 69 HIS CA C 69 55.950 55.950 56.234 -0.284 25768 313 1 . 1 1 69 69 HIS CB C 69 29.960 29.960 30.803 -0.843 25768 314 1 . 1 1 69 69 HIS H H 69 8.350 8.350 8.422 -0.072 25768 315 1 . 1 1 70 70 GLN N N 70 121.980 121.980 121.457 0.523 25768 316 1 . 1 1 70 70 GLN C C 70 175.740 175.740 175.159 0.581 25768 317 1 . 1 1 70 70 GLN CA C 70 56.340 56.340 55.925 0.415 25768 318 1 . 1 1 70 70 GLN CB C 70 29.660 29.660 29.782 -0.122 25768 319 1 . 1 1 70 70 GLN H H 70 8.350 8.350 8.460 -0.110 25768 320 1 . 1 1 71 71 VAL N N 71 120.530 120.530 120.061 0.469 25768 321 1 . 1 1 71 71 VAL C C 71 175.500 175.500 174.930 0.569 25768 322 1 . 1 1 71 71 VAL CA C 71 62.540 62.540 62.357 0.183 25768 323 1 . 1 1 71 71 VAL CB C 71 33.090 33.090 32.358 0.732 25768 324 1 . 1 1 71 71 VAL H H 71 8.020 8.020 8.203 -0.183 25768 325 1 . 1 1 72 72 ASP N N 72 123.910 123.910 124.140 -0.230 25768 326 1 . 1 1 72 72 ASP C C 72 176.300 176.300 176.073 0.227 25768 327 1 . 1 1 72 72 ASP CA C 72 54.340 54.340 54.110 0.230 25768 328 1 . 1 1 72 72 ASP CB C 72 41.480 41.480 41.961 -0.481 25768 329 1 . 1 1 72 72 ASP H H 72 8.280 8.280 8.283 -0.003 25768 330 1 . 1 1 73 73 VAL N N 73 120.580 120.580 118.644 1.936 25768 331 1 . 1 1 73 73 VAL C C 73 176.350 176.350 175.559 0.791 25768 332 1 . 1 1 73 73 VAL CA C 73 62.970 62.970 62.943 0.027 25768 333 1 . 1 1 73 73 VAL CB C 73 32.550 32.550 32.318 0.232 25768 334 1 . 1 1 73 73 VAL H H 73 7.960 7.960 8.243 -0.283 25768 335 1 . 1 1 74 74 LYS N N 74 123.620 123.620 121.686 1.934 25768 336 1 . 1 1 74 74 LYS C C 74 177.130 177.130 176.211 0.919 25768 337 1 . 1 1 74 74 LYS CA C 74 57.060 57.060 56.293 0.767 25768 338 1 . 1 1 74 74 LYS CB C 74 32.860 32.860 33.164 -0.304 25768 339 1 . 1 1 74 74 LYS H H 74 8.230 8.230 7.961 0.269 25768 340 1 . 1 1 75 75 GLY N N 75 109.370 109.370 110.660 -1.290 25768 341 1 . 1 1 75 75 GLY C C 75 174.030 174.030 174.039 -0.009 25768 342 1 . 1 1 75 75 GLY CA C 75 45.800 45.800 45.073 0.727 25768 343 1 . 1 1 75 75 GLY H H 75 8.160 8.160 8.367 -0.207 25768 344 1 . 1 1 76 76 LEU N N 76 121.660 121.660 121.807 -0.147 25768 345 1 . 1 1 76 76 LEU C C 76 177.410 177.410 176.995 0.415 25768 346 1 . 1 1 76 76 LEU CA C 76 55.410 55.410 55.218 0.192 25768 347 1 . 1 1 76 76 LEU CB C 76 42.790 42.790 42.581 0.209 25768 348 1 . 1 1 76 76 LEU H H 76 8.030 8.030 8.096 -0.067 25768 349 1 . 1 1 77 77 GLY N N 77 109.330 109.330 110.026 -0.696 25768 350 1 . 1 1 77 77 GLY C C 77 171.800 171.800 172.736 -0.936 25768 351 1 . 1 1 77 77 GLY CA C 77 44.990 44.990 44.443 0.547 25768 352 1 . 1 1 77 77 GLY H H 77 8.100 8.100 8.247 -0.148 25768 353 1 . 1 1 78 78 PRO C C 78 177.740 177.740 176.931 0.809 25768 354 1 . 1 1 78 78 PRO CA C 78 63.890 63.890 63.144 0.746 25768 355 1 . 1 1 78 78 PRO CB C 78 32.170 32.170 32.021 0.149 25768 356 1 . 1 1 79 79 GLY N N 79 109.530 109.530 109.001 0.529 25768 357 1 . 1 1 79 79 GLY C C 79 174.460 174.460 173.732 0.728 25768 358 1 . 1 1 79 79 GLY CA C 79 45.780 45.780 44.767 1.013 25768 359 1 . 1 1 79 79 GLY H H 79 8.410 8.410 8.294 0.116 25768 360 1 . 1 1 80 80 LEU N N 80 121.880 121.880 120.871 1.009 25768 361 1 . 1 1 80 80 LEU C C 80 177.100 177.100 176.263 0.837 25768 362 1 . 1 1 80 80 LEU CA C 80 55.720 55.720 55.034 0.686 25768 363 1 . 1 1 80 80 LEU CB C 80 42.580 42.580 43.114 -0.534 25768 364 1 . 1 1 80 80 LEU H H 80 8.010 8.010 8.109 -0.098 25768 365 1 . 1 1 81 81 ASP N N 81 119.990 119.990 120.757 -0.767 25768 366 1 . 1 1 81 81 ASP C C 81 176.880 176.880 176.081 0.799 25768 367 1 . 1 1 81 81 ASP CA C 81 54.770 54.770 54.240 0.530 25768 368 1 . 1 1 81 81 ASP CB C 81 41.390 41.390 41.801 -0.411 25768 369 1 . 1 1 81 81 ASP H H 81 8.220 8.220 8.403 -0.183 25768 370 1 . 1 1 82 82 GLY N N 82 109.270 109.270 109.030 0.240 25768 371 1 . 1 1 82 82 GLY C C 82 174.190 174.190 173.980 0.210 25768 372 1 . 1 1 82 82 GLY CA C 82 45.990 45.990 44.884 1.106 25768 373 1 . 1 1 82 82 GLY H H 82 8.170 8.170 8.189 -0.019 25768 374 1 . 1 1 83 83 LYS N N 83 121.000 121.000 120.129 0.871 25768 375 1 . 1 1 83 83 LYS C C 83 176.610 176.610 176.297 0.313 25768 376 1 . 1 1 83 83 LYS CA C 83 56.620 56.620 56.408 0.212 25768 377 1 . 1 1 83 83 LYS CB C 83 33.020 33.020 32.984 0.036 25768 378 1 . 1 1 83 83 LYS H H 83 7.970 7.970 8.188 -0.218 25768 379 1 . 1 1 84 84 LEU N N 84 123.120 123.120 121.617 1.503 25768 380 1 . 1 1 84 84 LEU C C 84 176.920 176.920 176.097 0.823 25768 381 1 . 1 1 84 84 LEU CA C 84 55.550 55.550 55.058 0.492 25768 382 1 . 1 1 84 84 LEU CB C 84 42.430 42.430 42.358 0.072 25768 383 1 . 1 1 84 84 LEU H H 84 8.130 8.130 8.241 -0.111 25768 384 1 . 1 1 85 85 ALA N N 85 123.930 123.930 123.865 0.065 25768 385 1 . 1 1 85 85 ALA C C 85 177.060 177.060 176.754 0.306 25768 386 1 . 1 1 85 85 ALA CA C 85 52.790 52.790 51.938 0.852 25768 387 1 . 1 1 85 85 ALA CB C 85 19.670 19.670 19.496 0.174 25768 388 1 . 1 1 85 85 ALA H H 85 8.040 8.040 8.022 0.018 25768 389 1 . 1 1 86 86 ASP N N 86 119.760 119.760 120.863 -1.103 25768 390 1 . 1 1 86 86 ASP C C 86 175.820 175.820 175.736 0.084 25768 391 1 . 1 1 86 86 ASP CA C 86 54.520 54.520 54.117 0.403 25768 392 1 . 1 1 86 86 ASP CB C 86 41.390 41.390 41.619 -0.229 25768 393 1 . 1 1 86 86 ASP H H 86 8.110 8.110 8.424 -0.314 25768 394 1 . 1 1 87 87 ILE N N 87 120.620 120.620 118.349 2.271 25768 395 1 . 1 1 87 87 ILE C C 87 175.740 175.740 175.384 0.356 25768 396 1 . 1 1 87 87 ILE CA C 87 61.160 61.160 61.441 -0.281 25768 397 1 . 1 1 87 87 ILE CB C 87 39.260 39.260 38.957 0.303 25768 398 1 . 1 1 87 87 ILE H H 87 7.800 7.800 8.062 -0.262 25768 399 1 . 1 1 88 88 LYS N N 88 125.820 125.820 123.401 2.419 25768 400 1 . 1 1 88 88 LYS C C 88 175.340 175.340 175.778 -0.438 25768 401 1 . 1 1 88 88 LYS CA C 88 56.300 56.300 56.071 0.229 25768 402 1 . 1 1 88 88 LYS CB C 88 32.900 32.900 33.588 -0.688 25768 403 1 . 1 1 88 88 LYS H H 88 8.250 8.250 8.295 -0.045 25768 404 1 . 1 1 89 89 GLN N N 89 121.750 121.750 121.251 0.499 25768 405 1 . 1 1 89 89 GLN C C 89 175.000 175.000 175.188 -0.188 25768 406 1 . 1 1 89 89 GLN CA C 89 55.210 55.210 55.532 -0.322 25768 407 1 . 1 1 89 89 GLN CB C 89 30.570 30.570 29.698 0.872 25768 408 1 . 1 1 89 89 GLN H H 89 8.000 8.000 8.270 -0.270 25768 409 1 . 1 1 90 90 LEU N N 90 126.660 126.660 125.245 1.415 25768 410 1 . 1 1 90 90 LEU C C 90 174.240 174.240 175.329 -1.089 25768 411 1 . 1 1 90 90 LEU CA C 90 52.720 52.720 52.929 -0.209 25768 412 1 . 1 1 90 90 LEU CB C 90 42.350 42.350 42.189 0.161 25768 413 1 . 1 1 90 90 LEU H H 90 8.630 8.630 8.368 0.262 25768 414 1 . 1 1 92 92 PRO C C 92 173.900 173.900 176.572 -2.672 25768 415 1 . 1 1 92 92 PRO CA C 92 63.320 63.320 62.750 0.570 25768 416 1 . 1 1 92 92 PRO CB C 92 31.920 31.920 32.566 -0.647 25768 417 1 . 1 1 93 93 THR N N 93 119.770 119.770 116.408 3.362 25768 418 1 . 1 1 93 93 THR C C 93 171.360 171.360 173.658 -2.298 25768 419 1 . 1 1 93 93 THR CA C 93 62.610 62.610 62.059 0.551 25768 420 1 . 1 1 93 93 THR CB C 93 72.680 72.680 70.218 2.461 25768 421 1 . 1 1 93 93 THR H H 93 8.290 8.290 8.282 0.008 25768 422 1 . 1 1 94 94 LEU N N 94 128.880 128.880 126.566 2.314 25768 423 1 . 1 1 94 94 LEU C C 94 175.130 175.130 174.787 0.343 25768 424 1 . 1 1 94 94 LEU CA C 94 53.520 53.520 54.294 -0.774 25768 425 1 . 1 1 94 94 LEU CB C 94 46.140 46.140 44.143 1.997 25768 426 1 . 1 1 94 94 LEU H H 94 8.680 8.680 8.667 0.013 25768 427 1 . 1 1 95 95 LEU N N 95 123.630 123.630 122.786 0.844 25768 428 1 . 1 1 95 95 LEU C C 95 175.540 175.540 174.850 0.690 25768 429 1 . 1 1 95 95 LEU CA C 95 55.190 55.190 53.910 1.280 25768 430 1 . 1 1 95 95 LEU CB C 95 45.300 45.300 45.885 -0.585 25768 431 1 . 1 1 95 95 LEU H H 95 9.580 9.580 8.461 1.119 25768 432 1 . 1 1 96 96 LEU N N 96 123.150 123.150 123.473 -0.323 25768 433 1 . 1 1 96 96 LEU C C 96 174.960 174.960 175.268 -0.308 25768 434 1 . 1 1 96 96 LEU CA C 96 54.420 54.420 54.469 -0.049 25768 435 1 . 1 1 96 96 LEU CB C 96 44.560 44.560 43.813 0.747 25768 436 1 . 1 1 96 96 LEU H H 96 8.770 8.770 8.797 -0.027 25768 437 1 . 1 1 97 97 GLN N N 97 121.290 121.290 121.964 -0.674 25768 438 1 . 1 1 97 97 GLN C C 97 174.380 174.380 174.080 0.300 25768 439 1 . 1 1 97 97 GLN CA C 97 54.740 54.740 54.298 0.442 25768 440 1 . 1 1 97 97 GLN CB C 97 36.600 36.600 32.476 4.124 25768 441 1 . 1 1 97 97 GLN H H 97 9.480 9.480 8.681 0.799 25768 442 1 . 1 1 98 98 TYR N N 98 122.250 122.250 121.525 0.725 25768 443 1 . 1 1 98 98 TYR C C 98 173.460 173.460 174.368 -0.908 25768 444 1 . 1 1 98 98 TYR CA C 98 55.160 55.160 56.078 -0.918 25768 445 1 . 1 1 98 98 TYR CB C 98 42.420 42.420 42.250 0.170 25768 446 1 . 1 1 98 98 TYR H H 98 9.010 9.010 8.591 0.418 25768 447 1 . 1 1 99 99 TYR N N 99 126.860 126.860 122.882 3.978 25768 448 1 . 1 1 99 99 TYR C C 99 175.380 175.380 174.801 0.579 25768 449 1 . 1 1 99 99 TYR CA C 99 54.220 54.220 55.203 -0.983 25768 450 1 . 1 1 99 99 TYR CB C 99 38.890 38.890 37.843 1.047 25768 451 1 . 1 1 99 99 TYR H H 99 8.300 8.300 7.934 0.366 25768 452 1 . 1 1 100 100 PRO C C 100 178.330 178.330 177.032 1.298 25768 453 1 . 1 1 100 100 PRO CA C 100 64.750 64.750 64.893 -0.143 25768 454 1 . 1 1 100 100 PRO CB C 100 32.130 32.130 32.129 0.001 25768 455 1 . 1 1 101 101 MET N N 101 114.520 114.520 117.002 -2.482 25768 456 1 . 1 1 101 101 MET C C 101 178.240 178.240 175.663 2.577 25768 457 1 . 1 1 101 101 MET CA C 101 53.500 53.500 54.559 -1.059 25768 458 1 . 1 1 101 101 MET CB C 101 30.160 30.160 32.974 -2.814 25768 459 1 . 1 1 101 101 MET H H 101 9.390 9.390 7.978 1.412 25768 460 1 . 1 1 102 102 GLY N N 102 117.500 117.500 108.060 9.440 25768 461 1 . 1 1 102 102 GLY C C 102 175.690 175.690 174.458 1.232 25768 462 1 . 1 1 102 102 GLY CA C 102 46.760 46.760 45.263 1.497 25768 463 1 . 1 1 102 102 GLY H H 102 8.640 8.640 7.671 0.969 25768 464 1 . 1 1 103 103 GLY N N 103 111.030 111.030 111.397 -0.367 25768 465 1 . 1 1 103 103 GLY C C 103 174.070 174.070 173.835 0.235 25768 466 1 . 1 1 103 103 GLY CA C 103 46.140 46.140 45.002 1.138 25768 467 1 . 1 1 103 103 GLY H H 103 9.390 9.390 8.237 1.153 25768 468 1 . 1 1 104 104 THR N N 104 109.290 109.290 113.077 -3.787 25768 469 1 . 1 1 104 104 THR C C 104 174.290 174.290 174.223 0.067 25768 470 1 . 1 1 104 104 THR CA C 104 60.900 60.900 60.200 0.700 25768 471 1 . 1 1 104 104 THR CB C 104 72.070 72.070 70.364 1.705 25768 472 1 . 1 1 104 104 THR H H 104 7.290 7.290 7.743 -0.453 25768 473 1 . 1 1 105 105 ASN C C 105 175.050 175.050 174.821 0.229 25768 474 1 . 1 1 105 105 ASN CA C 105 52.880 52.880 53.002 -0.122 25768 475 1 . 1 1 105 105 ASN CB C 105 38.260 38.260 38.642 -0.382 25768 476 1 . 1 1 106 106 SER N N 106 113.000 113.000 116.252 -3.252 25768 477 1 . 1 1 106 106 SER C C 106 176.000 176.000 174.672 1.328 25768 478 1 . 1 1 106 106 SER CA C 106 58.700 58.700 58.028 0.672 25768 479 1 . 1 1 106 106 SER CB C 106 64.540 64.540 64.252 0.288 25768 480 1 . 1 1 106 106 SER H H 106 7.450 7.450 7.559 -0.109 25768 481 1 . 1 1 107 107 ALA N N 107 132.220 132.220 126.203 6.017 25768 482 1 . 1 1 107 107 ALA C C 107 176.610 176.610 177.168 -0.558 25768 483 1 . 1 1 107 107 ALA CA C 107 54.380 54.380 53.345 1.035 25768 484 1 . 1 1 107 107 ALA CB C 107 18.690 18.690 19.123 -0.433 25768 485 1 . 1 1 107 107 ALA H H 107 8.870 8.870 8.469 0.401 25768 486 1 . 1 1 108 108 PHE N N 108 116.050 116.050 116.934 -0.884 25768 487 1 . 1 1 108 108 PHE C C 108 174.270 174.270 175.180 -0.910 25768 488 1 . 1 1 108 108 PHE CA C 108 56.140 56.140 57.048 -0.908 25768 489 1 . 1 1 108 108 PHE CB C 108 40.520 40.520 39.905 0.615 25768 490 1 . 1 1 108 108 PHE H H 108 7.550 7.550 7.612 -0.062 25768 491 1 . 1 1 109 109 GLN N N 109 128.260 128.260 123.634 4.626 25768 492 1 . 1 1 109 109 GLN C C 109 172.300 172.300 173.960 -1.660 25768 493 1 . 1 1 109 109 GLN CA C 109 52.310 52.310 52.819 -0.509 25768 494 1 . 1 1 109 109 GLN CB C 109 29.050 29.050 30.005 -0.955 25768 495 1 . 1 1 109 109 GLN H H 109 9.060 9.060 8.600 0.460 25768 496 1 . 1 1 110 110 PRO C C 110 175.020 175.020 175.853 -0.833 25768 497 1 . 1 1 110 110 PRO CA C 110 61.550 61.550 62.466 -0.916 25768 498 1 . 1 1 110 110 PRO CB C 110 33.280 33.280 32.229 1.051 25768 499 1 . 1 1 111 111 TYR N N 111 115.730 115.730 118.011 -2.281 25768 500 1 . 1 1 111 111 TYR C C 111 173.850 173.850 174.360 -0.510 25768 501 1 . 1 1 111 111 TYR CA C 111 56.470 56.470 56.835 -0.364 25768 502 1 . 1 1 111 111 TYR CB C 111 38.650 38.650 40.727 -2.077 25768 503 1 . 1 1 111 111 TYR H H 111 8.500 8.500 8.105 0.395 25768 504 1 . 1 1 112 112 GLY N N 112 103.570 103.570 108.982 -5.412 25768 505 1 . 1 1 112 112 GLY C C 112 172.020 172.020 172.860 -0.840 25768 506 1 . 1 1 112 112 GLY CA C 112 43.950 43.950 44.128 -0.178 25768 507 1 . 1 1 112 112 GLY H H 112 8.110 8.110 8.462 -0.352 25768 508 1 . 1 1 113 113 GLY N N 113 108.510 108.510 109.597 -1.087 25768 509 1 . 1 1 113 113 GLY C C 113 171.540 171.540 172.232 -0.692 25768 510 1 . 1 1 113 113 GLY CA C 113 46.120 46.120 44.629 1.491 25768 511 1 . 1 1 113 113 GLY H H 113 9.080 9.080 8.329 0.751 25768 512 1 . 1 1 114 114 LEU N N 114 120.270 120.270 122.700 -2.430 25768 513 1 . 1 1 114 114 LEU C C 114 175.810 175.810 175.740 0.070 25768 514 1 . 1 1 114 114 LEU CA C 114 53.920 53.920 53.906 0.014 25768 515 1 . 1 1 114 114 LEU CB C 114 47.940 47.940 46.444 1.496 25768 516 1 . 1 1 114 114 LEU H H 114 8.620 8.620 8.465 0.155 25768 517 1 . 1 1 115 115 GLY N N 115 110.620 110.620 110.356 0.264 25768 518 1 . 1 1 115 115 GLY C C 115 171.560 171.560 172.838 -1.278 25768 519 1 . 1 1 115 115 GLY CA C 115 46.940 46.940 44.186 2.754 25768 520 1 . 1 1 115 115 GLY H H 115 9.000 9.000 8.461 0.539 25768 521 1 . 1 1 116 116 VAL N N 116 113.600 113.600 119.128 -5.528 25768 522 1 . 1 1 116 116 VAL C C 116 174.120 174.120 174.277 -0.157 25768 523 1 . 1 1 116 116 VAL CA C 116 58.970 58.970 60.433 -1.463 25768 524 1 . 1 1 116 116 VAL CB C 116 36.600 36.600 34.434 2.166 25768 525 1 . 1 1 116 116 VAL H H 116 8.680 8.680 7.802 0.878 25768 526 1 . 1 1 117 117 ASN N N 117 120.020 120.020 122.726 -2.706 25768 527 1 . 1 1 117 117 ASN CA C 117 52.190 52.190 52.793 -0.603 25768 528 1 . 1 1 117 117 ASN CB C 117 42.450 42.450 40.671 1.779 25768 529 1 . 1 1 117 117 ASN H H 117 8.840 8.840 8.489 0.351 25768 530 1 . 1 1 119 119 THR C C 119 174.350 174.350 174.013 0.337 25768 531 1 . 1 1 119 119 THR CA C 119 63.140 63.140 61.758 1.382 25768 532 1 . 1 1 119 119 THR CB C 119 70.170 70.170 69.919 0.251 25768 533 1 . 1 1 120 120 THR N N 120 114.120 114.120 115.858 -1.738 25768 534 1 . 1 1 120 120 THR C C 120 174.220 174.220 173.648 0.572 25768 535 1 . 1 1 120 120 THR CA C 120 61.900 61.900 62.343 -0.443 25768 536 1 . 1 1 120 120 THR CB C 120 70.140 70.140 69.356 0.784 25768 537 1 . 1 1 120 120 THR H H 120 7.570 7.570 8.154 -0.584 25768 538 1 . 1 1 121 121 PHE N N 121 121.230 121.230 122.575 -1.345 25768 539 1 . 1 1 121 121 PHE C C 121 174.910 174.910 175.004 -0.094 25768 540 1 . 1 1 121 121 PHE CA C 121 58.720 58.720 57.449 1.271 25768 541 1 . 1 1 121 121 PHE CB C 121 40.470 40.470 39.919 0.551 25768 542 1 . 1 1 121 121 PHE H H 121 7.830 7.830 8.174 -0.344 25768 543 1 . 1 1 122 122 PHE C C 122 175.070 175.070 175.076 -0.006 25768 544 1 . 1 1 122 122 PHE CA C 122 57.890 57.890 58.120 -0.230 25768 545 1 . 1 1 122 122 PHE CB C 122 39.870 39.870 39.751 0.119 25768 546 1 . 1 1 123 123 ASP N N 123 122.170 122.170 121.381 0.789 25768 547 1 . 1 1 123 123 ASP C C 123 176.150 176.150 176.444 -0.294 25768 548 1 . 1 1 123 123 ASP CA C 123 54.530 54.530 54.668 -0.138 25768 549 1 . 1 1 123 123 ASP CB C 123 41.830 41.830 41.671 0.159 25768 550 1 . 1 1 123 123 ASP H H 123 7.950 7.950 8.486 -0.536 25768 551 1 . 1 1 124 124 GLU N N 124 122.690 122.690 120.727 1.963 25768 552 1 . 1 1 124 124 GLU C C 124 176.630 176.630 177.666 -1.036 25768 553 1 . 1 1 124 124 GLU CA C 124 57.620 57.620 58.176 -0.556 25768 554 1 . 1 1 124 124 GLU CB C 124 30.450 30.450 30.053 0.397 25768 555 1 . 1 1 124 124 GLU H H 124 8.340 8.340 8.605 -0.265 25768 556 1 . 1 1 125 125 ASP N N 125 121.280 121.280 120.015 1.265 25768 557 1 . 1 1 125 125 ASP C C 125 176.940 176.940 178.041 -1.100 25768 558 1 . 1 1 125 125 ASP CA C 125 55.180 55.180 56.797 -1.617 25768 559 1 . 1 1 125 125 ASP CB C 125 41.220 41.220 40.532 0.688 25768 560 1 . 1 1 125 125 ASP H H 125 8.310 8.310 8.515 -0.205 25768 561 1 . 1 1 126 126 LEU N N 126 122.830 122.830 118.952 3.878 25768 562 1 . 1 1 126 126 LEU C C 126 178.020 178.020 178.065 -0.045 25768 563 1 . 1 1 126 126 LEU CA C 126 56.450 56.450 56.806 -0.356 25768 564 1 . 1 1 126 126 LEU CB C 126 42.150 42.150 41.893 0.257 25768 565 1 . 1 1 126 126 LEU H H 126 8.010 8.010 7.891 0.119 25768 566 1 . 1 1 127 127 ALA N N 127 122.660 122.660 119.747 2.913 25768 567 1 . 1 1 127 127 ALA C C 127 178.600 178.600 177.845 0.755 25768 568 1 . 1 1 127 127 ALA CA C 127 53.780 53.780 53.388 0.392 25768 569 1 . 1 1 127 127 ALA CB C 127 19.000 19.000 19.228 -0.228 25768 570 1 . 1 1 127 127 ALA H H 127 8.100 8.100 7.776 0.324 25768 571 1 . 1 1 128 128 SER N N 128 113.740 113.740 113.402 0.338 25768 572 1 . 1 1 128 128 SER C C 128 175.010 175.010 173.400 1.610 25768 573 1 . 1 1 128 128 SER CA C 128 59.580 59.580 58.406 1.174 25768 574 1 . 1 1 128 128 SER CB C 128 63.800 63.800 63.414 0.386 25768 575 1 . 1 1 128 128 SER H H 128 7.920 7.920 7.834 0.086 25768 576 1 . 1 1 129 129 ASN N N 129 120.300 120.300 120.888 -0.588 25768 577 1 . 1 1 129 129 ASN C C 129 175.590 175.590 174.839 0.751 25768 578 1 . 1 1 129 129 ASN CA C 129 54.180 54.180 53.412 0.768 25768 579 1 . 1 1 129 129 ASN CB C 129 38.900 38.900 39.313 -0.413 25768 580 1 . 1 1 129 129 ASN H H 129 8.120 8.120 8.505 -0.385 25768 581 1 . 1 1 130 130 ARG N N 130 120.630 120.630 121.857 -1.227 25768 582 1 . 1 1 130 130 ARG C C 130 176.720 176.720 175.674 1.046 25768 583 1 . 1 1 130 130 ARG CA C 130 57.240 57.240 56.273 0.967 25768 584 1 . 1 1 130 130 ARG CB C 130 30.500 30.500 30.925 -0.425 25768 585 1 . 1 1 130 130 ARG H H 130 8.050 8.050 8.410 -0.360 25768 586 1 . 1 1 131 131 LYS N N 131 121.150 121.150 121.245 -0.095 25768 587 1 . 1 1 131 131 LYS C C 131 176.750 176.750 175.586 1.164 25768 588 1 . 1 1 131 131 LYS CA C 131 57.050 57.050 56.495 0.555 25768 589 1 . 1 1 131 131 LYS CB C 131 32.870 32.870 32.713 0.157 25768 590 1 . 1 1 131 131 LYS H H 131 8.020 8.020 8.395 -0.375 25768 591 1 . 1 1 132 132 ALA N N 132 124.110 124.110 123.989 0.121 25768 592 1 . 1 1 132 132 ALA C C 132 177.680 177.680 176.728 0.952 25768 593 1 . 1 1 132 132 ALA CA C 132 53.070 53.070 52.269 0.801 25768 594 1 . 1 1 132 132 ALA CB C 132 19.250 19.250 19.447 -0.197 25768 595 1 . 1 1 132 132 ALA H H 132 8.010 8.010 8.179 -0.169 25768 596 1 . 1 1 133 133 GLN N N 133 118.830 118.830 119.974 -1.144 25768 597 1 . 1 1 133 133 GLN C C 133 176.380 176.380 175.851 0.529 25768 598 1 . 1 1 133 133 GLN CA C 133 56.400 56.400 55.790 0.610 25768 599 1 . 1 1 133 133 GLN CB C 133 29.670 29.670 29.927 -0.257 25768 600 1 . 1 1 133 133 GLN H H 133 8.070 8.070 8.546 -0.476 25768 601 1 . 1 1 134 134 GLY N N 134 109.400 109.400 109.243 0.157 25768 602 1 . 1 1 134 134 GLY C C 134 174.060 174.060 173.584 0.476 25768 603 1 . 1 1 134 134 GLY CA C 134 45.690 45.690 44.921 0.769 25768 604 1 . 1 1 134 134 GLY H H 134 8.150 8.150 8.293 -0.143 25768 605 1 . 1 1 135 135 PHE N N 135 120.480 120.480 121.332 -0.852 25768 606 1 . 1 1 135 135 PHE C C 135 176.000 176.000 175.485 0.515 25768 607 1 . 1 1 135 135 PHE CA C 135 58.370 58.370 58.178 0.191 25768 608 1 . 1 1 135 135 PHE CB C 135 39.710 39.710 39.848 -0.138 25768 609 1 . 1 1 135 135 PHE H H 135 8.060 8.060 8.275 -0.215 25768 610 1 . 1 1 136 136 SER N N 136 116.740 116.740 116.893 -0.153 25768 611 1 . 1 1 136 136 SER C C 136 174.620 174.620 173.680 0.940 25768 612 1 . 1 1 136 136 SER CA C 136 58.870 58.870 58.175 0.695 25768 613 1 . 1 1 136 136 SER CB C 136 64.200 64.200 63.918 0.282 25768 614 1 . 1 1 136 136 SER H H 136 8.160 8.160 8.225 -0.065 25768 615 1 . 1 1 137 137 SER N N 137 117.650 117.650 118.867 -1.217 25768 616 1 . 1 1 137 137 SER C C 137 174.410 174.410 173.987 0.423 25768 617 1 . 1 1 137 137 SER CA C 137 58.880 58.880 58.341 0.539 25768 618 1 . 1 1 137 137 SER CB C 137 64.140 64.140 63.931 0.209 25768 619 1 . 1 1 137 137 SER H H 137 8.140 8.140 8.303 -0.163 25768 620 1 . 1 1 138 138 MET N N 138 121.980 121.980 123.130 -1.150 25768 621 1 . 1 1 138 138 MET C C 138 175.680 175.680 175.469 0.211 25768 622 1 . 1 1 138 138 MET CA C 138 56.180 56.180 55.733 0.447 25768 623 1 . 1 1 138 138 MET CB C 138 33.240 33.240 33.330 -0.090 25768 624 1 . 1 1 138 138 MET H H 138 8.110 8.110 8.374 -0.264 25768 625 1 . 1 1 139 139 LYS N N 139 122.110 122.110 122.183 -0.073 25768 626 1 . 1 1 139 139 LYS C C 139 176.220 176.220 175.721 0.499 25768 627 1 . 1 1 139 139 LYS CA C 139 56.370 56.370 56.146 0.223 25768 628 1 . 1 1 139 139 LYS CB C 139 33.220 33.220 32.971 0.249 25768 629 1 . 1 1 139 139 LYS H H 139 8.140 8.140 8.307 -0.167 25768 630 1 . 1 1 140 140 LEU N N 140 123.860 123.860 122.177 1.683 25768 631 1 . 1 1 140 140 LEU C C 140 177.100 177.100 176.329 0.771 25768 632 1 . 1 1 140 140 LEU CA C 140 55.710 55.710 55.358 0.352 25768 633 1 . 1 1 140 140 LEU CB C 140 42.460 42.460 42.748 -0.288 25768 634 1 . 1 1 140 140 LEU H H 140 8.140 8.140 8.277 -0.137 25768 635 1 . 1 1 141 141 GLN N N 141 120.350 120.350 120.049 0.301 25768 636 1 . 1 1 141 141 GLN C C 141 175.170 175.170 174.988 0.182 25768 637 1 . 1 1 141 141 GLN CA C 141 56.200 56.200 55.928 0.272 25768 638 1 . 1 1 141 141 GLN CB C 141 29.950 29.950 29.678 0.272 25768 639 1 . 1 1 141 141 GLN H H 141 8.210 8.210 8.255 -0.045 25768 640 1 . 1 1 142 142 ASP N N 142 120.950 120.950 121.547 -0.597 25768 641 1 . 1 1 142 142 ASP C C 142 175.840 175.840 175.661 0.179 25768 642 1 . 1 1 142 142 ASP CA C 142 54.700 54.700 54.457 0.243 25768 643 1 . 1 1 142 142 ASP CB C 142 41.760 41.760 41.308 0.452 25768 644 1 . 1 1 142 142 ASP H H 142 8.120 8.120 8.567 -0.447 25768 645 1 . 1 1 143 143 SER N N 143 114.880 114.880 115.038 -0.158 25768 646 1 . 1 1 143 143 SER C C 143 173.290 173.290 173.678 -0.388 25768 647 1 . 1 1 143 143 SER CA C 143 58.450 58.450 58.374 0.076 25768 648 1 . 1 1 143 143 SER CB C 143 64.760 64.760 63.699 1.061 25768 649 1 . 1 1 143 143 SER H H 143 7.960 7.960 8.108 -0.148 25768 650 1 . 1 1 144 144 TRP N N 144 123.110 123.110 123.951 -0.841 25768 651 1 . 1 1 144 144 TRP C C 144 175.880 175.880 176.152 -0.272 25768 652 1 . 1 1 144 144 TRP CA C 144 56.420 56.420 57.180 -0.760 25768 653 1 . 1 1 144 144 TRP CB C 144 31.160 31.160 30.663 0.497 25768 654 1 . 1 1 144 144 TRP H H 144 8.080 8.080 8.145 -0.065 25768 655 1 . 1 1 145 145 GLY N N 145 110.410 110.410 110.898 -0.487 25768 656 1 . 1 1 145 145 GLY C C 145 172.870 172.870 173.488 -0.618 25768 657 1 . 1 1 145 145 GLY CA C 145 45.130 45.130 44.777 0.353 25768 658 1 . 1 1 145 145 GLY H H 145 8.660 8.660 8.460 0.200 25768 659 1 . 1 1 148 148 GLY C C 148 171.800 171.800 172.963 -1.163 25768 660 1 . 1 1 148 148 GLY CA C 148 44.140 44.140 44.653 -0.513 25768 661 1 . 1 1 149 149 GLU N N 149 123.070 123.070 121.320 1.750 25768 662 1 . 1 1 149 149 GLU C C 149 174.210 174.210 174.389 -0.179 25768 663 1 . 1 1 149 149 GLU CA C 149 55.120 55.120 55.486 -0.366 25768 664 1 . 1 1 149 149 GLU CB C 149 37.410 37.410 34.003 3.407 25768 665 1 . 1 1 149 149 GLU H H 149 8.550 8.550 8.334 0.216 25768 666 1 . 1 1 150 150 LEU N N 150 126.130 126.130 123.124 3.006 25768 667 1 . 1 1 150 150 LEU C C 150 174.410 174.410 175.443 -1.033 25768 668 1 . 1 1 150 150 LEU CA C 150 54.260 54.260 53.539 0.721 25768 669 1 . 1 1 150 150 LEU CB C 150 47.510 47.510 44.877 2.633 25768 670 1 . 1 1 150 150 LEU H H 150 8.550 8.550 8.219 0.331 25768 671 1 . 1 1 151 151 GLY N N 151 109.500 109.500 109.163 0.337 25768 672 1 . 1 1 151 151 GLY C C 151 170.610 170.610 171.969 -1.359 25768 673 1 . 1 1 151 151 GLY CA C 151 45.980 45.980 43.968 2.012 25768 674 1 . 1 1 151 151 GLY H H 151 8.090 8.090 8.221 -0.131 25768 675 1 . 1 1 152 152 PHE N N 152 110.960 110.960 119.952 -8.992 25768 676 1 . 1 1 152 152 PHE C C 152 171.510 171.510 174.156 -2.647 25768 677 1 . 1 1 152 152 PHE CA C 152 58.170 58.170 56.628 1.542 25768 678 1 . 1 1 152 152 PHE CB C 152 41.690 41.690 41.841 -0.151 25768 679 1 . 1 1 152 152 PHE H H 152 8.380 8.380 8.211 0.169 25768 680 1 . 1 1 153 153 ASP N N 153 118.880 118.880 124.684 -5.804 25768 681 1 . 1 1 153 153 ASP C C 153 176.520 176.520 174.832 1.688 25768 682 1 . 1 1 153 153 ASP CA C 153 52.940 52.940 53.425 -0.485 25768 683 1 . 1 1 153 153 ASP CB C 153 44.540 44.540 43.650 0.890 25768 684 1 . 1 1 153 153 ASP H H 153 7.970 7.970 8.596 -0.626 25768 685 1 . 1 1 154 154 TYR N N 154 123.630 123.630 124.824 -1.194 25768 686 1 . 1 1 154 154 TYR C C 154 175.610 175.610 174.109 1.501 25768 687 1 . 1 1 154 154 TYR CA C 154 57.310 57.310 57.121 0.189 25768 688 1 . 1 1 154 154 TYR CB C 154 42.040 42.040 41.718 0.323 25768 689 1 . 1 1 154 154 TYR H H 154 9.730 9.730 9.125 0.605 25768 690 1 . 1 1 155 155 MET N N 155 126.190 126.190 125.624 0.566 25768 691 1 . 1 1 155 155 MET C C 155 174.970 174.970 175.057 -0.087 25768 692 1 . 1 1 155 155 MET CA C 155 54.720 54.720 55.935 -1.215 25768 693 1 . 1 1 155 155 MET CB C 155 28.300 28.300 32.897 -4.597 25768 694 1 . 1 1 155 155 MET H H 155 8.600 8.600 8.578 0.022 25768 695 1 . 1 1 156 156 LEU N N 156 125.290 125.290 125.406 -0.116 25768 696 1 . 1 1 156 156 LEU C C 156 177.680 177.680 177.477 0.203 25768 697 1 . 1 1 156 156 LEU CA C 156 56.040 56.040 54.831 1.209 25768 698 1 . 1 1 156 156 LEU CB C 156 43.040 43.040 43.170 -0.130 25768 699 1 . 1 1 156 156 LEU H H 156 9.190 9.190 8.591 0.600 25768 700 1 . 1 1 157 157 ASN N N 157 114.690 114.690 116.471 -1.781 25768 701 1 . 1 1 157 157 ASN C C 157 173.640 173.640 177.112 -3.472 25768 702 1 . 1 1 157 157 ASN CA C 157 52.650 52.650 56.187 -3.537 25768 703 1 . 1 1 157 157 ASN CB C 157 37.270 37.270 36.829 0.441 25768 704 1 . 1 1 157 157 ASN H H 157 8.060 8.060 8.209 -0.149 25768 705 1 . 1 1 158 158 GLU N N 158 114.530 114.530 120.487 -5.957 25768 706 1 . 1 1 158 158 GLU C C 158 176.090 176.090 177.150 -1.060 25768 707 1 . 1 1 158 158 GLU CA C 158 60.010 60.010 58.313 1.697 25768 708 1 . 1 1 158 158 GLU CB C 158 29.730 29.730 29.998 -0.268 25768 709 1 . 1 1 158 158 GLU H H 158 8.560 8.560 8.426 0.134 25768 710 1 . 1 1 159 159 HIS N N 159 110.480 110.480 116.949 -6.469 25768 711 1 . 1 1 159 159 HIS C C 159 173.130 173.130 174.151 -1.021 25768 712 1 . 1 1 159 159 HIS CA C 159 56.770 56.770 55.097 1.673 25768 713 1 . 1 1 159 159 HIS CB C 159 32.630 32.630 29.788 2.842 25768 714 1 . 1 1 159 159 HIS H H 159 8.190 8.190 7.738 0.452 25768 715 1 . 1 1 160 160 ALA N N 160 122.890 122.890 120.577 2.313 25768 716 1 . 1 1 160 160 ALA C C 160 176.200 176.200 175.178 1.022 25768 717 1 . 1 1 160 160 ALA CA C 160 51.730 51.730 53.390 -1.660 25768 718 1 . 1 1 160 160 ALA CB C 160 21.560 21.560 18.628 2.932 25768 719 1 . 1 1 160 160 ALA H H 160 8.400 8.400 7.604 0.796 25768 720 1 . 1 1 161 161 LEU N N 161 116.540 116.540 117.481 -0.941 25768 721 1 . 1 1 161 161 LEU C C 161 174.930 174.930 175.833 -0.903 25768 722 1 . 1 1 161 161 LEU CA C 161 54.280 54.280 54.031 0.249 25768 723 1 . 1 1 161 161 LEU CB C 161 45.640 45.640 44.871 0.769 25768 724 1 . 1 1 161 161 LEU H H 161 8.590 8.590 8.122 0.468 25768 725 1 . 1 1 162 162 PHE N N 162 121.780 121.780 123.144 -1.364 25768 726 1 . 1 1 162 162 PHE C C 162 171.960 171.960 174.334 -2.374 25768 727 1 . 1 1 162 162 PHE CA C 162 56.420 56.420 56.961 -0.542 25768 728 1 . 1 1 162 162 PHE CB C 162 43.340 43.340 42.244 1.096 25768 729 1 . 1 1 162 162 PHE H H 162 9.180 9.180 9.189 -0.009 25768 730 1 . 1 1 163 163 ASN N N 163 127.850 127.850 123.493 4.357 25768 731 1 . 1 1 163 163 ASN C C 163 171.320 171.320 173.754 -2.434 25768 732 1 . 1 1 163 163 ASN CA C 163 52.340 52.340 52.398 -0.058 25768 733 1 . 1 1 163 163 ASN CB C 163 46.410 46.410 41.967 4.443 25768 734 1 . 1 1 163 163 ASN H H 163 7.700 7.700 8.443 -0.743 25768 735 1 . 1 1 164 164 MET N N 164 119.950 119.950 121.653 -1.703 25768 736 1 . 1 1 164 164 MET C C 164 172.830 172.830 174.254 -1.424 25768 737 1 . 1 1 164 164 MET CA C 164 55.180 55.180 54.431 0.749 25768 738 1 . 1 1 164 164 MET CB C 164 37.770 37.770 37.419 0.351 25768 739 1 . 1 1 164 164 MET H H 164 7.070 7.070 8.576 -1.506 25768 740 1 . 1 1 165 165 ALA N N 165 120.600 120.600 124.080 -3.480 25768 741 1 . 1 1 165 165 ALA C C 165 174.240 174.240 175.046 -0.806 25768 742 1 . 1 1 165 165 ALA CA C 165 51.630 51.630 51.025 0.605 25768 743 1 . 1 1 165 165 ALA CB C 165 22.330 22.330 22.147 0.183 25768 744 1 . 1 1 165 165 ALA H H 165 8.290 8.290 8.710 -0.420 25768 745 1 . 1 1 166 166 VAL N N 166 117.900 117.900 118.667 -0.767 25768 746 1 . 1 1 166 166 VAL C C 166 172.950 172.950 174.548 -1.598 25768 747 1 . 1 1 166 166 VAL CA C 166 59.710 59.710 60.963 -1.253 25768 748 1 . 1 1 166 166 VAL CB C 166 35.290 35.290 35.613 -0.323 25768 749 1 . 1 1 166 166 VAL H H 166 8.720 8.720 8.383 0.338 25768 750 1 . 1 1 171 171 ILE C C 171 175.750 175.750 174.971 0.779 25768 751 1 . 1 1 171 171 ILE CA C 171 61.720 61.720 61.508 0.212 25768 752 1 . 1 1 171 171 ILE CB C 171 39.300 39.300 38.777 0.523 25768 753 1 . 1 1 172 172 ASP N N 172 124.070 124.070 122.739 1.331 25768 754 1 . 1 1 172 172 ASP C C 172 176.590 176.590 175.846 0.744 25768 755 1 . 1 1 172 172 ASP CA C 172 54.460 54.460 54.149 0.311 25768 756 1 . 1 1 172 172 ASP CB C 172 41.410 41.410 41.797 -0.387 25768 757 1 . 1 1 172 172 ASP H H 172 8.460 8.460 8.262 0.199 25768 758 1 . 1 1 173 173 THR N N 173 115.570 115.570 115.521 0.049 25768 759 1 . 1 1 173 173 THR C C 173 175.030 175.030 174.632 0.398 25768 760 1 . 1 1 173 173 THR CA C 173 62.680 62.680 62.620 0.060 25768 761 1 . 1 1 173 173 THR CB C 173 69.840 69.840 69.459 0.381 25768 762 1 . 1 1 173 173 THR H H 173 8.080 8.080 8.158 -0.078 25768 763 1 . 1 1 174 174 LYS N N 174 122.680 122.680 123.335 -0.655 25768 764 1 . 1 1 174 174 LYS C C 174 176.340 176.340 175.968 0.372 25768 765 1 . 1 1 174 174 LYS CA C 174 56.820 56.820 56.265 0.555 25768 766 1 . 1 1 174 174 LYS CB C 174 32.790 32.790 32.658 0.132 25768 767 1 . 1 1 174 174 LYS H H 174 8.180 8.180 8.418 -0.238 25768 768 1 . 1 1 175 175 ALA N N 175 124.050 124.050 123.791 0.259 25768 769 1 . 1 1 175 175 ALA C C 175 177.550 177.550 176.951 0.599 25768 770 1 . 1 1 175 175 ALA CA C 175 52.840 52.840 52.452 0.388 25768 771 1 . 1 1 175 175 ALA CB C 175 19.580 19.580 18.772 0.808 25768 772 1 . 1 1 175 175 ALA H H 175 8.050 8.050 8.081 -0.031 25768 773 1 . 1 1 176 176 SER N N 176 114.920 114.920 116.086 -1.166 25768 774 1 . 1 1 176 176 SER C C 176 174.240 174.240 174.032 0.208 25768 775 1 . 1 1 176 176 SER CA C 176 58.390 58.390 58.344 0.046 25768 776 1 . 1 1 176 176 SER CB C 176 64.370 64.370 63.673 0.697 25768 777 1 . 1 1 176 176 SER H H 176 8.070 8.070 8.330 -0.260 25768 778 1 . 1 1 177 177 ILE N N 177 121.650 121.650 122.467 -0.817 25768 779 1 . 1 1 177 177 ILE C C 177 174.990 174.990 175.067 -0.077 25768 780 1 . 1 1 177 177 ILE CA C 177 61.570 61.570 60.987 0.583 25768 781 1 . 1 1 177 177 ILE CB C 177 39.100 39.100 38.837 0.263 25768 782 1 . 1 1 177 177 ILE H H 177 7.960 7.960 8.019 -0.059 25768 783 1 . 1 1 178 178 ASN N N 178 127.040 127.040 124.611 2.429 25768 784 1 . 1 1 178 178 ASN C C 178 179.160 179.160 175.191 3.969 25768 785 1 . 1 1 178 178 ASN CA C 178 55.100 55.100 53.503 1.597 25768 786 1 . 1 1 178 178 ASN CB C 178 41.300 41.300 39.075 2.225 25768 787 1 . 1 1 178 178 ASN H H 178 7.850 7.850 8.534 -0.684 25768 788 1 . 1 1 180 180 PRO C C 180 177.520 177.520 176.471 1.049 25768 789 1 . 1 1 180 180 PRO CA C 180 63.980 63.980 63.351 0.629 25768 790 1 . 1 1 180 180 PRO CB C 180 32.190 32.190 31.994 0.196 25768 791 1 . 1 1 181 181 SER N N 181 115.600 115.600 115.832 -0.232 25768 792 1 . 1 1 181 181 SER C C 181 174.710 174.710 173.913 0.797 25768 793 1 . 1 1 181 181 SER CA C 181 58.900 58.900 58.505 0.395 25768 794 1 . 1 1 181 181 SER CB C 181 64.070 64.070 63.584 0.486 25768 795 1 . 1 1 181 181 SER H H 181 8.260 8.260 8.420 -0.160 25768 796 1 . 1 1 182 182 ALA N N 182 125.880 125.880 124.409 1.471 25768 797 1 . 1 1 182 182 ALA C C 182 177.560 177.560 176.602 0.958 25768 798 1 . 1 1 182 182 ALA CA C 182 53.090 53.090 52.185 0.905 25768 799 1 . 1 1 182 182 ALA CB C 182 19.310 19.310 19.275 0.035 25768 800 1 . 1 1 182 182 ALA H H 182 8.130 8.130 8.015 0.115 25768 801 1 . 1 1 183 183 LEU N N 183 119.980 119.980 121.204 -1.224 25768 802 1 . 1 1 183 183 LEU C C 183 177.850 177.850 177.362 0.488 25768 803 1 . 1 1 183 183 LEU CA C 183 55.650 55.650 55.023 0.627 25768 804 1 . 1 1 183 183 LEU CB C 183 42.530 42.530 42.692 -0.162 25768 805 1 . 1 1 183 183 LEU H H 183 7.940 7.940 8.294 -0.354 25768 806 1 . 1 1 184 184 GLY N N 184 109.250 109.250 110.582 -1.332 25768 807 1 . 1 1 184 184 GLY C C 184 174.250 174.250 173.839 0.411 25768 808 1 . 1 1 184 184 GLY CA C 184 45.830 45.830 44.842 0.988 25768 809 1 . 1 1 184 184 GLY H H 184 8.150 8.150 8.359 -0.209 25768 810 1 . 1 1 185 185 VAL N N 185 118.830 118.830 119.842 -1.012 25768 811 1 . 1 1 185 185 VAL C C 185 175.890 175.890 175.173 0.717 25768 812 1 . 1 1 185 185 VAL CA C 185 62.740 62.740 62.032 0.708 25768 813 1 . 1 1 185 185 VAL CB C 185 32.770 32.770 32.195 0.575 25768 814 1 . 1 1 185 185 VAL H H 185 7.760 7.760 8.062 -0.302 25768 815 1 . 1 1 186 186 ASN N N 186 121.850 121.850 121.503 0.347 25768 816 1 . 1 1 186 186 ASN C C 186 174.970 174.970 174.535 0.435 25768 817 1 . 1 1 186 186 ASN CA C 186 53.590 53.590 53.283 0.307 25768 818 1 . 1 1 186 186 ASN CB C 186 39.160 39.160 39.223 -0.063 25768 819 1 . 1 1 186 186 ASN H H 186 8.380 8.380 8.399 -0.019 25768 820 1 . 1 1 187 187 LYS N N 187 122.120 122.120 121.546 0.573 25768 821 1 . 1 1 187 187 LYS C C 187 176.490 176.490 175.854 0.636 25768 822 1 . 1 1 187 187 LYS CA C 187 56.750 56.750 56.448 0.302 25768 823 1 . 1 1 187 187 LYS CB C 187 33.250 33.250 33.296 -0.046 25768 824 1 . 1 1 187 187 LYS H H 187 8.140 8.140 8.312 -0.172 25768 825 1 . 1 1 188 188 THR N N 188 115.250 115.250 114.389 0.861 25768 826 1 . 1 1 188 188 THR C C 188 174.250 174.250 174.183 0.067 25768 827 1 . 1 1 188 188 THR CA C 188 62.360 62.360 62.214 0.146 25768 828 1 . 1 1 188 188 THR CB C 188 70.280 70.280 69.609 0.671 25768 829 1 . 1 1 188 188 THR H H 188 8.100 8.100 8.247 -0.147 25768 830 1 . 1 1 189 189 LYS N N 189 123.780 123.780 123.226 0.554 25768 831 1 . 1 1 189 189 LYS C C 189 176.090 176.090 175.776 0.314 25768 832 1 . 1 1 189 189 LYS CA C 189 56.590 56.590 56.403 0.187 25768 833 1 . 1 1 189 189 LYS CB C 189 33.350 33.350 33.189 0.161 25768 834 1 . 1 1 189 189 LYS H H 189 8.110 8.110 8.282 -0.172 25768 835 1 . 1 1 190 190 VAL N N 190 120.920 120.920 119.141 1.779 25768 836 1 . 1 1 190 190 VAL C C 190 175.590 175.590 175.291 0.299 25768 837 1 . 1 1 190 190 VAL CA C 190 62.400 62.400 61.944 0.456 25768 838 1 . 1 1 190 190 VAL CB C 190 32.990 32.990 32.709 0.281 25768 839 1 . 1 1 190 190 VAL H H 190 8.040 8.040 8.112 -0.072 25768 840 1 . 1 1 191 191 ASP N N 191 123.790 123.790 123.142 0.648 25768 841 1 . 1 1 191 191 ASP C C 191 175.750 175.750 176.232 -0.482 25768 842 1 . 1 1 191 191 ASP CA C 191 54.650 54.650 55.173 -0.523 25768 843 1 . 1 1 191 191 ASP CB C 191 41.450 41.450 41.654 -0.204 25768 844 1 . 1 1 191 191 ASP H H 191 8.240 8.240 8.423 -0.183 25768 845 1 . 1 1 192 192 VAL N N 192 118.850 118.850 117.977 0.873 25768 846 1 . 1 1 192 192 VAL C C 192 175.380 175.380 174.909 0.471 25768 847 1 . 1 1 192 192 VAL CA C 192 62.110 62.110 62.763 -0.653 25768 848 1 . 1 1 192 192 VAL CB C 192 33.290 33.290 32.108 1.182 25768 849 1 . 1 1 192 192 VAL H H 192 7.860 7.860 7.848 0.012 25768 850 1 . 1 1 193 193 ASP N N 193 124.190 124.190 121.017 3.173 25768 851 1 . 1 1 193 193 ASP C C 193 175.630 175.630 175.628 0.002 25768 852 1 . 1 1 193 193 ASP CA C 193 54.540 54.540 54.363 0.177 25768 853 1 . 1 1 193 193 ASP CB C 193 41.410 41.410 41.303 0.107 25768 854 1 . 1 1 193 193 ASP H H 193 8.310 8.310 8.280 0.030 25768 855 1 . 1 1 194 194 VAL N N 194 119.580 119.580 118.139 1.441 25768 856 1 . 1 1 194 194 VAL C C 194 174.950 174.950 174.959 -0.009 25768 857 1 . 1 1 194 194 VAL CA C 194 61.770 61.770 62.296 -0.526 25768 858 1 . 1 1 194 194 VAL CB C 194 33.680 33.680 32.988 0.692 25768 859 1 . 1 1 194 194 VAL H H 194 7.890 7.890 7.703 0.187 25768 860 1 . 1 1 195 195 ASP N N 195 125.660 125.660 125.378 0.282 25768 861 1 . 1 1 195 195 ASP C C 195 174.290 174.290 174.635 -0.345 25768 862 1 . 1 1 195 195 ASP CA C 195 51.940 51.940 52.233 -0.293 25768 863 1 . 1 1 195 195 ASP CB C 195 40.950 40.950 41.569 -0.619 25768 864 1 . 1 1 195 195 ASP H H 195 8.410 8.410 8.189 0.221 25768 865 1 . 1 1 198 198 VAL C C 198 173.940 173.940 174.329 -0.389 25768 866 1 . 1 1 198 198 VAL CA C 198 61.270 61.270 60.895 0.375 25768 867 1 . 1 1 198 198 VAL CB C 198 35.910 35.910 33.119 2.791 25768 868 1 . 1 1 199 199 TYR N N 199 123.780 123.780 123.408 0.372 25768 869 1 . 1 1 199 199 TYR C C 199 174.150 174.150 174.288 -0.138 25768 870 1 . 1 1 199 199 TYR CA C 199 56.220 56.220 56.679 -0.459 25768 871 1 . 1 1 199 199 TYR CB C 199 41.660 41.660 41.920 -0.260 25768 872 1 . 1 1 199 199 TYR H H 199 8.540 8.540 8.050 0.490 25768 873 1 . 1 1 200 200 MET N N 200 123.920 123.920 122.374 1.546 25768 874 1 . 1 1 200 200 MET C C 200 173.810 173.810 174.541 -0.731 25768 875 1 . 1 1 200 200 MET CA C 200 54.710 54.710 54.715 -0.006 25768 876 1 . 1 1 200 200 MET CB C 200 37.110 37.110 35.057 2.053 25768 877 1 . 1 1 200 200 MET H H 200 9.130 9.130 8.377 0.753 25768 878 1 . 1 1 201 201 ILE N N 201 123.670 123.670 121.051 2.619 25768 879 1 . 1 1 201 201 ILE C C 201 174.030 174.030 174.162 -0.132 25768 880 1 . 1 1 201 201 ILE CA C 201 59.820 59.820 59.347 0.473 25768 881 1 . 1 1 201 201 ILE CB C 201 41.720 41.720 41.674 0.046 25768 882 1 . 1 1 201 201 ILE H H 201 8.030 8.030 8.300 -0.270 25768 883 1 . 1 1 202 202 GLY N N 202 112.910 112.910 111.807 1.103 25768 884 1 . 1 1 202 202 GLY C C 202 170.280 170.280 171.828 -1.548 25768 885 1 . 1 1 202 202 GLY CA C 202 46.800 46.800 45.189 1.611 25768 886 1 . 1 1 202 202 GLY H H 202 8.580 8.580 8.043 0.537 25768 887 1 . 1 1 203 203 PHE N N 203 116.240 116.240 116.100 0.140 25768 888 1 . 1 1 203 203 PHE C C 203 173.940 173.940 174.194 -0.254 25768 889 1 . 1 1 203 203 PHE CA C 203 55.890 55.890 54.990 0.900 25768 890 1 . 1 1 203 203 PHE CB C 203 45.060 45.060 42.166 2.894 25768 891 1 . 1 1 203 203 PHE H H 203 8.620 8.620 8.116 0.504 25768 892 1 . 1 1 204 204 GLY N N 204 105.610 105.610 106.173 -0.563 25768 893 1 . 1 1 204 204 GLY C C 204 171.190 171.190 171.647 -0.457 25768 894 1 . 1 1 204 204 GLY CA C 204 46.720 46.720 45.022 1.698 25768 895 1 . 1 1 204 204 GLY H H 204 8.960 8.960 8.745 0.215 25768 896 1 . 1 1 205 205 TYR N N 205 121.160 121.160 119.079 2.081 25768 897 1 . 1 1 205 205 TYR C C 205 173.030 173.030 173.912 -0.882 25768 898 1 . 1 1 205 205 TYR CA C 205 57.190 57.190 56.917 0.273 25768 899 1 . 1 1 205 205 TYR CB C 205 44.400 44.400 43.084 1.316 25768 900 1 . 1 1 205 205 TYR H H 205 9.380 9.380 8.699 0.681 25768 901 1 . 1 1 206 206 LYS N N 206 126.970 126.970 124.534 2.436 25768 902 1 . 1 1 206 206 LYS C C 206 174.210 174.210 175.383 -1.173 25768 903 1 . 1 1 206 206 LYS CA C 206 54.770 54.770 55.501 -0.731 25768 904 1 . 1 1 206 206 LYS CB C 206 34.440 34.440 33.680 0.761 25768 905 1 . 1 1 206 206 LYS H H 206 8.380 8.380 8.284 0.096 25768 906 1 . 1 1 207 207 PHE N N 207 126.330 126.330 125.651 0.679 25768 907 1 . 1 1 207 207 PHE C C 207 175.020 175.020 174.665 0.355 25768 908 1 . 1 1 207 207 PHE CA C 207 58.170 58.170 58.248 -0.078 25768 909 1 . 1 1 207 207 PHE CB C 207 40.920 40.920 40.388 0.532 25768 910 1 . 1 1 207 207 PHE H H 207 9.290 9.290 8.323 0.967 25768 911 1 . 1 1 208 208 LEU N N 208 122.740 122.740 124.888 -2.148 25768 912 1 . 1 1 208 208 LEU C C 208 176.510 176.510 176.129 0.381 25768 913 1 . 1 1 208 208 LEU CA C 208 54.910 54.910 54.337 0.573 25768 914 1 . 1 1 208 208 LEU CB C 208 43.830 43.830 43.751 0.079 25768 915 1 . 1 1 208 208 LEU H H 208 8.310 8.310 8.064 0.246 25768 stop_ save_