data_25277 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25277 _Entry.PDB_ID 2MVO 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 25277 _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 27 27 PRO CA C 27 63.230 63.230 62.562 0.668 25277 2 1 1 . 1 1 27 27 PRO CB C 27 32.050 32.050 32.468 -0.418 25277 3 1 1 . 1 1 28 28 ASP N N 28 120.030 120.030 123.086 -3.056 25277 4 1 1 . 1 1 28 28 ASP C C 28 176.130 176.130 176.883 -0.753 25277 5 1 1 . 1 1 28 28 ASP CA C 28 54.170 54.170 55.191 -1.021 25277 6 1 1 . 1 1 28 28 ASP CB C 28 40.860 40.860 40.692 0.168 25277 7 1 1 . 1 1 28 28 ASP H H 28 8.260 8.260 8.604 -0.344 25277 8 1 1 . 1 1 29 29 LEU N N 29 123.030 123.030 121.157 1.873 25277 9 1 1 . 1 1 29 29 LEU C C 29 177.870 177.870 176.136 1.734 25277 10 1 1 . 1 1 29 29 LEU CA C 29 55.160 55.160 54.734 0.426 25277 11 1 1 . 1 1 29 29 LEU CB C 29 42.270 42.270 42.752 -0.482 25277 12 1 1 . 1 1 29 29 LEU H H 29 8.120 8.120 7.513 0.607 25277 13 1 1 . 1 1 30 30 GLY N N 30 109.350 109.350 111.465 -2.115 25277 14 1 1 . 1 1 30 30 GLY CA C 30 45.340 45.340 44.813 0.527 25277 15 1 1 . 1 1 30 30 GLY H H 30 8.410 8.410 8.390 0.020 25277 16 1 1 . 1 1 44 44 PRO CA C 44 63.590 63.590 62.268 1.322 25277 17 1 1 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.282 -0.292 25277 18 1 1 . 1 1 45 45 ALA N N 45 122.140 122.140 122.371 -0.231 25277 19 1 1 . 1 1 45 45 ALA CA C 45 52.670 52.670 52.705 -0.035 25277 20 1 1 . 1 1 45 45 ALA H H 45 8.350 8.350 7.980 0.370 25277 21 1 1 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.420 -0.120 25277 22 1 1 . 1 1 49 49 PRO CA C 49 62.950 62.950 63.235 -0.285 25277 23 1 1 . 1 1 49 49 PRO CB C 49 31.990 31.990 32.040 -0.050 25277 24 1 1 . 1 1 50 50 VAL N N 50 124.190 124.190 126.658 -2.468 25277 25 1 1 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.382 -0.062 25277 26 1 1 . 1 1 50 50 VAL CA C 50 59.850 59.850 59.652 0.198 25277 27 1 1 . 1 1 50 50 VAL CB C 50 32.480 32.480 32.359 0.120 25277 28 1 1 . 1 1 50 50 VAL H H 50 8.070 8.070 7.886 0.184 25277 29 1 1 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.325 0.025 25277 30 1 1 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.233 -0.303 25277 31 1 1 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.206 -0.226 25277 32 1 1 . 1 1 52 52 LEU N N 52 124.500 124.500 121.684 2.816 25277 33 1 1 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.277 0.213 25277 34 1 1 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.758 -0.868 25277 35 1 1 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.522 0.668 25277 36 1 1 . 1 1 52 52 LEU H H 52 8.360 8.360 8.210 0.150 25277 37 1 1 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.529 -0.119 25277 38 1 1 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.106 0.224 25277 39 1 1 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.256 -0.266 25277 40 1 1 . 1 1 54 54 SER N N 54 117.380 117.380 116.065 1.315 25277 41 1 1 . 1 1 54 54 SER HA H 54 4.600 4.600 4.431 0.169 25277 42 1 1 . 1 1 54 54 SER CA C 54 56.710 56.710 57.962 -1.252 25277 43 1 1 . 1 1 54 54 SER CB C 54 62.500 62.500 62.702 -0.202 25277 44 1 1 . 1 1 54 54 SER H H 54 8.400 8.400 8.335 0.065 25277 45 1 1 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.584 -0.034 25277 46 1 1 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.326 0.214 25277 47 1 1 . 1 1 55 55 PRO CB C 55 32.620 32.620 32.222 0.398 25277 48 1 1 . 1 1 57 57 SER HA H 57 4.420 4.420 4.271 0.149 25277 49 1 1 . 1 1 57 57 SER CA C 57 57.580 57.580 60.463 -2.883 25277 50 1 1 . 1 1 57 57 SER CB C 57 63.780 63.780 63.220 0.560 25277 51 1 1 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.436 0.554 25277 52 1 1 . 1 1 58 58 ASN C C 58 172.230 172.230 173.713 -1.483 25277 53 1 1 . 1 1 58 58 ASN CA C 58 53.670 53.670 54.682 -1.012 25277 54 1 1 . 1 1 58 58 ASN CB C 58 37.850 37.850 36.972 0.877 25277 55 1 1 . 1 1 59 59 LYS N N 59 117.660 117.660 117.957 -0.297 25277 56 1 1 . 1 1 59 59 LYS HA H 59 5.360 5.360 4.892 0.468 25277 57 1 1 . 1 1 59 59 LYS C C 59 175.120 175.120 173.826 1.294 25277 58 1 1 . 1 1 59 59 LYS CA C 59 54.860 54.860 56.065 -1.205 25277 59 1 1 . 1 1 59 59 LYS CB C 59 36.450 36.450 36.480 -0.030 25277 60 1 1 . 1 1 59 59 LYS H H 59 7.640 7.640 7.776 -0.136 25277 61 1 1 . 1 1 60 60 GLN N N 60 120.680 120.680 121.524 -0.844 25277 62 1 1 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.632 -0.142 25277 63 1 1 . 1 1 60 60 GLN C C 60 173.640 173.640 173.196 0.444 25277 64 1 1 . 1 1 60 60 GLN CA C 60 55.480 55.480 54.781 0.699 25277 65 1 1 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.161 -0.171 25277 66 1 1 . 1 1 60 60 GLN H H 60 8.930 8.930 8.322 0.608 25277 67 1 1 . 1 1 61 61 ASP N N 61 126.170 126.170 121.475 4.695 25277 68 1 1 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.877 0.173 25277 69 1 1 . 1 1 61 61 ASP C C 61 175.000 175.000 175.139 -0.139 25277 70 1 1 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.184 0.696 25277 71 1 1 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.669 -0.899 25277 72 1 1 . 1 1 61 61 ASP H H 61 8.540 8.540 8.472 0.068 25277 73 1 1 . 1 1 62 62 ILE N N 62 121.100 121.100 124.657 -3.557 25277 74 1 1 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.573 0.207 25277 75 1 1 . 1 1 62 62 ILE C C 62 171.480 171.480 173.726 -2.246 25277 76 1 1 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.705 0.385 25277 77 1 1 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.162 0.978 25277 78 1 1 . 1 1 62 62 ILE H H 62 8.970 8.970 8.412 0.558 25277 79 1 1 . 1 1 63 63 SER N N 63 119.430 119.430 120.113 -0.683 25277 80 1 1 . 1 1 63 63 SER HA H 63 4.680 4.680 4.542 0.138 25277 81 1 1 . 1 1 63 63 SER C C 63 174.030 174.030 174.387 -0.357 25277 82 1 1 . 1 1 63 63 SER CA C 63 56.550 56.550 56.446 0.104 25277 83 1 1 . 1 1 63 63 SER CB C 63 67.320 67.320 66.257 1.063 25277 84 1 1 . 1 1 63 63 SER H H 63 8.520 8.520 8.512 0.008 25277 85 1 1 . 1 1 64 64 GLU N N 64 121.250 121.250 119.219 2.031 25277 86 1 1 . 1 1 64 64 GLU HA H 64 2.770 2.770 2.944 -0.174 25277 87 1 1 . 1 1 64 64 GLU C C 64 177.190 177.190 177.856 -0.666 25277 88 1 1 . 1 1 64 64 GLU CA C 64 58.590 58.590 58.924 -0.334 25277 89 1 1 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.723 -0.583 25277 90 1 1 . 1 1 64 64 GLU H H 64 7.400 7.400 7.720 -0.320 25277 91 1 1 . 1 1 65 65 ALA N N 65 119.250 119.250 121.456 -2.206 25277 92 1 1 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.918 -0.058 25277 93 1 1 . 1 1 65 65 ALA C C 65 179.630 179.630 179.832 -0.202 25277 94 1 1 . 1 1 65 65 ALA CA C 65 53.810 53.810 54.630 -0.820 25277 95 1 1 . 1 1 65 65 ALA CB C 65 18.400 18.400 17.956 0.444 25277 96 1 1 . 1 1 65 65 ALA H H 65 7.700 7.700 7.684 0.016 25277 97 1 1 . 1 1 66 66 ASN N N 66 112.360 112.360 116.144 -3.784 25277 98 1 1 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.576 0.454 25277 99 1 1 . 1 1 66 66 ASN C C 66 174.580 174.580 176.757 -2.177 25277 100 1 1 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.686 -0.136 25277 101 1 1 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.573 1.357 25277 102 1 1 . 1 1 66 66 ASN H H 66 7.960 7.960 7.384 0.576 25277 103 1 1 . 1 1 67 67 LEU N N 67 115.390 115.390 118.260 -2.870 25277 104 1 1 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.406 0.244 25277 105 1 1 . 1 1 67 67 LEU C C 67 176.500 176.500 176.075 0.425 25277 106 1 1 . 1 1 67 67 LEU CA C 67 54.350 54.350 54.686 -0.336 25277 107 1 1 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.044 2.626 25277 108 1 1 . 1 1 67 67 LEU H H 67 7.050 7.050 7.488 -0.438 25277 109 1 1 . 1 1 68 68 ALA N N 68 125.680 125.680 121.596 4.084 25277 110 1 1 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.728 0.162 25277 111 1 1 . 1 1 68 68 ALA C C 68 177.480 177.480 177.773 -0.293 25277 112 1 1 . 1 1 68 68 ALA CA C 68 53.550 53.550 53.697 -0.147 25277 113 1 1 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.289 -0.139 25277 114 1 1 . 1 1 68 68 ALA H H 68 8.880 8.880 8.011 0.869 25277 115 1 1 . 1 1 69 69 TYR N N 69 119.780 119.780 118.772 1.008 25277 116 1 1 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.301 0.189 25277 117 1 1 . 1 1 69 69 TYR C C 69 175.340 175.340 177.193 -1.853 25277 118 1 1 . 1 1 69 69 TYR CA C 69 58.640 58.640 61.046 -2.406 25277 119 1 1 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.144 -0.864 25277 120 1 1 . 1 1 69 69 TYR H H 69 7.420 7.420 8.360 -0.940 25277 121 1 1 . 1 1 70 70 LEU N N 70 118.820 118.820 116.745 2.075 25277 122 1 1 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.177 0.113 25277 123 1 1 . 1 1 70 70 LEU C C 70 176.770 176.770 177.459 -0.689 25277 124 1 1 . 1 1 70 70 LEU CA C 70 53.880 53.880 55.501 -1.621 25277 125 1 1 . 1 1 70 70 LEU CB C 70 41.300 41.300 41.636 -0.336 25277 126 1 1 . 1 1 70 70 LEU H H 70 7.690 7.690 7.502 0.188 25277 127 1 1 . 1 1 71 71 TRP N N 71 124.110 124.110 122.901 1.209 25277 128 1 1 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.551 0.039 25277 129 1 1 . 1 1 71 71 TRP CA C 71 54.150 54.150 55.956 -1.806 25277 130 1 1 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.410 -0.200 25277 131 1 1 . 1 1 71 71 TRP H H 71 8.130 8.130 7.703 0.427 25277 132 1 1 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.391 0.189 25277 133 1 1 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.127 0.463 25277 134 1 1 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.744 -1.684 25277 135 1 1 . 1 1 73 73 LEU N N 73 118.760 118.760 117.968 0.792 25277 136 1 1 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.523 0.877 25277 137 1 1 . 1 1 73 73 LEU C C 73 176.620 176.620 178.227 -1.607 25277 138 1 1 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.710 -0.660 25277 139 1 1 . 1 1 73 73 LEU CB C 73 44.260 44.260 42.624 1.636 25277 140 1 1 . 1 1 73 73 LEU H H 73 5.190 5.190 6.549 -1.359 25277 141 1 1 . 1 1 74 74 THR N N 74 110.120 110.120 115.370 -5.250 25277 142 1 1 . 1 1 74 74 THR HA H 74 4.250 4.250 4.196 0.054 25277 143 1 1 . 1 1 74 74 THR C C 74 176.080 176.080 175.623 0.457 25277 144 1 1 . 1 1 74 74 THR CA C 74 62.690 62.690 64.223 -1.533 25277 145 1 1 . 1 1 74 74 THR CB C 74 67.930 67.930 69.311 -1.381 25277 146 1 1 . 1 1 74 74 THR H H 74 9.010 9.010 8.627 0.383 25277 147 1 1 . 1 1 75 75 VAL N N 75 113.030 113.030 117.849 -4.819 25277 148 1 1 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.213 0.597 25277 149 1 1 . 1 1 75 75 VAL C C 75 176.010 176.010 177.215 -1.205 25277 150 1 1 . 1 1 75 75 VAL CA C 75 59.100 59.100 62.214 -3.114 25277 151 1 1 . 1 1 75 75 VAL CB C 75 33.220 33.220 32.586 0.634 25277 152 1 1 . 1 1 75 75 VAL H H 75 6.660 6.660 7.686 -1.026 25277 153 1 1 . 1 1 76 76 ASP N N 76 119.590 119.590 124.750 -5.160 25277 154 1 1 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.591 -0.101 25277 155 1 1 . 1 1 76 76 ASP C C 76 175.060 175.060 175.953 -0.893 25277 156 1 1 . 1 1 76 76 ASP CA C 76 55.110 55.110 57.180 -2.070 25277 157 1 1 . 1 1 76 76 ASP CB C 76 41.300 41.300 41.180 0.120 25277 158 1 1 . 1 1 76 76 ASP H H 76 8.770 8.770 9.058 -0.288 25277 159 1 1 . 1 1 77 77 HIS N N 77 113.300 113.300 112.042 1.258 25277 160 1 1 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.676 0.414 25277 161 1 1 . 1 1 77 77 HIS C C 77 171.370 171.370 173.842 -2.472 25277 162 1 1 . 1 1 77 77 HIS CA C 77 55.590 55.590 54.503 1.087 25277 163 1 1 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.599 -2.409 25277 164 1 1 . 1 1 77 77 HIS H H 77 7.650 7.650 7.674 -0.024 25277 165 1 1 . 1 1 78 78 GLY N N 78 101.350 101.350 105.830 -4.480 25277 166 1 1 . 1 1 78 78 GLY C C 78 172.110 172.110 172.220 -0.110 25277 167 1 1 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.864 -0.054 25277 168 1 1 . 1 1 78 78 GLY H H 78 8.450 8.450 8.738 -0.288 25277 169 1 1 . 1 1 79 79 THR N N 79 120.230 120.230 116.974 3.256 25277 170 1 1 . 1 1 79 79 THR HA H 79 5.110 5.110 4.889 0.221 25277 171 1 1 . 1 1 79 79 THR C C 79 172.920 172.920 173.857 -0.937 25277 172 1 1 . 1 1 79 79 THR CA C 79 61.480 61.480 61.659 -0.179 25277 173 1 1 . 1 1 79 79 THR CB C 79 72.130 72.130 70.750 1.380 25277 174 1 1 . 1 1 79 79 THR H H 79 8.080 8.080 8.493 -0.413 25277 175 1 1 . 1 1 80 80 ILE N N 80 119.620 119.620 119.899 -0.279 25277 176 1 1 . 1 1 80 80 ILE HA H 80 5.140 5.140 5.015 0.125 25277 177 1 1 . 1 1 80 80 ILE C C 80 174.340 174.340 174.174 0.166 25277 178 1 1 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.354 -0.004 25277 179 1 1 . 1 1 80 80 ILE CB C 80 39.550 39.550 40.738 -1.188 25277 180 1 1 . 1 1 80 80 ILE H H 80 8.970 8.970 8.667 0.303 25277 181 1 1 . 1 1 81 81 GLU N N 81 119.960 119.960 125.166 -5.206 25277 182 1 1 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.063 -0.063 25277 183 1 1 . 1 1 81 81 GLU C C 81 176.130 176.130 174.472 1.658 25277 184 1 1 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.947 -0.386 25277 185 1 1 . 1 1 81 81 GLU CB C 81 33.390 33.390 34.518 -1.128 25277 186 1 1 . 1 1 81 81 GLU H H 81 8.350 8.350 8.292 0.058 25277 187 1 1 . 1 1 82 82 CYS N N 82 123.110 123.110 124.563 -1.453 25277 188 1 1 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.121 -0.191 25277 189 1 1 . 1 1 82 82 CYS C C 82 174.430 174.430 175.133 -0.703 25277 190 1 1 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.062 -4.822 25277 191 1 1 . 1 1 82 82 CYS CB C 82 43.720 43.720 26.691 17.029 25277 192 1 1 . 1 1 82 82 CYS H H 82 8.220 8.220 8.390 -0.170 25277 193 1 1 . 1 1 83 83 LEU N N 83 131.660 131.660 127.160 4.500 25277 194 1 1 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.680 -0.150 25277 195 1 1 . 1 1 83 83 LEU CA C 83 53.900 53.900 53.115 0.785 25277 196 1 1 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.159 -1.959 25277 197 1 1 . 1 1 83 83 LEU H H 83 8.910 8.910 8.165 0.745 25277 198 1 1 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.228 0.142 25277 199 1 1 . 1 1 84 84 PRO CA C 84 63.190 63.190 65.190 -2.000 25277 200 1 1 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.705 0.225 25277 201 1 1 . 1 1 85 85 SER N N 85 117.620 117.620 112.613 5.007 25277 202 1 1 . 1 1 85 85 SER HA H 85 3.870 3.870 4.428 -0.558 25277 203 1 1 . 1 1 85 85 SER C C 85 174.350 174.350 174.191 0.159 25277 204 1 1 . 1 1 85 85 SER CA C 85 58.970 58.970 58.569 0.401 25277 205 1 1 . 1 1 85 85 SER CB C 85 63.820 63.820 62.883 0.937 25277 206 1 1 . 1 1 85 85 SER H H 85 7.660 7.660 8.173 -0.513 25277 207 1 1 . 1 1 86 86 ASP N N 86 117.590 117.590 118.029 -0.439 25277 208 1 1 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.330 -0.190 25277 209 1 1 . 1 1 86 86 ASP C C 86 174.480 174.480 174.099 0.381 25277 210 1 1 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.740 -0.760 25277 211 1 1 . 1 1 86 86 ASP CB C 86 37.850 37.850 38.800 -0.950 25277 212 1 1 . 1 1 86 86 ASP H H 86 8.490 8.490 8.401 0.089 25277 213 1 1 . 1 1 87 87 ASN N N 87 117.160 117.160 117.151 0.009 25277 214 1 1 . 1 1 87 87 ASN HA H 87 4.530 4.530 5.060 -0.530 25277 215 1 1 . 1 1 87 87 ASN CA C 87 52.480 52.480 52.185 0.295 25277 216 1 1 . 1 1 87 87 ASN CB C 87 40.040 40.040 40.918 -0.878 25277 217 1 1 . 1 1 87 87 ASN H H 87 7.260 7.260 7.643 -0.383 25277 218 1 1 . 1 1 88 88 ALA HA H 88 4.730 4.730 4.702 0.028 25277 219 1 1 . 1 1 88 88 ALA C C 88 174.620 174.620 176.239 -1.619 25277 220 1 1 . 1 1 88 88 ALA CA C 88 51.230 51.230 51.057 0.173 25277 221 1 1 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.063 0.477 25277 222 1 1 . 1 1 89 89 VAL N N 89 116.580 116.580 119.070 -2.490 25277 223 1 1 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.069 0.031 25277 224 1 1 . 1 1 89 89 VAL C C 89 172.750 172.750 173.577 -0.827 25277 225 1 1 . 1 1 89 89 VAL CA C 89 58.980 58.980 59.428 -0.448 25277 226 1 1 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.362 0.858 25277 227 1 1 . 1 1 89 89 VAL H H 89 8.740 8.740 8.286 0.454 25277 228 1 1 . 1 1 90 90 PHE N N 90 120.300 120.300 123.721 -3.421 25277 229 1 1 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.248 -0.098 25277 230 1 1 . 1 1 90 90 PHE C C 90 172.910 172.910 173.639 -0.729 25277 231 1 1 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.378 0.422 25277 232 1 1 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.631 1.019 25277 233 1 1 . 1 1 90 90 PHE H H 90 8.950 8.950 9.094 -0.144 25277 234 1 1 . 1 1 91 91 VAL N N 91 129.020 129.020 128.236 0.784 25277 235 1 1 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.658 -0.198 25277 236 1 1 . 1 1 91 91 VAL C C 91 175.910 175.910 174.106 1.804 25277 237 1 1 . 1 1 91 91 VAL CA C 91 60.780 60.780 59.352 1.428 25277 238 1 1 . 1 1 91 91 VAL CB C 91 32.020 32.020 33.316 -1.296 25277 239 1 1 . 1 1 91 91 VAL H H 91 9.090 9.090 8.621 0.469 25277 240 1 1 . 1 1 92 92 ALA N N 92 129.760 129.760 129.982 -0.222 25277 241 1 1 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.735 -0.235 25277 242 1 1 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.641 2.209 25277 243 1 1 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.601 -1.551 25277 244 1 1 . 1 1 92 92 ALA H H 92 8.680 8.680 8.414 0.266 25277 245 1 1 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.065 0.095 25277 246 1 1 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.082 0.318 25277 247 1 1 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.610 0.330 25277 248 1 1 . 1 1 94 94 ASP N N 94 113.220 113.220 114.985 -1.765 25277 249 1 1 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.462 -0.042 25277 250 1 1 . 1 1 94 94 ASP C C 94 176.980 176.980 177.475 -0.495 25277 251 1 1 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.986 -0.456 25277 252 1 1 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.867 -0.287 25277 253 1 1 . 1 1 94 94 ASP H H 94 7.890 7.890 7.799 0.091 25277 254 1 1 . 1 1 95 95 GLY N N 95 109.120 109.120 108.324 0.796 25277 255 1 1 . 1 1 95 95 GLY C C 95 174.440 174.440 174.311 0.129 25277 256 1 1 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.106 -0.546 25277 257 1 1 . 1 1 95 95 GLY H H 95 8.500 8.500 8.144 0.356 25277 258 1 1 . 1 1 96 96 THR N N 96 120.350 120.350 118.513 1.837 25277 259 1 1 . 1 1 96 96 THR HA H 96 3.780 3.780 4.406 -0.626 25277 260 1 1 . 1 1 96 96 THR C C 96 172.590 172.590 173.369 -0.779 25277 261 1 1 . 1 1 96 96 THR CA C 96 64.660 64.660 61.851 2.809 25277 262 1 1 . 1 1 96 96 THR CB C 96 68.330 68.330 69.893 -1.563 25277 263 1 1 . 1 1 96 96 THR H H 96 8.100 8.100 8.432 -0.332 25277 264 1 1 . 1 1 97 97 THR N N 97 122.660 122.660 121.200 1.460 25277 265 1 1 . 1 1 97 97 THR HA H 97 4.590 4.590 4.712 -0.122 25277 266 1 1 . 1 1 97 97 THR C C 97 173.000 173.000 173.112 -0.112 25277 267 1 1 . 1 1 97 97 THR CA C 97 62.700 62.700 61.784 0.916 25277 268 1 1 . 1 1 97 97 THR CB C 97 68.840 68.840 69.789 -0.949 25277 269 1 1 . 1 1 97 97 THR H H 97 7.850 7.850 8.282 -0.432 25277 270 1 1 . 1 1 98 98 TYR N N 98 122.890 122.890 124.144 -1.254 25277 271 1 1 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.101 -0.161 25277 272 1 1 . 1 1 98 98 TYR C C 98 178.970 178.970 174.839 4.131 25277 273 1 1 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.075 0.435 25277 274 1 1 . 1 1 98 98 TYR CB C 98 42.950 42.950 41.832 1.118 25277 275 1 1 . 1 1 98 98 TYR H H 98 9.460 9.460 9.105 0.355 25277 276 1 1 . 1 1 99 99 ALA N N 99 121.760 121.760 123.964 -2.204 25277 277 1 1 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.667 -0.557 25277 278 1 1 . 1 1 99 99 ALA C C 99 178.010 178.010 176.607 1.403 25277 279 1 1 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.200 1.070 25277 280 1 1 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.608 2.442 25277 281 1 1 . 1 1 99 99 ALA H H 99 9.110 9.110 8.868 0.242 25277 282 1 1 . 1 1 100 100 LEU N N 100 119.330 119.330 124.838 -5.508 25277 283 1 1 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.247 0.223 25277 284 1 1 . 1 1 100 100 LEU C C 100 174.720 174.720 177.318 -2.598 25277 285 1 1 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.539 -2.399 25277 286 1 1 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.689 1.941 25277 287 1 1 . 1 1 100 100 LEU H H 100 8.950 8.950 8.304 0.646 25277 288 1 1 . 1 1 101 101 ASN N N 101 112.600 112.600 115.689 -3.089 25277 289 1 1 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.793 0.127 25277 290 1 1 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.143 -1.213 25277 291 1 1 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.514 1.086 25277 292 1 1 . 1 1 101 101 ASN H H 101 7.550 7.550 7.574 -0.024 25277 293 1 1 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.345 -0.155 25277 294 1 1 . 1 1 102 102 ASP C C 102 178.770 178.770 178.049 0.721 25277 295 1 1 . 1 1 102 102 ASP CA C 102 56.880 56.880 57.157 -0.277 25277 296 1 1 . 1 1 102 102 ASP CB C 102 39.980 39.980 41.073 -1.093 25277 297 1 1 . 1 1 103 103 ARG N N 103 119.370 119.370 119.635 -0.265 25277 298 1 1 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.096 -0.266 25277 299 1 1 . 1 1 103 103 ARG C C 103 178.550 178.550 178.384 0.166 25277 300 1 1 . 1 1 103 103 ARG CA C 103 59.380 59.380 59.174 0.206 25277 301 1 1 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.933 -0.433 25277 302 1 1 . 1 1 103 103 ARG H H 103 7.970 7.970 8.090 -0.120 25277 303 1 1 . 1 1 104 104 ALA N N 104 120.110 120.110 122.278 -2.168 25277 304 1 1 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.113 0.097 25277 305 1 1 . 1 1 104 104 ALA C C 104 179.510 179.510 179.461 0.049 25277 306 1 1 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.270 -0.520 25277 307 1 1 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.391 1.279 25277 308 1 1 . 1 1 104 104 ALA H H 104 7.610 7.610 8.448 -0.838 25277 309 1 1 . 1 1 105 105 GLU N N 105 120.460 120.460 118.612 1.848 25277 310 1 1 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.070 0.640 25277 311 1 1 . 1 1 105 105 GLU C C 105 181.710 181.710 179.683 2.027 25277 312 1 1 . 1 1 105 105 GLU CA C 105 58.680 58.680 58.865 -0.185 25277 313 1 1 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.592 -0.102 25277 314 1 1 . 1 1 105 105 GLU H H 105 7.750 7.750 7.798 -0.048 25277 315 1 1 . 1 1 106 106 LYS N N 106 121.980 121.980 120.773 1.207 25277 316 1 1 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.080 -0.060 25277 317 1 1 . 1 1 106 106 LYS C C 106 177.890 177.890 178.041 -0.151 25277 318 1 1 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.703 -0.233 25277 319 1 1 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.428 -0.698 25277 320 1 1 . 1 1 106 106 LYS H H 106 8.380 8.380 8.009 0.371 25277 321 1 1 . 1 1 107 107 ALA N N 107 119.850 119.850 118.981 0.869 25277 322 1 1 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.249 0.011 25277 323 1 1 . 1 1 107 107 ALA C C 107 177.210 177.210 177.533 -0.323 25277 324 1 1 . 1 1 107 107 ALA CA C 107 52.270 52.270 52.163 0.107 25277 325 1 1 . 1 1 107 107 ALA CB C 107 18.740 18.740 18.921 -0.181 25277 326 1 1 . 1 1 107 107 ALA H H 107 7.400 7.400 7.650 -0.250 25277 327 1 1 . 1 1 108 108 GLY N N 108 104.560 104.560 105.990 -1.430 25277 328 1 1 . 1 1 108 108 GLY C C 108 174.300 174.300 174.494 -0.194 25277 329 1 1 . 1 1 108 108 GLY CA C 108 44.610 44.610 44.996 -0.386 25277 330 1 1 . 1 1 108 108 GLY H H 108 7.560 7.560 7.794 -0.234 25277 331 1 1 . 1 1 109 109 HIS N N 109 122.550 122.550 120.751 1.799 25277 332 1 1 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.922 -0.152 25277 333 1 1 . 1 1 109 109 HIS CA C 109 54.580 54.580 54.182 0.398 25277 334 1 1 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.500 -0.910 25277 335 1 1 . 1 1 109 109 HIS H H 109 7.590 7.590 7.632 -0.042 25277 336 1 1 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.692 -0.132 25277 337 1 1 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.006 0.724 25277 338 1 1 . 1 1 111 111 PRO CB C 111 32.800 32.800 33.109 -0.309 25277 339 1 1 . 1 1 112 112 ILE N N 112 119.770 119.770 119.532 0.238 25277 340 1 1 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.315 0.545 25277 341 1 1 . 1 1 112 112 ILE C C 112 172.800 172.800 177.437 -4.637 25277 342 1 1 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.284 -2.094 25277 343 1 1 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.265 3.175 25277 344 1 1 . 1 1 112 112 ILE H H 112 7.890 7.890 8.666 -0.776 25277 345 1 1 . 1 1 113 113 THR N N 113 113.610 113.610 116.227 -2.617 25277 346 1 1 . 1 1 113 113 THR HA H 113 3.010 3.010 3.968 -0.958 25277 347 1 1 . 1 1 113 113 THR CA C 113 66.860 66.860 67.921 -1.061 25277 348 1 1 . 1 1 113 113 THR CB C 113 66.920 66.920 67.280 -0.360 25277 349 1 1 . 1 1 113 113 THR H H 113 7.070 7.070 8.492 -1.422 25277 350 1 1 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.332 0.008 25277 351 1 1 . 1 1 114 114 PRO CA C 114 66.080 66.080 65.079 1.001 25277 352 1 1 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.541 0.539 25277 353 1 1 . 1 1 115 115 ILE N N 115 134.770 134.770 109.746 25.024 25277 354 1 1 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.396 0.214 25277 355 1 1 . 1 1 115 115 ILE C C 115 174.800 174.800 174.983 -0.183 25277 356 1 1 . 1 1 115 115 ILE CA C 115 60.000 60.000 59.996 0.004 25277 357 1 1 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.914 -0.054 25277 358 1 1 . 1 1 115 115 ILE H H 115 7.510 7.510 7.577 -0.067 25277 359 1 1 . 1 1 116 116 ARG N N 116 120.890 120.890 122.295 -1.405 25277 360 1 1 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.177 -0.207 25277 361 1 1 . 1 1 116 116 ARG C C 116 174.910 174.910 175.846 -0.936 25277 362 1 1 . 1 1 116 116 ARG CA C 116 57.780 57.780 55.744 2.036 25277 363 1 1 . 1 1 116 116 ARG CB C 116 31.870 31.870 31.380 0.490 25277 364 1 1 . 1 1 116 116 ARG H H 116 7.280 7.280 7.545 -0.265 25277 365 1 1 . 1 1 117 117 ALA N N 117 125.400 125.400 128.535 -3.135 25277 366 1 1 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.340 -0.110 25277 367 1 1 . 1 1 117 117 ALA C C 117 176.290 176.290 175.796 0.494 25277 368 1 1 . 1 1 117 117 ALA CA C 117 50.780 50.780 51.561 -0.781 25277 369 1 1 . 1 1 117 117 ALA CB C 117 20.290 20.290 20.326 -0.036 25277 370 1 1 . 1 1 117 117 ALA H H 117 8.150 8.150 8.318 -0.168 25277 371 1 1 . 1 1 118 118 LYS N N 118 119.890 119.890 122.941 -3.051 25277 372 1 1 . 1 1 118 118 LYS HA H 118 4.590 4.590 3.693 0.897 25277 373 1 1 . 1 1 118 118 LYS C C 118 177.400 177.400 176.321 1.079 25277 374 1 1 . 1 1 118 118 LYS CA C 118 55.670 55.670 54.916 0.754 25277 375 1 1 . 1 1 118 118 LYS CB C 118 34.510 34.510 33.385 1.125 25277 376 1 1 . 1 1 118 118 LYS H H 118 8.360 8.360 8.288 0.072 25277 377 1 1 . 1 1 119 119 GLY N N 119 108.630 108.630 112.466 -3.836 25277 378 1 1 . 1 1 119 119 GLY CA C 119 43.610 43.610 43.941 -0.331 25277 379 1 1 . 1 1 119 119 GLY H H 119 8.320 8.320 7.930 0.390 25277 380 1 1 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.703 0.197 25277 381 1 1 . 1 1 124 124 TYR C C 124 177.430 177.430 176.298 1.132 25277 382 1 1 . 1 1 124 124 TYR CA C 124 57.970 57.970 57.047 0.923 25277 383 1 1 . 1 1 124 124 TYR CB C 124 38.650 38.650 40.817 -2.167 25277 384 1 1 . 1 1 125 125 ILE N N 125 123.670 123.670 122.544 1.126 25277 385 1 1 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.120 -0.280 25277 386 1 1 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.663 0.067 25277 387 1 1 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.274 0.236 25277 388 1 1 . 1 1 125 125 ILE H H 125 8.340 8.340 8.124 0.216 25277 389 1 1 . 1 1 126 126 SER HA H 126 4.070 4.070 4.345 -0.275 25277 390 1 1 . 1 1 126 126 SER C C 126 176.290 176.290 175.036 1.254 25277 391 1 1 . 1 1 126 126 SER CA C 126 59.190 59.190 58.798 0.392 25277 392 1 1 . 1 1 126 126 SER CB C 126 63.200 63.200 63.605 -0.405 25277 393 1 1 . 1 1 127 127 LEU N N 127 127.030 127.030 124.463 2.567 25277 394 1 1 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.355 -0.415 25277 395 1 1 . 1 1 127 127 LEU C C 127 176.660 176.660 178.210 -1.550 25277 396 1 1 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.499 0.611 25277 397 1 1 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.681 1.249 25277 398 1 1 . 1 1 127 127 LEU H H 127 8.790 8.790 8.366 0.424 25277 399 1 1 . 1 1 128 128 GLY N N 128 106.600 106.600 108.972 -2.372 25277 400 1 1 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.594 0.936 25277 401 1 1 . 1 1 128 128 GLY H H 128 8.450 8.450 8.308 0.142 25277 402 1 1 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.044 0.186 25277 403 1 1 . 1 1 129 129 ALA C C 129 180.410 180.410 179.177 1.233 25277 404 1 1 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.552 0.368 25277 405 1 1 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.318 0.812 25277 406 1 1 . 1 1 130 130 LEU N N 130 122.550 122.550 120.661 1.889 25277 407 1 1 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.053 -0.133 25277 408 1 1 . 1 1 130 130 LEU C C 130 179.020 179.020 178.470 0.550 25277 409 1 1 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.435 0.195 25277 410 1 1 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.647 0.493 25277 411 1 1 . 1 1 130 130 LEU H H 130 8.040 8.040 7.468 0.572 25277 412 1 1 . 1 1 131 131 LEU N N 131 121.910 121.910 119.410 2.500 25277 413 1 1 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.870 0.050 25277 414 1 1 . 1 1 131 131 LEU C C 131 177.910 177.910 178.407 -0.497 25277 415 1 1 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.095 0.475 25277 416 1 1 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.535 -0.815 25277 417 1 1 . 1 1 131 131 LEU H H 131 9.060 9.060 7.853 1.207 25277 418 1 1 . 1 1 132 132 SER N N 132 115.530 115.530 115.189 0.341 25277 419 1 1 . 1 1 132 132 SER HA H 132 3.970 3.970 4.074 -0.104 25277 420 1 1 . 1 1 132 132 SER C C 132 177.140 177.140 176.592 0.548 25277 421 1 1 . 1 1 132 132 SER CA C 132 62.340 62.340 62.058 0.282 25277 422 1 1 . 1 1 132 132 SER CB C 132 62.370 62.370 62.922 -0.552 25277 423 1 1 . 1 1 132 132 SER H H 132 8.730 8.730 8.167 0.563 25277 424 1 1 . 1 1 133 133 THR N N 133 116.960 116.960 118.972 -2.012 25277 425 1 1 . 1 1 133 133 THR HA H 133 3.860 3.860 4.054 -0.194 25277 426 1 1 . 1 1 133 133 THR C C 133 175.670 175.670 176.469 -0.799 25277 427 1 1 . 1 1 133 133 THR CA C 133 66.930 66.930 67.283 -0.353 25277 428 1 1 . 1 1 133 133 THR CB C 133 68.880 68.880 68.559 0.321 25277 429 1 1 . 1 1 133 133 THR H H 133 7.750 7.750 7.855 -0.105 25277 430 1 1 . 1 1 134 134 THR N N 134 118.830 118.830 119.304 -0.474 25277 431 1 1 . 1 1 134 134 THR HA H 134 3.780 3.780 4.062 -0.282 25277 432 1 1 . 1 1 134 134 THR C C 134 176.750 176.750 176.227 0.523 25277 433 1 1 . 1 1 134 134 THR CA C 134 67.650 67.650 67.442 0.208 25277 434 1 1 . 1 1 134 134 THR CB C 134 67.560 67.560 68.455 -0.895 25277 435 1 1 . 1 1 134 134 THR H H 134 7.570 7.570 7.715 -0.145 25277 436 1 1 . 1 1 135 135 LEU N N 135 121.420 121.420 121.751 -0.331 25277 437 1 1 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.900 0.590 25277 438 1 1 . 1 1 135 135 LEU C C 135 180.050 180.050 178.712 1.338 25277 439 1 1 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.267 -1.257 25277 440 1 1 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.372 -0.762 25277 441 1 1 . 1 1 135 135 LEU H H 135 8.650 8.650 8.279 0.371 25277 442 1 1 . 1 1 136 136 ASN N N 136 117.010 117.010 117.357 -0.347 25277 443 1 1 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.447 0.093 25277 444 1 1 . 1 1 136 136 ASN C C 136 175.980 175.980 177.888 -1.908 25277 445 1 1 . 1 1 136 136 ASN CA C 136 54.770 54.770 55.787 -1.017 25277 446 1 1 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.273 0.167 25277 447 1 1 . 1 1 136 136 ASN H H 136 7.360 7.360 7.861 -0.501 25277 448 1 1 . 1 1 137 137 LEU N N 137 116.940 116.940 120.662 -3.722 25277 449 1 1 . 1 1 137 137 LEU HA H 137 4.160 4.160 4.036 0.124 25277 450 1 1 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.695 -2.265 25277 451 1 1 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.613 -0.043 25277 452 1 1 . 1 1 137 137 LEU H H 137 7.810 7.810 7.550 0.260 25277 453 1 1 . 1 1 138 138 CYS N N 138 115.430 115.430 115.314 0.116 25277 454 1 1 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.236 0.174 25277 455 1 1 . 1 1 138 138 CYS CA C 138 55.480 55.480 61.123 -5.643 25277 456 1 1 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.321 14.879 25277 457 1 1 . 1 1 138 138 CYS H H 138 7.450 7.450 7.940 -0.490 25277 458 1 1 . 1 1 139 139 GLY C C 139 178.800 178.800 174.053 4.747 25277 459 1 1 . 1 1 139 139 GLY CA C 139 45.500 45.500 45.073 0.427 25277 460 1 1 . 1 1 140 140 LYS N N 140 119.830 119.830 121.640 -1.810 25277 461 1 1 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.304 0.016 25277 462 1 1 . 1 1 140 140 LYS C C 140 175.820 175.820 175.970 -0.150 25277 463 1 1 . 1 1 140 140 LYS CA C 140 55.680 55.680 57.021 -1.341 25277 464 1 1 . 1 1 140 140 LYS CB C 140 32.800 32.800 32.977 -0.177 25277 465 1 1 . 1 1 140 140 LYS H H 140 7.760 7.760 7.498 0.262 25277 466 1 2 . 1 1 27 27 PRO CA C 27 63.230 63.230 62.361 0.869 25277 467 1 2 . 1 1 27 27 PRO CB C 27 32.050 32.050 32.440 -0.390 25277 468 1 2 . 1 1 28 28 ASP N N 28 120.030 120.030 118.754 1.276 25277 469 1 2 . 1 1 28 28 ASP C C 28 176.130 176.130 175.479 0.651 25277 470 1 2 . 1 1 28 28 ASP CA C 28 54.170 54.170 53.287 0.883 25277 471 1 2 . 1 1 28 28 ASP CB C 28 40.860 40.860 41.336 -0.476 25277 472 1 2 . 1 1 28 28 ASP H H 28 8.260 8.260 8.207 0.053 25277 473 1 2 . 1 1 29 29 LEU N N 29 123.030 123.030 120.501 2.529 25277 474 1 2 . 1 1 29 29 LEU C C 29 177.870 177.870 177.753 0.117 25277 475 1 2 . 1 1 29 29 LEU CA C 29 55.160 55.160 54.499 0.661 25277 476 1 2 . 1 1 29 29 LEU CB C 29 42.270 42.270 42.732 -0.462 25277 477 1 2 . 1 1 29 29 LEU H H 29 8.120 8.120 8.186 -0.066 25277 478 1 2 . 1 1 30 30 GLY N N 30 109.350 109.350 109.336 0.014 25277 479 1 2 . 1 1 30 30 GLY CA C 30 45.340 45.340 44.221 1.119 25277 480 1 2 . 1 1 30 30 GLY H H 30 8.410 8.410 8.243 0.167 25277 481 1 2 . 1 1 44 44 PRO CA C 44 63.590 63.590 61.932 1.658 25277 482 1 2 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.160 -0.170 25277 483 1 2 . 1 1 45 45 ALA N N 45 122.140 122.140 121.468 0.672 25277 484 1 2 . 1 1 45 45 ALA CA C 45 52.670 52.670 52.020 0.650 25277 485 1 2 . 1 1 45 45 ALA H H 45 8.350 8.350 7.981 0.369 25277 486 1 2 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.402 -0.102 25277 487 1 2 . 1 1 49 49 PRO CA C 49 62.950 62.950 63.167 -0.217 25277 488 1 2 . 1 1 49 49 PRO CB C 49 31.990 31.990 31.867 0.123 25277 489 1 2 . 1 1 50 50 VAL N N 50 124.190 124.190 126.188 -1.998 25277 490 1 2 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.426 -0.106 25277 491 1 2 . 1 1 50 50 VAL CA C 50 59.850 59.850 59.020 0.830 25277 492 1 2 . 1 1 50 50 VAL CB C 50 32.480 32.480 32.166 0.314 25277 493 1 2 . 1 1 50 50 VAL H H 50 8.070 8.070 8.185 -0.115 25277 494 1 2 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.311 0.039 25277 495 1 2 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.375 -0.445 25277 496 1 2 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.136 -0.156 25277 497 1 2 . 1 1 52 52 LEU N N 52 124.500 124.500 122.423 2.077 25277 498 1 2 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.288 0.202 25277 499 1 2 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.780 -0.890 25277 500 1 2 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.837 0.353 25277 501 1 2 . 1 1 52 52 LEU H H 52 8.360 8.360 8.231 0.129 25277 502 1 2 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.619 -0.209 25277 503 1 2 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.453 -0.123 25277 504 1 2 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.262 -0.272 25277 505 1 2 . 1 1 54 54 SER N N 54 117.380 117.380 116.516 0.864 25277 506 1 2 . 1 1 54 54 SER HA H 54 4.600 4.600 4.428 0.172 25277 507 1 2 . 1 1 54 54 SER CA C 54 56.710 56.710 57.155 -0.445 25277 508 1 2 . 1 1 54 54 SER CB C 54 62.500 62.500 63.077 -0.577 25277 509 1 2 . 1 1 54 54 SER H H 54 8.400 8.400 8.235 0.165 25277 510 1 2 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.541 0.009 25277 511 1 2 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.507 0.033 25277 512 1 2 . 1 1 55 55 PRO CB C 55 32.620 32.620 32.350 0.270 25277 513 1 2 . 1 1 57 57 SER HA H 57 4.420 4.420 4.306 0.114 25277 514 1 2 . 1 1 57 57 SER CA C 57 57.580 57.580 60.118 -2.538 25277 515 1 2 . 1 1 57 57 SER CB C 57 63.780 63.780 63.265 0.515 25277 516 1 2 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.277 0.713 25277 517 1 2 . 1 1 58 58 ASN C C 58 172.230 172.230 173.985 -1.755 25277 518 1 2 . 1 1 58 58 ASN CA C 58 53.670 53.670 54.901 -1.231 25277 519 1 2 . 1 1 58 58 ASN CB C 58 37.850 37.850 37.167 0.683 25277 520 1 2 . 1 1 59 59 LYS N N 59 117.660 117.660 114.569 3.091 25277 521 1 2 . 1 1 59 59 LYS HA H 59 5.360 5.360 4.926 0.434 25277 522 1 2 . 1 1 59 59 LYS C C 59 175.120 175.120 174.036 1.084 25277 523 1 2 . 1 1 59 59 LYS CA C 59 54.860 54.860 55.547 -0.688 25277 524 1 2 . 1 1 59 59 LYS CB C 59 36.450 36.450 36.400 0.050 25277 525 1 2 . 1 1 59 59 LYS H H 59 7.640 7.640 7.756 -0.116 25277 526 1 2 . 1 1 60 60 GLN N N 60 120.680 120.680 118.302 2.378 25277 527 1 2 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.680 -0.190 25277 528 1 2 . 1 1 60 60 GLN C C 60 173.640 173.640 173.433 0.207 25277 529 1 2 . 1 1 60 60 GLN CA C 60 55.480 55.480 54.767 0.713 25277 530 1 2 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.181 -0.191 25277 531 1 2 . 1 1 60 60 GLN H H 60 8.930 8.930 8.317 0.613 25277 532 1 2 . 1 1 61 61 ASP N N 61 126.170 126.170 121.654 4.516 25277 533 1 2 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.892 0.158 25277 534 1 2 . 1 1 61 61 ASP C C 61 175.000 175.000 175.170 -0.170 25277 535 1 2 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.281 0.599 25277 536 1 2 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.504 -0.734 25277 537 1 2 . 1 1 61 61 ASP H H 61 8.540 8.540 8.541 -0.001 25277 538 1 2 . 1 1 62 62 ILE N N 62 121.100 121.100 124.958 -3.858 25277 539 1 2 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.566 0.214 25277 540 1 2 . 1 1 62 62 ILE C C 62 171.480 171.480 173.631 -2.151 25277 541 1 2 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.818 0.272 25277 542 1 2 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.154 0.986 25277 543 1 2 . 1 1 62 62 ILE H H 62 8.970 8.970 8.337 0.633 25277 544 1 2 . 1 1 63 63 SER N N 63 119.430 119.430 120.036 -0.606 25277 545 1 2 . 1 1 63 63 SER HA H 63 4.680 4.680 4.586 0.094 25277 546 1 2 . 1 1 63 63 SER C C 63 174.030 174.030 174.498 -0.468 25277 547 1 2 . 1 1 63 63 SER CA C 63 56.550 56.550 56.540 0.010 25277 548 1 2 . 1 1 63 63 SER CB C 63 67.320 67.320 66.263 1.057 25277 549 1 2 . 1 1 63 63 SER H H 63 8.520 8.520 8.213 0.307 25277 550 1 2 . 1 1 64 64 GLU N N 64 121.250 121.250 119.572 1.678 25277 551 1 2 . 1 1 64 64 GLU HA H 64 2.770 2.770 2.916 -0.146 25277 552 1 2 . 1 1 64 64 GLU C C 64 177.190 177.190 177.853 -0.663 25277 553 1 2 . 1 1 64 64 GLU CA C 64 58.590 58.590 58.854 -0.264 25277 554 1 2 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.647 -0.507 25277 555 1 2 . 1 1 64 64 GLU H H 64 7.400 7.400 7.736 -0.336 25277 556 1 2 . 1 1 65 65 ALA N N 65 119.250 119.250 121.658 -2.408 25277 557 1 2 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.826 0.034 25277 558 1 2 . 1 1 65 65 ALA C C 65 179.630 179.630 179.482 0.148 25277 559 1 2 . 1 1 65 65 ALA CA C 65 53.810 53.810 55.084 -1.274 25277 560 1 2 . 1 1 65 65 ALA CB C 65 18.400 18.400 18.198 0.202 25277 561 1 2 . 1 1 65 65 ALA H H 65 7.700 7.700 8.289 -0.589 25277 562 1 2 . 1 1 66 66 ASN N N 66 112.360 112.360 115.699 -3.339 25277 563 1 2 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.445 0.585 25277 564 1 2 . 1 1 66 66 ASN C C 66 174.580 174.580 176.849 -2.269 25277 565 1 2 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.627 -0.077 25277 566 1 2 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.510 1.420 25277 567 1 2 . 1 1 66 66 ASN H H 66 7.960 7.960 7.489 0.471 25277 568 1 2 . 1 1 67 67 LEU N N 67 115.390 115.390 118.473 -3.083 25277 569 1 2 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.353 0.297 25277 570 1 2 . 1 1 67 67 LEU C C 67 176.500 176.500 176.323 0.177 25277 571 1 2 . 1 1 67 67 LEU CA C 67 54.350 54.350 55.180 -0.830 25277 572 1 2 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.172 2.498 25277 573 1 2 . 1 1 67 67 LEU H H 67 7.050 7.050 7.497 -0.447 25277 574 1 2 . 1 1 68 68 ALA N N 68 125.680 125.680 121.485 4.195 25277 575 1 2 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.729 0.161 25277 576 1 2 . 1 1 68 68 ALA C C 68 177.480 177.480 177.878 -0.398 25277 577 1 2 . 1 1 68 68 ALA CA C 68 53.550 53.550 53.793 -0.243 25277 578 1 2 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.172 -0.022 25277 579 1 2 . 1 1 68 68 ALA H H 68 8.880 8.880 8.082 0.798 25277 580 1 2 . 1 1 69 69 TYR N N 69 119.780 119.780 118.539 1.241 25277 581 1 2 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.279 0.211 25277 582 1 2 . 1 1 69 69 TYR C C 69 175.340 175.340 177.385 -2.045 25277 583 1 2 . 1 1 69 69 TYR CA C 69 58.640 58.640 60.883 -2.243 25277 584 1 2 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.079 -0.799 25277 585 1 2 . 1 1 69 69 TYR H H 69 7.420 7.420 8.433 -1.013 25277 586 1 2 . 1 1 70 70 LEU N N 70 118.820 118.820 118.368 0.452 25277 587 1 2 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.147 0.143 25277 588 1 2 . 1 1 70 70 LEU C C 70 176.770 176.770 177.146 -0.376 25277 589 1 2 . 1 1 70 70 LEU CA C 70 53.880 53.880 56.245 -2.365 25277 590 1 2 . 1 1 70 70 LEU CB C 70 41.300 41.300 42.106 -0.806 25277 591 1 2 . 1 1 70 70 LEU H H 70 7.690 7.690 7.552 0.138 25277 592 1 2 . 1 1 71 71 TRP N N 71 124.110 124.110 121.641 2.469 25277 593 1 2 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.545 0.045 25277 594 1 2 . 1 1 71 71 TRP CA C 71 54.150 54.150 56.215 -2.065 25277 595 1 2 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.121 0.089 25277 596 1 2 . 1 1 71 71 TRP H H 71 8.130 8.130 7.797 0.333 25277 597 1 2 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.388 0.192 25277 598 1 2 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.181 0.409 25277 599 1 2 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.761 -1.702 25277 600 1 2 . 1 1 73 73 LEU N N 73 118.760 118.760 117.976 0.784 25277 601 1 2 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.612 0.788 25277 602 1 2 . 1 1 73 73 LEU C C 73 176.620 176.620 178.231 -1.611 25277 603 1 2 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.748 -0.698 25277 604 1 2 . 1 1 73 73 LEU CB C 73 44.260 44.260 43.134 1.126 25277 605 1 2 . 1 1 73 73 LEU H H 73 5.190 5.190 6.564 -1.374 25277 606 1 2 . 1 1 74 74 THR N N 74 110.120 110.120 115.188 -5.068 25277 607 1 2 . 1 1 74 74 THR HA H 74 4.250 4.250 4.235 0.015 25277 608 1 2 . 1 1 74 74 THR C C 74 176.080 176.080 175.661 0.419 25277 609 1 2 . 1 1 74 74 THR CA C 74 62.690 62.690 64.109 -1.419 25277 610 1 2 . 1 1 74 74 THR CB C 74 67.930 67.930 69.197 -1.267 25277 611 1 2 . 1 1 74 74 THR H H 74 9.010 9.010 8.623 0.387 25277 612 1 2 . 1 1 75 75 VAL N N 75 113.030 113.030 118.290 -5.260 25277 613 1 2 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.187 0.623 25277 614 1 2 . 1 1 75 75 VAL C C 75 176.010 176.010 177.324 -1.314 25277 615 1 2 . 1 1 75 75 VAL CA C 75 59.100 59.100 62.793 -3.693 25277 616 1 2 . 1 1 75 75 VAL CB C 75 33.220 33.220 32.574 0.646 25277 617 1 2 . 1 1 75 75 VAL H H 75 6.660 6.660 7.599 -0.939 25277 618 1 2 . 1 1 76 76 ASP N N 76 119.590 119.590 124.408 -4.818 25277 619 1 2 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.694 -0.204 25277 620 1 2 . 1 1 76 76 ASP C C 76 175.060 175.060 176.058 -0.998 25277 621 1 2 . 1 1 76 76 ASP CA C 76 55.110 55.110 57.156 -2.046 25277 622 1 2 . 1 1 76 76 ASP CB C 76 41.300 41.300 41.154 0.145 25277 623 1 2 . 1 1 76 76 ASP H H 76 8.770 8.770 9.045 -0.275 25277 624 1 2 . 1 1 77 77 HIS N N 77 113.300 113.300 112.025 1.275 25277 625 1 2 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.714 0.376 25277 626 1 2 . 1 1 77 77 HIS C C 77 171.370 171.370 173.834 -2.464 25277 627 1 2 . 1 1 77 77 HIS CA C 77 55.590 55.590 54.576 1.014 25277 628 1 2 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.564 -2.374 25277 629 1 2 . 1 1 77 77 HIS H H 77 7.650 7.650 7.687 -0.037 25277 630 1 2 . 1 1 78 78 GLY N N 78 101.350 101.350 105.828 -4.478 25277 631 1 2 . 1 1 78 78 GLY C C 78 172.110 172.110 172.233 -0.123 25277 632 1 2 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.849 -0.039 25277 633 1 2 . 1 1 78 78 GLY H H 78 8.450 8.450 8.733 -0.283 25277 634 1 2 . 1 1 79 79 THR N N 79 120.230 120.230 117.023 3.207 25277 635 1 2 . 1 1 79 79 THR HA H 79 5.110 5.110 4.944 0.166 25277 636 1 2 . 1 1 79 79 THR C C 79 172.920 172.920 173.953 -1.033 25277 637 1 2 . 1 1 79 79 THR CA C 79 61.480 61.480 61.586 -0.106 25277 638 1 2 . 1 1 79 79 THR CB C 79 72.130 72.130 70.630 1.500 25277 639 1 2 . 1 1 79 79 THR H H 79 8.080 8.080 8.447 -0.367 25277 640 1 2 . 1 1 80 80 ILE N N 80 119.620 119.620 119.893 -0.273 25277 641 1 2 . 1 1 80 80 ILE HA H 80 5.140 5.140 4.978 0.162 25277 642 1 2 . 1 1 80 80 ILE C C 80 174.340 174.340 174.158 0.182 25277 643 1 2 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.340 0.010 25277 644 1 2 . 1 1 80 80 ILE CB C 80 39.550 39.550 40.679 -1.129 25277 645 1 2 . 1 1 80 80 ILE H H 80 8.970 8.970 8.690 0.280 25277 646 1 2 . 1 1 81 81 GLU N N 81 119.960 119.960 125.222 -5.262 25277 647 1 2 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.082 -0.082 25277 648 1 2 . 1 1 81 81 GLU C C 81 176.130 176.130 174.447 1.683 25277 649 1 2 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.866 -0.306 25277 650 1 2 . 1 1 81 81 GLU CB C 81 33.390 33.390 34.487 -1.097 25277 651 1 2 . 1 1 81 81 GLU H H 81 8.350 8.350 8.311 0.039 25277 652 1 2 . 1 1 82 82 CYS N N 82 123.110 123.110 124.562 -1.452 25277 653 1 2 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.129 -0.199 25277 654 1 2 . 1 1 82 82 CYS C C 82 174.430 174.430 175.013 -0.583 25277 655 1 2 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.080 -4.840 25277 656 1 2 . 1 1 82 82 CYS CB C 82 43.720 43.720 26.915 16.805 25277 657 1 2 . 1 1 82 82 CYS H H 82 8.220 8.220 8.370 -0.150 25277 658 1 2 . 1 1 83 83 LEU N N 83 131.660 131.660 127.280 4.380 25277 659 1 2 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.675 -0.145 25277 660 1 2 . 1 1 83 83 LEU CA C 83 53.900 53.900 53.268 0.632 25277 661 1 2 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.536 -2.336 25277 662 1 2 . 1 1 83 83 LEU H H 83 8.910 8.910 8.229 0.681 25277 663 1 2 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.242 0.128 25277 664 1 2 . 1 1 84 84 PRO CA C 84 63.190 63.190 65.235 -2.045 25277 665 1 2 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.763 0.167 25277 666 1 2 . 1 1 85 85 SER N N 85 117.620 117.620 112.566 5.054 25277 667 1 2 . 1 1 85 85 SER HA H 85 3.870 3.870 4.412 -0.542 25277 668 1 2 . 1 1 85 85 SER C C 85 174.350 174.350 174.384 -0.034 25277 669 1 2 . 1 1 85 85 SER CA C 85 58.970 58.970 58.694 0.276 25277 670 1 2 . 1 1 85 85 SER CB C 85 63.820 63.820 63.173 0.647 25277 671 1 2 . 1 1 85 85 SER H H 85 7.660 7.660 7.976 -0.316 25277 672 1 2 . 1 1 86 86 ASP N N 86 117.590 117.590 119.352 -1.762 25277 673 1 2 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.351 -0.211 25277 674 1 2 . 1 1 86 86 ASP C C 86 174.480 174.480 173.911 0.569 25277 675 1 2 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.382 -0.402 25277 676 1 2 . 1 1 86 86 ASP CB C 86 37.850 37.850 39.657 -1.808 25277 677 1 2 . 1 1 86 86 ASP H H 86 8.490 8.490 8.276 0.214 25277 678 1 2 . 1 1 87 87 ASN N N 87 117.160 117.160 117.387 -0.227 25277 679 1 2 . 1 1 87 87 ASN HA H 87 4.530 4.530 5.042 -0.512 25277 680 1 2 . 1 1 87 87 ASN CA C 87 52.480 52.480 52.100 0.380 25277 681 1 2 . 1 1 87 87 ASN CB C 87 40.040 40.040 40.653 -0.613 25277 682 1 2 . 1 1 87 87 ASN H H 87 7.260 7.260 7.594 -0.334 25277 683 1 2 . 1 1 88 88 ALA HA H 88 4.730 4.730 4.788 -0.058 25277 684 1 2 . 1 1 88 88 ALA C C 88 174.620 174.620 176.233 -1.613 25277 685 1 2 . 1 1 88 88 ALA CA C 88 51.230 51.230 50.766 0.465 25277 686 1 2 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.193 0.347 25277 687 1 2 . 1 1 89 89 VAL N N 89 116.580 116.580 116.918 -0.338 25277 688 1 2 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.094 0.006 25277 689 1 2 . 1 1 89 89 VAL C C 89 172.750 172.750 173.516 -0.766 25277 690 1 2 . 1 1 89 89 VAL CA C 89 58.980 58.980 59.282 -0.302 25277 691 1 2 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.389 0.831 25277 692 1 2 . 1 1 89 89 VAL H H 89 8.740 8.740 8.323 0.417 25277 693 1 2 . 1 1 90 90 PHE N N 90 120.300 120.300 123.721 -3.421 25277 694 1 2 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.097 0.053 25277 695 1 2 . 1 1 90 90 PHE C C 90 172.910 172.910 173.580 -0.670 25277 696 1 2 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.681 0.119 25277 697 1 2 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.303 1.347 25277 698 1 2 . 1 1 90 90 PHE H H 90 8.950 8.950 9.089 -0.139 25277 699 1 2 . 1 1 91 91 VAL N N 91 129.020 129.020 128.124 0.896 25277 700 1 2 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.715 -0.255 25277 701 1 2 . 1 1 91 91 VAL C C 91 175.910 175.910 174.148 1.762 25277 702 1 2 . 1 1 91 91 VAL CA C 91 60.780 60.780 59.527 1.253 25277 703 1 2 . 1 1 91 91 VAL CB C 91 32.020 32.020 33.308 -1.288 25277 704 1 2 . 1 1 91 91 VAL H H 91 9.090 9.090 8.667 0.423 25277 705 1 2 . 1 1 92 92 ALA N N 92 129.760 129.760 130.054 -0.294 25277 706 1 2 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.744 -0.244 25277 707 1 2 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.692 2.158 25277 708 1 2 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.637 -1.587 25277 709 1 2 . 1 1 92 92 ALA H H 92 8.680 8.680 8.478 0.202 25277 710 1 2 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.075 0.085 25277 711 1 2 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.096 0.304 25277 712 1 2 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.616 0.324 25277 713 1 2 . 1 1 94 94 ASP N N 94 113.220 113.220 114.939 -1.719 25277 714 1 2 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.474 -0.054 25277 715 1 2 . 1 1 94 94 ASP C C 94 176.980 176.980 177.481 -0.501 25277 716 1 2 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.981 -0.451 25277 717 1 2 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.867 -0.287 25277 718 1 2 . 1 1 94 94 ASP H H 94 7.890 7.890 7.809 0.081 25277 719 1 2 . 1 1 95 95 GLY N N 95 109.120 109.120 109.170 -0.050 25277 720 1 2 . 1 1 95 95 GLY C C 95 174.440 174.440 174.351 0.089 25277 721 1 2 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.118 -0.558 25277 722 1 2 . 1 1 95 95 GLY H H 95 8.500 8.500 8.255 0.245 25277 723 1 2 . 1 1 96 96 THR N N 96 120.350 120.350 118.016 2.334 25277 724 1 2 . 1 1 96 96 THR HA H 96 3.780 3.780 4.424 -0.644 25277 725 1 2 . 1 1 96 96 THR C C 96 172.590 172.590 173.212 -0.622 25277 726 1 2 . 1 1 96 96 THR CA C 96 64.660 64.660 61.758 2.902 25277 727 1 2 . 1 1 96 96 THR CB C 96 68.330 68.330 70.320 -1.990 25277 728 1 2 . 1 1 96 96 THR H H 96 8.100 8.100 8.459 -0.359 25277 729 1 2 . 1 1 97 97 THR N N 97 122.660 122.660 120.768 1.892 25277 730 1 2 . 1 1 97 97 THR HA H 97 4.590 4.590 4.875 -0.285 25277 731 1 2 . 1 1 97 97 THR C C 97 173.000 173.000 173.914 -0.914 25277 732 1 2 . 1 1 97 97 THR CA C 97 62.700 62.700 62.102 0.598 25277 733 1 2 . 1 1 97 97 THR CB C 97 68.840 68.840 69.957 -1.117 25277 734 1 2 . 1 1 97 97 THR H H 97 7.850 7.850 8.454 -0.604 25277 735 1 2 . 1 1 98 98 TYR N N 98 122.890 122.890 125.904 -3.014 25277 736 1 2 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.281 -0.341 25277 737 1 2 . 1 1 98 98 TYR C C 98 178.970 178.970 174.678 4.292 25277 738 1 2 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.155 0.355 25277 739 1 2 . 1 1 98 98 TYR CB C 98 42.950 42.950 42.028 0.922 25277 740 1 2 . 1 1 98 98 TYR H H 98 9.460 9.460 9.336 0.124 25277 741 1 2 . 1 1 99 99 ALA N N 99 121.760 121.760 123.793 -2.033 25277 742 1 2 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.612 -0.502 25277 743 1 2 . 1 1 99 99 ALA C C 99 178.010 178.010 176.500 1.510 25277 744 1 2 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.164 1.106 25277 745 1 2 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.652 2.398 25277 746 1 2 . 1 1 99 99 ALA H H 99 9.110 9.110 8.859 0.251 25277 747 1 2 . 1 1 100 100 LEU N N 100 119.330 119.330 124.526 -5.196 25277 748 1 2 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.241 0.229 25277 749 1 2 . 1 1 100 100 LEU C C 100 174.720 174.720 177.398 -2.678 25277 750 1 2 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.475 -2.335 25277 751 1 2 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.692 1.938 25277 752 1 2 . 1 1 100 100 LEU H H 100 8.950 8.950 8.256 0.694 25277 753 1 2 . 1 1 101 101 ASN N N 101 112.600 112.600 115.895 -3.295 25277 754 1 2 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.823 0.097 25277 755 1 2 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.636 -1.706 25277 756 1 2 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.799 0.801 25277 757 1 2 . 1 1 101 101 ASN H H 101 7.550 7.550 7.603 -0.053 25277 758 1 2 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.327 -0.137 25277 759 1 2 . 1 1 102 102 ASP C C 102 178.770 178.770 178.123 0.647 25277 760 1 2 . 1 1 102 102 ASP CA C 102 56.880 56.880 57.628 -0.748 25277 761 1 2 . 1 1 102 102 ASP CB C 102 39.980 39.980 40.642 -0.661 25277 762 1 2 . 1 1 103 103 ARG N N 103 119.370 119.370 119.985 -0.615 25277 763 1 2 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.129 -0.299 25277 764 1 2 . 1 1 103 103 ARG C C 103 178.550 178.550 178.378 0.172 25277 765 1 2 . 1 1 103 103 ARG CA C 103 59.380 59.380 59.086 0.294 25277 766 1 2 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.870 -0.370 25277 767 1 2 . 1 1 103 103 ARG H H 103 7.970 7.970 8.065 -0.095 25277 768 1 2 . 1 1 104 104 ALA N N 104 120.110 120.110 122.140 -2.030 25277 769 1 2 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.061 0.149 25277 770 1 2 . 1 1 104 104 ALA C C 104 179.510 179.510 179.581 -0.071 25277 771 1 2 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.332 -0.582 25277 772 1 2 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.239 1.431 25277 773 1 2 . 1 1 104 104 ALA H H 104 7.610 7.610 8.451 -0.841 25277 774 1 2 . 1 1 105 105 GLU N N 105 120.460 120.460 118.343 2.117 25277 775 1 2 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.135 0.575 25277 776 1 2 . 1 1 105 105 GLU C C 105 181.710 181.710 179.702 2.008 25277 777 1 2 . 1 1 105 105 GLU CA C 105 58.680 58.680 58.774 -0.094 25277 778 1 2 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.283 0.207 25277 779 1 2 . 1 1 105 105 GLU H H 105 7.750 7.750 7.775 -0.025 25277 780 1 2 . 1 1 106 106 LYS N N 106 121.980 121.980 120.460 1.520 25277 781 1 2 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.119 -0.099 25277 782 1 2 . 1 1 106 106 LYS C C 106 177.890 177.890 178.273 -0.383 25277 783 1 2 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.691 -0.221 25277 784 1 2 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.443 -0.713 25277 785 1 2 . 1 1 106 106 LYS H H 106 8.380 8.380 7.956 0.424 25277 786 1 2 . 1 1 107 107 ALA N N 107 119.850 119.850 118.973 0.877 25277 787 1 2 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.322 -0.062 25277 788 1 2 . 1 1 107 107 ALA C C 107 177.210 177.210 177.618 -0.408 25277 789 1 2 . 1 1 107 107 ALA CA C 107 52.270 52.270 52.237 0.033 25277 790 1 2 . 1 1 107 107 ALA CB C 107 18.740 18.740 19.069 -0.329 25277 791 1 2 . 1 1 107 107 ALA H H 107 7.400 7.400 7.672 -0.272 25277 792 1 2 . 1 1 108 108 GLY N N 108 104.560 104.560 106.089 -1.529 25277 793 1 2 . 1 1 108 108 GLY C C 108 174.300 174.300 174.501 -0.201 25277 794 1 2 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.023 -0.413 25277 795 1 2 . 1 1 108 108 GLY H H 108 7.560 7.560 7.839 -0.279 25277 796 1 2 . 1 1 109 109 HIS N N 109 122.550 122.550 120.720 1.830 25277 797 1 2 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.880 -0.110 25277 798 1 2 . 1 1 109 109 HIS CA C 109 54.580 54.580 54.929 -0.349 25277 799 1 2 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.892 -1.302 25277 800 1 2 . 1 1 109 109 HIS H H 109 7.590 7.590 7.752 -0.162 25277 801 1 2 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.862 -0.302 25277 802 1 2 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.138 0.592 25277 803 1 2 . 1 1 111 111 PRO CB C 111 32.800 32.800 33.173 -0.373 25277 804 1 2 . 1 1 112 112 ILE N N 112 119.770 119.770 120.162 -0.392 25277 805 1 2 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.443 0.417 25277 806 1 2 . 1 1 112 112 ILE C C 112 172.800 172.800 177.498 -4.698 25277 807 1 2 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.500 -2.310 25277 808 1 2 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.320 3.120 25277 809 1 2 . 1 1 112 112 ILE H H 112 7.890 7.890 8.548 -0.658 25277 810 1 2 . 1 1 113 113 THR N N 113 113.610 113.610 116.257 -2.647 25277 811 1 2 . 1 1 113 113 THR HA H 113 3.010 3.010 3.990 -0.980 25277 812 1 2 . 1 1 113 113 THR CA C 113 66.860 66.860 67.974 -1.114 25277 813 1 2 . 1 1 113 113 THR CB C 113 66.920 66.920 67.295 -0.375 25277 814 1 2 . 1 1 113 113 THR H H 113 7.070 7.070 8.555 -1.485 25277 815 1 2 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.344 -0.004 25277 816 1 2 . 1 1 114 114 PRO CA C 114 66.080 66.080 65.024 1.056 25277 817 1 2 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.552 0.529 25277 818 1 2 . 1 1 115 115 ILE N N 115 134.770 134.770 110.021 24.749 25277 819 1 2 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.396 0.214 25277 820 1 2 . 1 1 115 115 ILE C C 115 174.800 174.800 174.974 -0.174 25277 821 1 2 . 1 1 115 115 ILE CA C 115 60.000 60.000 59.948 0.052 25277 822 1 2 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.555 0.305 25277 823 1 2 . 1 1 115 115 ILE H H 115 7.510 7.510 7.658 -0.148 25277 824 1 2 . 1 1 116 116 ARG N N 116 120.890 120.890 122.223 -1.333 25277 825 1 2 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.176 -0.206 25277 826 1 2 . 1 1 116 116 ARG C C 116 174.910 174.910 175.695 -0.785 25277 827 1 2 . 1 1 116 116 ARG CA C 116 57.780 57.780 55.852 1.928 25277 828 1 2 . 1 1 116 116 ARG CB C 116 31.870 31.870 31.551 0.319 25277 829 1 2 . 1 1 116 116 ARG H H 116 7.280 7.280 7.566 -0.286 25277 830 1 2 . 1 1 117 117 ALA N N 117 125.400 125.400 127.791 -2.391 25277 831 1 2 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.401 -0.171 25277 832 1 2 . 1 1 117 117 ALA C C 117 176.290 176.290 175.950 0.340 25277 833 1 2 . 1 1 117 117 ALA CA C 117 50.780 50.780 51.138 -0.358 25277 834 1 2 . 1 1 117 117 ALA CB C 117 20.290 20.290 20.490 -0.200 25277 835 1 2 . 1 1 117 117 ALA H H 117 8.150 8.150 8.456 -0.306 25277 836 1 2 . 1 1 118 118 LYS N N 118 119.890 119.890 122.620 -2.730 25277 837 1 2 . 1 1 118 118 LYS HA H 118 4.590 4.590 3.892 0.698 25277 838 1 2 . 1 1 118 118 LYS C C 118 177.400 177.400 175.879 1.521 25277 839 1 2 . 1 1 118 118 LYS CA C 118 55.670 55.670 54.614 1.056 25277 840 1 2 . 1 1 118 118 LYS CB C 118 34.510 34.510 32.943 1.567 25277 841 1 2 . 1 1 118 118 LYS H H 118 8.360 8.360 8.186 0.174 25277 842 1 2 . 1 1 119 119 GLY N N 119 108.630 108.630 110.735 -2.105 25277 843 1 2 . 1 1 119 119 GLY CA C 119 43.610 43.610 43.868 -0.258 25277 844 1 2 . 1 1 119 119 GLY H H 119 8.320 8.320 8.010 0.310 25277 845 1 2 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.723 0.177 25277 846 1 2 . 1 1 124 124 TYR C C 124 177.430 177.430 176.391 1.039 25277 847 1 2 . 1 1 124 124 TYR CA C 124 57.970 57.970 57.193 0.777 25277 848 1 2 . 1 1 124 124 TYR CB C 124 38.650 38.650 40.561 -1.911 25277 849 1 2 . 1 1 125 125 ILE N N 125 123.670 123.670 123.254 0.416 25277 850 1 2 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.117 -0.277 25277 851 1 2 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.551 0.179 25277 852 1 2 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.262 0.248 25277 853 1 2 . 1 1 125 125 ILE H H 125 8.340 8.340 8.081 0.259 25277 854 1 2 . 1 1 126 126 SER HA H 126 4.070 4.070 4.387 -0.317 25277 855 1 2 . 1 1 126 126 SER C C 126 176.290 176.290 175.007 1.283 25277 856 1 2 . 1 1 126 126 SER CA C 126 59.190 59.190 59.065 0.126 25277 857 1 2 . 1 1 126 126 SER CB C 126 63.200 63.200 63.795 -0.595 25277 858 1 2 . 1 1 127 127 LEU N N 127 127.030 127.030 124.186 2.844 25277 859 1 2 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.294 -0.354 25277 860 1 2 . 1 1 127 127 LEU C C 127 176.660 176.660 178.256 -1.596 25277 861 1 2 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.561 0.549 25277 862 1 2 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.645 1.285 25277 863 1 2 . 1 1 127 127 LEU H H 127 8.790 8.790 8.306 0.484 25277 864 1 2 . 1 1 128 128 GLY N N 128 106.600 106.600 108.928 -2.328 25277 865 1 2 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.603 0.927 25277 866 1 2 . 1 1 128 128 GLY H H 128 8.450 8.450 8.309 0.141 25277 867 1 2 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.038 0.192 25277 868 1 2 . 1 1 129 129 ALA C C 129 180.410 180.410 179.213 1.197 25277 869 1 2 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.565 0.355 25277 870 1 2 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.292 0.838 25277 871 1 2 . 1 1 130 130 LEU N N 130 122.550 122.550 120.614 1.936 25277 872 1 2 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.041 -0.121 25277 873 1 2 . 1 1 130 130 LEU C C 130 179.020 179.020 178.487 0.533 25277 874 1 2 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.384 0.246 25277 875 1 2 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.614 0.526 25277 876 1 2 . 1 1 130 130 LEU H H 130 8.040 8.040 7.423 0.617 25277 877 1 2 . 1 1 131 131 LEU N N 131 121.910 121.910 119.443 2.467 25277 878 1 2 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.879 0.041 25277 879 1 2 . 1 1 131 131 LEU C C 131 177.910 177.910 178.444 -0.534 25277 880 1 2 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.082 0.488 25277 881 1 2 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.512 -0.792 25277 882 1 2 . 1 1 131 131 LEU H H 131 9.060 9.060 7.898 1.162 25277 883 1 2 . 1 1 132 132 SER N N 132 115.530 115.530 115.068 0.462 25277 884 1 2 . 1 1 132 132 SER HA H 132 3.970 3.970 4.071 -0.101 25277 885 1 2 . 1 1 132 132 SER C C 132 177.140 177.140 176.801 0.339 25277 886 1 2 . 1 1 132 132 SER CA C 132 62.340 62.340 62.268 0.072 25277 887 1 2 . 1 1 132 132 SER CB C 132 62.370 62.370 62.861 -0.491 25277 888 1 2 . 1 1 132 132 SER H H 132 8.730 8.730 8.099 0.631 25277 889 1 2 . 1 1 133 133 THR N N 133 116.960 116.960 119.322 -2.362 25277 890 1 2 . 1 1 133 133 THR HA H 133 3.860 3.860 3.974 -0.114 25277 891 1 2 . 1 1 133 133 THR C C 133 175.670 175.670 176.544 -0.874 25277 892 1 2 . 1 1 133 133 THR CA C 133 66.930 66.930 67.397 -0.467 25277 893 1 2 . 1 1 133 133 THR CB C 133 68.880 68.880 68.750 0.130 25277 894 1 2 . 1 1 133 133 THR H H 133 7.750 7.750 7.802 -0.052 25277 895 1 2 . 1 1 134 134 THR N N 134 118.830 118.830 119.173 -0.343 25277 896 1 2 . 1 1 134 134 THR HA H 134 3.780 3.780 3.974 -0.194 25277 897 1 2 . 1 1 134 134 THR C C 134 176.750 176.750 176.285 0.465 25277 898 1 2 . 1 1 134 134 THR CA C 134 67.650 67.650 67.259 0.391 25277 899 1 2 . 1 1 134 134 THR CB C 134 67.560 67.560 68.697 -1.137 25277 900 1 2 . 1 1 134 134 THR H H 134 7.570 7.570 7.702 -0.132 25277 901 1 2 . 1 1 135 135 LEU N N 135 121.420 121.420 121.858 -0.438 25277 902 1 2 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.925 0.565 25277 903 1 2 . 1 1 135 135 LEU C C 135 180.050 180.050 178.823 1.227 25277 904 1 2 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.257 -1.247 25277 905 1 2 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.516 -0.906 25277 906 1 2 . 1 1 135 135 LEU H H 135 8.650 8.650 8.239 0.411 25277 907 1 2 . 1 1 136 136 ASN N N 136 117.010 117.010 117.620 -0.610 25277 908 1 2 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.460 0.080 25277 909 1 2 . 1 1 136 136 ASN C C 136 175.980 175.980 177.884 -1.904 25277 910 1 2 . 1 1 136 136 ASN CA C 136 54.770 54.770 55.773 -1.003 25277 911 1 2 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.252 0.188 25277 912 1 2 . 1 1 136 136 ASN H H 136 7.360 7.360 7.813 -0.453 25277 913 1 2 . 1 1 137 137 LEU N N 137 116.940 116.940 120.620 -3.680 25277 914 1 2 . 1 1 137 137 LEU HA H 137 4.160 4.160 3.988 0.172 25277 915 1 2 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.681 -2.251 25277 916 1 2 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.637 -0.067 25277 917 1 2 . 1 1 137 137 LEU H H 137 7.810 7.810 7.527 0.283 25277 918 1 2 . 1 1 138 138 CYS N N 138 115.430 115.430 114.498 0.932 25277 919 1 2 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.225 0.185 25277 920 1 2 . 1 1 138 138 CYS CA C 138 55.480 55.480 60.919 -5.439 25277 921 1 2 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.600 14.600 25277 922 1 2 . 1 1 138 138 CYS H H 138 7.450 7.450 7.892 -0.442 25277 923 1 2 . 1 1 139 139 GLY C C 139 178.800 178.800 173.731 5.069 25277 924 1 2 . 1 1 139 139 GLY CA C 139 45.500 45.500 45.002 0.499 25277 925 1 2 . 1 1 140 140 LYS N N 140 119.830 119.830 122.281 -2.451 25277 926 1 2 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.448 -0.128 25277 927 1 2 . 1 1 140 140 LYS C C 140 175.820 175.820 177.204 -1.384 25277 928 1 2 . 1 1 140 140 LYS CA C 140 55.680 55.680 56.188 -0.508 25277 929 1 2 . 1 1 140 140 LYS CB C 140 32.800 32.800 33.470 -0.670 25277 930 1 2 . 1 1 140 140 LYS H H 140 7.760 7.760 7.457 0.303 25277 931 1 3 . 1 1 27 27 PRO CA C 27 63.230 63.230 62.513 0.717 25277 932 1 3 . 1 1 27 27 PRO CB C 27 32.050 32.050 32.065 -0.015 25277 933 1 3 . 1 1 28 28 ASP N N 28 120.030 120.030 119.464 0.566 25277 934 1 3 . 1 1 28 28 ASP C C 28 176.130 176.130 175.626 0.504 25277 935 1 3 . 1 1 28 28 ASP CA C 28 54.170 54.170 54.154 0.016 25277 936 1 3 . 1 1 28 28 ASP CB C 28 40.860 40.860 41.581 -0.721 25277 937 1 3 . 1 1 28 28 ASP H H 28 8.260 8.260 8.259 0.001 25277 938 1 3 . 1 1 29 29 LEU N N 29 123.030 123.030 121.962 1.068 25277 939 1 3 . 1 1 29 29 LEU C C 29 177.870 177.870 176.985 0.885 25277 940 1 3 . 1 1 29 29 LEU CA C 29 55.160 55.160 54.653 0.507 25277 941 1 3 . 1 1 29 29 LEU CB C 29 42.270 42.270 43.288 -1.018 25277 942 1 3 . 1 1 29 29 LEU H H 29 8.120 8.120 8.055 0.065 25277 943 1 3 . 1 1 30 30 GLY N N 30 109.350 109.350 112.152 -2.802 25277 944 1 3 . 1 1 30 30 GLY CA C 30 45.340 45.340 44.625 0.715 25277 945 1 3 . 1 1 30 30 GLY H H 30 8.410 8.410 8.362 0.048 25277 946 1 3 . 1 1 44 44 PRO CA C 44 63.590 63.590 62.641 0.949 25277 947 1 3 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.136 -0.146 25277 948 1 3 . 1 1 45 45 ALA N N 45 122.140 122.140 122.552 -0.412 25277 949 1 3 . 1 1 45 45 ALA CA C 45 52.670 52.670 52.704 -0.034 25277 950 1 3 . 1 1 45 45 ALA H H 45 8.350 8.350 7.977 0.373 25277 951 1 3 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.204 0.096 25277 952 1 3 . 1 1 49 49 PRO CA C 49 62.950 62.950 63.169 -0.219 25277 953 1 3 . 1 1 49 49 PRO CB C 49 31.990 31.990 32.153 -0.163 25277 954 1 3 . 1 1 50 50 VAL N N 50 124.190 124.190 125.018 -0.828 25277 955 1 3 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.315 0.005 25277 956 1 3 . 1 1 50 50 VAL CA C 50 59.850 59.850 59.686 0.164 25277 957 1 3 . 1 1 50 50 VAL CB C 50 32.480 32.480 32.476 0.004 25277 958 1 3 . 1 1 50 50 VAL H H 50 8.070 8.070 8.172 -0.102 25277 959 1 3 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.292 0.058 25277 960 1 3 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.224 -0.294 25277 961 1 3 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.107 -0.127 25277 962 1 3 . 1 1 52 52 LEU N N 52 124.500 124.500 122.003 2.497 25277 963 1 3 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.250 0.240 25277 964 1 3 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.794 -0.904 25277 965 1 3 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.418 0.772 25277 966 1 3 . 1 1 52 52 LEU H H 52 8.360 8.360 8.180 0.180 25277 967 1 3 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.350 0.060 25277 968 1 3 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.720 -0.390 25277 969 1 3 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.120 -0.130 25277 970 1 3 . 1 1 54 54 SER N N 54 117.380 117.380 116.996 0.384 25277 971 1 3 . 1 1 54 54 SER HA H 54 4.600 4.600 4.339 0.261 25277 972 1 3 . 1 1 54 54 SER CA C 54 56.710 56.710 57.298 -0.589 25277 973 1 3 . 1 1 54 54 SER CB C 54 62.500 62.500 63.162 -0.662 25277 974 1 3 . 1 1 54 54 SER H H 54 8.400 8.400 8.111 0.289 25277 975 1 3 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.558 -0.008 25277 976 1 3 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.413 0.128 25277 977 1 3 . 1 1 55 55 PRO CB C 55 32.620 32.620 32.143 0.477 25277 978 1 3 . 1 1 57 57 SER HA H 57 4.420 4.420 4.329 0.091 25277 979 1 3 . 1 1 57 57 SER CA C 57 57.580 57.580 59.860 -2.280 25277 980 1 3 . 1 1 57 57 SER CB C 57 63.780 63.780 63.227 0.552 25277 981 1 3 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.418 0.572 25277 982 1 3 . 1 1 58 58 ASN C C 58 172.230 172.230 173.863 -1.633 25277 983 1 3 . 1 1 58 58 ASN CA C 58 53.670 53.670 54.675 -1.005 25277 984 1 3 . 1 1 58 58 ASN CB C 58 37.850 37.850 37.123 0.727 25277 985 1 3 . 1 1 59 59 LYS N N 59 117.660 117.660 117.988 -0.328 25277 986 1 3 . 1 1 59 59 LYS HA H 59 5.360 5.360 4.921 0.439 25277 987 1 3 . 1 1 59 59 LYS C C 59 175.120 175.120 173.822 1.298 25277 988 1 3 . 1 1 59 59 LYS CA C 59 54.860 54.860 56.088 -1.228 25277 989 1 3 . 1 1 59 59 LYS CB C 59 36.450 36.450 36.540 -0.090 25277 990 1 3 . 1 1 59 59 LYS H H 59 7.640 7.640 7.773 -0.133 25277 991 1 3 . 1 1 60 60 GLN N N 60 120.680 120.680 121.218 -0.538 25277 992 1 3 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.638 -0.148 25277 993 1 3 . 1 1 60 60 GLN C C 60 173.640 173.640 173.258 0.382 25277 994 1 3 . 1 1 60 60 GLN CA C 60 55.480 55.480 54.791 0.689 25277 995 1 3 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.177 -0.187 25277 996 1 3 . 1 1 60 60 GLN H H 60 8.930 8.930 8.421 0.509 25277 997 1 3 . 1 1 61 61 ASP N N 61 126.170 126.170 121.409 4.761 25277 998 1 3 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.818 0.232 25277 999 1 3 . 1 1 61 61 ASP C C 61 175.000 175.000 175.230 -0.230 25277 1000 1 3 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.411 0.469 25277 1001 1 3 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.452 -0.682 25277 1002 1 3 . 1 1 61 61 ASP H H 61 8.540 8.540 8.556 -0.016 25277 1003 1 3 . 1 1 62 62 ILE N N 62 121.100 121.100 125.375 -4.275 25277 1004 1 3 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.563 0.217 25277 1005 1 3 . 1 1 62 62 ILE C C 62 171.480 171.480 173.620 -2.140 25277 1006 1 3 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.573 0.517 25277 1007 1 3 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.534 0.606 25277 1008 1 3 . 1 1 62 62 ILE H H 62 8.970 8.970 8.409 0.561 25277 1009 1 3 . 1 1 63 63 SER N N 63 119.430 119.430 121.195 -1.765 25277 1010 1 3 . 1 1 63 63 SER HA H 63 4.680 4.680 4.511 0.169 25277 1011 1 3 . 1 1 63 63 SER C C 63 174.030 174.030 174.354 -0.324 25277 1012 1 3 . 1 1 63 63 SER CA C 63 56.550 56.550 56.568 -0.018 25277 1013 1 3 . 1 1 63 63 SER CB C 63 67.320 67.320 66.142 1.178 25277 1014 1 3 . 1 1 63 63 SER H H 63 8.520 8.520 7.992 0.528 25277 1015 1 3 . 1 1 64 64 GLU N N 64 121.250 121.250 120.123 1.127 25277 1016 1 3 . 1 1 64 64 GLU HA H 64 2.770 2.770 2.952 -0.182 25277 1017 1 3 . 1 1 64 64 GLU C C 64 177.190 177.190 177.833 -0.643 25277 1018 1 3 . 1 1 64 64 GLU CA C 64 58.590 58.590 58.857 -0.267 25277 1019 1 3 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.617 -0.477 25277 1020 1 3 . 1 1 64 64 GLU H H 64 7.400 7.400 7.592 -0.192 25277 1021 1 3 . 1 1 65 65 ALA N N 65 119.250 119.250 122.091 -2.841 25277 1022 1 3 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.868 -0.008 25277 1023 1 3 . 1 1 65 65 ALA C C 65 179.630 179.630 179.556 0.074 25277 1024 1 3 . 1 1 65 65 ALA CA C 65 53.810 53.810 54.737 -0.927 25277 1025 1 3 . 1 1 65 65 ALA CB C 65 18.400 18.400 17.948 0.452 25277 1026 1 3 . 1 1 65 65 ALA H H 65 7.700 7.700 8.274 -0.574 25277 1027 1 3 . 1 1 66 66 ASN N N 66 112.360 112.360 116.385 -4.025 25277 1028 1 3 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.481 0.549 25277 1029 1 3 . 1 1 66 66 ASN C C 66 174.580 174.580 177.376 -2.796 25277 1030 1 3 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.670 -0.120 25277 1031 1 3 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.469 1.461 25277 1032 1 3 . 1 1 66 66 ASN H H 66 7.960 7.960 7.473 0.487 25277 1033 1 3 . 1 1 67 67 LEU N N 67 115.390 115.390 118.699 -3.309 25277 1034 1 3 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.220 0.430 25277 1035 1 3 . 1 1 67 67 LEU C C 67 176.500 176.500 176.909 -0.409 25277 1036 1 3 . 1 1 67 67 LEU CA C 67 54.350 54.350 56.134 -1.784 25277 1037 1 3 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.029 2.641 25277 1038 1 3 . 1 1 67 67 LEU H H 67 7.050 7.050 7.586 -0.536 25277 1039 1 3 . 1 1 68 68 ALA N N 68 125.680 125.680 120.333 5.347 25277 1040 1 3 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.756 0.134 25277 1041 1 3 . 1 1 68 68 ALA C C 68 177.480 177.480 178.271 -0.791 25277 1042 1 3 . 1 1 68 68 ALA CA C 68 53.550 53.550 53.333 0.217 25277 1043 1 3 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.215 -0.065 25277 1044 1 3 . 1 1 68 68 ALA H H 68 8.880 8.880 7.991 0.889 25277 1045 1 3 . 1 1 69 69 TYR N N 69 119.780 119.780 120.150 -0.370 25277 1046 1 3 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.315 0.175 25277 1047 1 3 . 1 1 69 69 TYR C C 69 175.340 175.340 177.350 -2.010 25277 1048 1 3 . 1 1 69 69 TYR CA C 69 58.640 58.640 60.738 -2.098 25277 1049 1 3 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.059 -0.779 25277 1050 1 3 . 1 1 69 69 TYR H H 69 7.420 7.420 8.507 -1.087 25277 1051 1 3 . 1 1 70 70 LEU N N 70 118.820 118.820 116.994 1.826 25277 1052 1 3 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.152 0.138 25277 1053 1 3 . 1 1 70 70 LEU C C 70 176.770 176.770 177.466 -0.696 25277 1054 1 3 . 1 1 70 70 LEU CA C 70 53.880 53.880 55.635 -1.755 25277 1055 1 3 . 1 1 70 70 LEU CB C 70 41.300 41.300 41.796 -0.496 25277 1056 1 3 . 1 1 70 70 LEU H H 70 7.690 7.690 7.463 0.227 25277 1057 1 3 . 1 1 71 71 TRP N N 71 124.110 124.110 122.629 1.481 25277 1058 1 3 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.541 0.049 25277 1059 1 3 . 1 1 71 71 TRP CA C 71 54.150 54.150 56.063 -1.913 25277 1060 1 3 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.408 -0.198 25277 1061 1 3 . 1 1 71 71 TRP H H 71 8.130 8.130 7.690 0.440 25277 1062 1 3 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.394 0.186 25277 1063 1 3 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.175 0.415 25277 1064 1 3 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.777 -1.717 25277 1065 1 3 . 1 1 73 73 LEU N N 73 118.760 118.760 117.852 0.908 25277 1066 1 3 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.602 0.798 25277 1067 1 3 . 1 1 73 73 LEU C C 73 176.620 176.620 178.334 -1.714 25277 1068 1 3 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.733 -0.682 25277 1069 1 3 . 1 1 73 73 LEU CB C 73 44.260 44.260 43.063 1.197 25277 1070 1 3 . 1 1 73 73 LEU H H 73 5.190 5.190 6.651 -1.461 25277 1071 1 3 . 1 1 74 74 THR N N 74 110.120 110.120 115.603 -5.483 25277 1072 1 3 . 1 1 74 74 THR HA H 74 4.250 4.250 4.226 0.024 25277 1073 1 3 . 1 1 74 74 THR C C 74 176.080 176.080 175.485 0.595 25277 1074 1 3 . 1 1 74 74 THR CA C 74 62.690 62.690 64.126 -1.436 25277 1075 1 3 . 1 1 74 74 THR CB C 74 67.930 67.930 69.226 -1.296 25277 1076 1 3 . 1 1 74 74 THR H H 74 9.010 9.010 8.674 0.336 25277 1077 1 3 . 1 1 75 75 VAL N N 75 113.030 113.030 118.777 -5.747 25277 1078 1 3 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.238 0.572 25277 1079 1 3 . 1 1 75 75 VAL C C 75 176.010 176.010 177.264 -1.254 25277 1080 1 3 . 1 1 75 75 VAL CA C 75 59.100 59.100 62.555 -3.455 25277 1081 1 3 . 1 1 75 75 VAL CB C 75 33.220 33.220 32.408 0.812 25277 1082 1 3 . 1 1 75 75 VAL H H 75 6.660 6.660 7.640 -0.980 25277 1083 1 3 . 1 1 76 76 ASP N N 76 119.590 119.590 124.555 -4.965 25277 1084 1 3 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.678 -0.188 25277 1085 1 3 . 1 1 76 76 ASP C C 76 175.060 175.060 176.069 -1.009 25277 1086 1 3 . 1 1 76 76 ASP CA C 76 55.110 55.110 57.173 -2.063 25277 1087 1 3 . 1 1 76 76 ASP CB C 76 41.300 41.300 41.166 0.134 25277 1088 1 3 . 1 1 76 76 ASP H H 76 8.770 8.770 9.037 -0.267 25277 1089 1 3 . 1 1 77 77 HIS N N 77 113.300 113.300 112.019 1.281 25277 1090 1 3 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.716 0.374 25277 1091 1 3 . 1 1 77 77 HIS C C 77 171.370 171.370 173.845 -2.475 25277 1092 1 3 . 1 1 77 77 HIS CA C 77 55.590 55.590 54.555 1.035 25277 1093 1 3 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.575 -2.385 25277 1094 1 3 . 1 1 77 77 HIS H H 77 7.650 7.650 7.673 -0.023 25277 1095 1 3 . 1 1 78 78 GLY N N 78 101.350 101.350 105.303 -3.953 25277 1096 1 3 . 1 1 78 78 GLY C C 78 172.110 172.110 172.413 -0.303 25277 1097 1 3 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.803 0.007 25277 1098 1 3 . 1 1 78 78 GLY H H 78 8.450 8.450 8.710 -0.260 25277 1099 1 3 . 1 1 79 79 THR N N 79 120.230 120.230 117.090 3.140 25277 1100 1 3 . 1 1 79 79 THR HA H 79 5.110 5.110 4.863 0.247 25277 1101 1 3 . 1 1 79 79 THR C C 79 172.920 172.920 173.807 -0.887 25277 1102 1 3 . 1 1 79 79 THR CA C 79 61.480 61.480 62.132 -0.652 25277 1103 1 3 . 1 1 79 79 THR CB C 79 72.130 72.130 70.624 1.506 25277 1104 1 3 . 1 1 79 79 THR H H 79 8.080 8.080 8.473 -0.393 25277 1105 1 3 . 1 1 80 80 ILE N N 80 119.620 119.620 120.633 -1.013 25277 1106 1 3 . 1 1 80 80 ILE HA H 80 5.140 5.140 4.896 0.244 25277 1107 1 3 . 1 1 80 80 ILE C C 80 174.340 174.340 174.016 0.324 25277 1108 1 3 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.548 -0.198 25277 1109 1 3 . 1 1 80 80 ILE CB C 80 39.550 39.550 40.205 -0.655 25277 1110 1 3 . 1 1 80 80 ILE H H 80 8.970 8.970 8.732 0.238 25277 1111 1 3 . 1 1 81 81 GLU N N 81 119.960 119.960 125.696 -5.736 25277 1112 1 3 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.073 -0.073 25277 1113 1 3 . 1 1 81 81 GLU C C 81 176.130 176.130 174.528 1.602 25277 1114 1 3 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.865 -0.305 25277 1115 1 3 . 1 1 81 81 GLU CB C 81 33.390 33.390 34.560 -1.170 25277 1116 1 3 . 1 1 81 81 GLU H H 81 8.350 8.350 8.282 0.068 25277 1117 1 3 . 1 1 82 82 CYS N N 82 123.110 123.110 124.613 -1.503 25277 1118 1 3 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.034 -0.104 25277 1119 1 3 . 1 1 82 82 CYS C C 82 174.430 174.430 174.989 -0.559 25277 1120 1 3 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.167 -4.927 25277 1121 1 3 . 1 1 82 82 CYS CB C 82 43.720 43.720 26.393 17.327 25277 1122 1 3 . 1 1 82 82 CYS H H 82 8.220 8.220 8.392 -0.172 25277 1123 1 3 . 1 1 83 83 LEU N N 83 131.660 131.660 127.335 4.325 25277 1124 1 3 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.712 -0.182 25277 1125 1 3 . 1 1 83 83 LEU CA C 83 53.900 53.900 52.777 1.123 25277 1126 1 3 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.844 -2.644 25277 1127 1 3 . 1 1 83 83 LEU H H 83 8.910 8.910 8.142 0.768 25277 1128 1 3 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.264 0.106 25277 1129 1 3 . 1 1 84 84 PRO CA C 84 63.190 63.190 64.762 -1.572 25277 1130 1 3 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.767 0.163 25277 1131 1 3 . 1 1 85 85 SER N N 85 117.620 117.620 113.961 3.659 25277 1132 1 3 . 1 1 85 85 SER HA H 85 3.870 3.870 4.430 -0.560 25277 1133 1 3 . 1 1 85 85 SER C C 85 174.350 174.350 173.864 0.486 25277 1134 1 3 . 1 1 85 85 SER CA C 85 58.970 58.970 59.015 -0.045 25277 1135 1 3 . 1 1 85 85 SER CB C 85 63.820 63.820 63.270 0.550 25277 1136 1 3 . 1 1 85 85 SER H H 85 7.660 7.660 8.217 -0.557 25277 1137 1 3 . 1 1 86 86 ASP N N 86 117.590 117.590 118.076 -0.486 25277 1138 1 3 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.347 -0.207 25277 1139 1 3 . 1 1 86 86 ASP C C 86 174.480 174.480 174.041 0.439 25277 1140 1 3 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.575 -0.595 25277 1141 1 3 . 1 1 86 86 ASP CB C 86 37.850 37.850 38.796 -0.946 25277 1142 1 3 . 1 1 86 86 ASP H H 86 8.490 8.490 8.247 0.243 25277 1143 1 3 . 1 1 87 87 ASN N N 87 117.160 117.160 113.619 3.541 25277 1144 1 3 . 1 1 87 87 ASN HA H 87 4.530 4.530 5.085 -0.555 25277 1145 1 3 . 1 1 87 87 ASN CA C 87 52.480 52.480 51.701 0.779 25277 1146 1 3 . 1 1 87 87 ASN CB C 87 40.040 40.040 41.400 -1.360 25277 1147 1 3 . 1 1 87 87 ASN H H 87 7.260 7.260 7.620 -0.360 25277 1148 1 3 . 1 1 88 88 ALA HA H 88 4.730 4.730 4.770 -0.040 25277 1149 1 3 . 1 1 88 88 ALA C C 88 174.620 174.620 176.302 -1.682 25277 1150 1 3 . 1 1 88 88 ALA CA C 88 51.230 51.230 50.626 0.604 25277 1151 1 3 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.214 0.326 25277 1152 1 3 . 1 1 89 89 VAL N N 89 116.580 116.580 117.376 -0.796 25277 1153 1 3 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.042 0.058 25277 1154 1 3 . 1 1 89 89 VAL C C 89 172.750 172.750 173.501 -0.751 25277 1155 1 3 . 1 1 89 89 VAL CA C 89 58.980 58.980 59.400 -0.420 25277 1156 1 3 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.563 0.657 25277 1157 1 3 . 1 1 89 89 VAL H H 89 8.740 8.740 8.210 0.530 25277 1158 1 3 . 1 1 90 90 PHE N N 90 120.300 120.300 123.248 -2.948 25277 1159 1 3 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.106 0.044 25277 1160 1 3 . 1 1 90 90 PHE C C 90 172.910 172.910 173.648 -0.738 25277 1161 1 3 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.654 0.146 25277 1162 1 3 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.322 1.329 25277 1163 1 3 . 1 1 90 90 PHE H H 90 8.950 8.950 8.988 -0.038 25277 1164 1 3 . 1 1 91 91 VAL N N 91 129.020 129.020 127.539 1.481 25277 1165 1 3 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.656 -0.196 25277 1166 1 3 . 1 1 91 91 VAL C C 91 175.910 175.910 173.988 1.922 25277 1167 1 3 . 1 1 91 91 VAL CA C 91 60.780 60.780 60.496 0.284 25277 1168 1 3 . 1 1 91 91 VAL CB C 91 32.020 32.020 34.033 -2.013 25277 1169 1 3 . 1 1 91 91 VAL H H 91 9.090 9.090 8.659 0.431 25277 1170 1 3 . 1 1 92 92 ALA N N 92 129.760 129.760 129.402 0.358 25277 1171 1 3 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.754 -0.254 25277 1172 1 3 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.752 2.098 25277 1173 1 3 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.490 -1.440 25277 1174 1 3 . 1 1 92 92 ALA H H 92 8.680 8.680 8.418 0.262 25277 1175 1 3 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.068 0.092 25277 1176 1 3 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.084 0.316 25277 1177 1 3 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.609 0.331 25277 1178 1 3 . 1 1 94 94 ASP N N 94 113.220 113.220 114.960 -1.740 25277 1179 1 3 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.466 -0.046 25277 1180 1 3 . 1 1 94 94 ASP C C 94 176.980 176.980 177.479 -0.499 25277 1181 1 3 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.990 -0.460 25277 1182 1 3 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.861 -0.281 25277 1183 1 3 . 1 1 94 94 ASP H H 94 7.890 7.890 7.807 0.083 25277 1184 1 3 . 1 1 95 95 GLY N N 95 109.120 109.120 108.577 0.543 25277 1185 1 3 . 1 1 95 95 GLY C C 95 174.440 174.440 174.368 0.072 25277 1186 1 3 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.063 -0.503 25277 1187 1 3 . 1 1 95 95 GLY H H 95 8.500 8.500 8.154 0.346 25277 1188 1 3 . 1 1 96 96 THR N N 96 120.350 120.350 118.043 2.307 25277 1189 1 3 . 1 1 96 96 THR HA H 96 3.780 3.780 4.400 -0.620 25277 1190 1 3 . 1 1 96 96 THR C C 96 172.590 172.590 173.455 -0.865 25277 1191 1 3 . 1 1 96 96 THR CA C 96 64.660 64.660 62.504 2.156 25277 1192 1 3 . 1 1 96 96 THR CB C 96 68.330 68.330 70.161 -1.831 25277 1193 1 3 . 1 1 96 96 THR H H 96 8.100 8.100 8.466 -0.366 25277 1194 1 3 . 1 1 97 97 THR N N 97 122.660 122.660 121.644 1.016 25277 1195 1 3 . 1 1 97 97 THR HA H 97 4.590 4.590 4.775 -0.185 25277 1196 1 3 . 1 1 97 97 THR C C 97 173.000 173.000 173.654 -0.654 25277 1197 1 3 . 1 1 97 97 THR CA C 97 62.700 62.700 61.881 0.819 25277 1198 1 3 . 1 1 97 97 THR CB C 97 68.840 68.840 70.010 -1.170 25277 1199 1 3 . 1 1 97 97 THR H H 97 7.850 7.850 8.476 -0.626 25277 1200 1 3 . 1 1 98 98 TYR N N 98 122.890 122.890 125.806 -2.916 25277 1201 1 3 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.298 -0.358 25277 1202 1 3 . 1 1 98 98 TYR C C 98 178.970 178.970 174.757 4.213 25277 1203 1 3 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.186 0.324 25277 1204 1 3 . 1 1 98 98 TYR CB C 98 42.950 42.950 41.977 0.973 25277 1205 1 3 . 1 1 98 98 TYR H H 98 9.460 9.460 9.239 0.221 25277 1206 1 3 . 1 1 99 99 ALA N N 99 121.760 121.760 123.546 -1.786 25277 1207 1 3 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.621 -0.511 25277 1208 1 3 . 1 1 99 99 ALA C C 99 178.010 178.010 176.370 1.640 25277 1209 1 3 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.181 1.089 25277 1210 1 3 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.630 2.420 25277 1211 1 3 . 1 1 99 99 ALA H H 99 9.110 9.110 8.863 0.247 25277 1212 1 3 . 1 1 100 100 LEU N N 100 119.330 119.330 124.692 -5.362 25277 1213 1 3 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.209 0.261 25277 1214 1 3 . 1 1 100 100 LEU C C 100 174.720 174.720 177.065 -2.345 25277 1215 1 3 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.777 -2.637 25277 1216 1 3 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.559 2.071 25277 1217 1 3 . 1 1 100 100 LEU H H 100 8.950 8.950 8.244 0.706 25277 1218 1 3 . 1 1 101 101 ASN N N 101 112.600 112.600 115.261 -2.661 25277 1219 1 3 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.881 0.039 25277 1220 1 3 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.101 -1.171 25277 1221 1 3 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.333 1.267 25277 1222 1 3 . 1 1 101 101 ASN H H 101 7.550 7.550 7.679 -0.129 25277 1223 1 3 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.443 -0.253 25277 1224 1 3 . 1 1 102 102 ASP C C 102 178.770 178.770 178.091 0.679 25277 1225 1 3 . 1 1 102 102 ASP CA C 102 56.880 56.880 57.836 -0.956 25277 1226 1 3 . 1 1 102 102 ASP CB C 102 39.980 39.980 41.078 -1.098 25277 1227 1 3 . 1 1 103 103 ARG N N 103 119.370 119.370 119.008 0.362 25277 1228 1 3 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.038 -0.208 25277 1229 1 3 . 1 1 103 103 ARG C C 103 178.550 178.550 178.497 0.053 25277 1230 1 3 . 1 1 103 103 ARG CA C 103 59.380 59.380 59.075 0.305 25277 1231 1 3 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.978 -0.478 25277 1232 1 3 . 1 1 103 103 ARG H H 103 7.970 7.970 8.239 -0.269 25277 1233 1 3 . 1 1 104 104 ALA N N 104 120.110 120.110 121.757 -1.647 25277 1234 1 3 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.081 0.129 25277 1235 1 3 . 1 1 104 104 ALA C C 104 179.510 179.510 179.464 0.046 25277 1236 1 3 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.204 -0.454 25277 1237 1 3 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.354 1.316 25277 1238 1 3 . 1 1 104 104 ALA H H 104 7.610 7.610 8.542 -0.932 25277 1239 1 3 . 1 1 105 105 GLU N N 105 120.460 120.460 118.798 1.662 25277 1240 1 3 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.235 0.475 25277 1241 1 3 . 1 1 105 105 GLU C C 105 181.710 181.710 179.700 2.010 25277 1242 1 3 . 1 1 105 105 GLU CA C 105 58.680 58.680 58.890 -0.210 25277 1243 1 3 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.584 -0.094 25277 1244 1 3 . 1 1 105 105 GLU H H 105 7.750 7.750 7.785 -0.035 25277 1245 1 3 . 1 1 106 106 LYS N N 106 121.980 121.980 120.749 1.231 25277 1246 1 3 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.092 -0.072 25277 1247 1 3 . 1 1 106 106 LYS C C 106 177.890 177.890 178.043 -0.153 25277 1248 1 3 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.725 -0.255 25277 1249 1 3 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.432 -0.702 25277 1250 1 3 . 1 1 106 106 LYS H H 106 8.380 8.380 8.055 0.325 25277 1251 1 3 . 1 1 107 107 ALA N N 107 119.850 119.850 119.031 0.819 25277 1252 1 3 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.312 -0.052 25277 1253 1 3 . 1 1 107 107 ALA C C 107 177.210 177.210 177.639 -0.429 25277 1254 1 3 . 1 1 107 107 ALA CA C 107 52.270 52.270 52.239 0.031 25277 1255 1 3 . 1 1 107 107 ALA CB C 107 18.740 18.740 19.048 -0.308 25277 1256 1 3 . 1 1 107 107 ALA H H 107 7.400 7.400 7.631 -0.231 25277 1257 1 3 . 1 1 108 108 GLY N N 108 104.560 104.560 105.996 -1.436 25277 1258 1 3 . 1 1 108 108 GLY C C 108 174.300 174.300 174.456 -0.156 25277 1259 1 3 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.018 -0.408 25277 1260 1 3 . 1 1 108 108 GLY H H 108 7.560 7.560 7.822 -0.262 25277 1261 1 3 . 1 1 109 109 HIS N N 109 122.550 122.550 120.633 1.917 25277 1262 1 3 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.921 -0.151 25277 1263 1 3 . 1 1 109 109 HIS CA C 109 54.580 54.580 54.718 -0.138 25277 1264 1 3 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.925 -1.335 25277 1265 1 3 . 1 1 109 109 HIS H H 109 7.590 7.590 7.744 -0.154 25277 1266 1 3 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.830 -0.270 25277 1267 1 3 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.080 0.650 25277 1268 1 3 . 1 1 111 111 PRO CB C 111 32.800 32.800 33.108 -0.308 25277 1269 1 3 . 1 1 112 112 ILE N N 112 119.770 119.770 119.700 0.070 25277 1270 1 3 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.485 0.375 25277 1271 1 3 . 1 1 112 112 ILE C C 112 172.800 172.800 177.533 -4.733 25277 1272 1 3 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.480 -2.290 25277 1273 1 3 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.290 3.150 25277 1274 1 3 . 1 1 112 112 ILE H H 112 7.890 7.890 8.322 -0.432 25277 1275 1 3 . 1 1 113 113 THR N N 113 113.610 113.610 116.337 -2.727 25277 1276 1 3 . 1 1 113 113 THR HA H 113 3.010 3.010 3.980 -0.970 25277 1277 1 3 . 1 1 113 113 THR CA C 113 66.860 66.860 67.989 -1.129 25277 1278 1 3 . 1 1 113 113 THR CB C 113 66.920 66.920 67.276 -0.356 25277 1279 1 3 . 1 1 113 113 THR H H 113 7.070 7.070 8.574 -1.504 25277 1280 1 3 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.344 -0.004 25277 1281 1 3 . 1 1 114 114 PRO CA C 114 66.080 66.080 65.005 1.075 25277 1282 1 3 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.542 0.538 25277 1283 1 3 . 1 1 115 115 ILE N N 115 134.770 134.770 110.091 24.679 25277 1284 1 3 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.390 0.220 25277 1285 1 3 . 1 1 115 115 ILE C C 115 174.800 174.800 174.974 -0.174 25277 1286 1 3 . 1 1 115 115 ILE CA C 115 60.000 60.000 59.929 0.071 25277 1287 1 3 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.504 0.356 25277 1288 1 3 . 1 1 115 115 ILE H H 115 7.510 7.510 7.616 -0.106 25277 1289 1 3 . 1 1 116 116 ARG N N 116 120.890 120.890 122.299 -1.409 25277 1290 1 3 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.168 -0.198 25277 1291 1 3 . 1 1 116 116 ARG C C 116 174.910 174.910 175.742 -0.832 25277 1292 1 3 . 1 1 116 116 ARG CA C 116 57.780 57.780 55.930 1.850 25277 1293 1 3 . 1 1 116 116 ARG CB C 116 31.870 31.870 31.493 0.377 25277 1294 1 3 . 1 1 116 116 ARG H H 116 7.280 7.280 7.568 -0.288 25277 1295 1 3 . 1 1 117 117 ALA N N 117 125.400 125.400 127.925 -2.525 25277 1296 1 3 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.378 -0.148 25277 1297 1 3 . 1 1 117 117 ALA C C 117 176.290 176.290 175.700 0.590 25277 1298 1 3 . 1 1 117 117 ALA CA C 117 50.780 50.780 51.204 -0.424 25277 1299 1 3 . 1 1 117 117 ALA CB C 117 20.290 20.290 20.720 -0.430 25277 1300 1 3 . 1 1 117 117 ALA H H 117 8.150 8.150 8.401 -0.251 25277 1301 1 3 . 1 1 118 118 LYS N N 118 119.890 119.890 122.825 -2.935 25277 1302 1 3 . 1 1 118 118 LYS HA H 118 4.590 4.590 3.722 0.868 25277 1303 1 3 . 1 1 118 118 LYS C C 118 177.400 177.400 176.336 1.064 25277 1304 1 3 . 1 1 118 118 LYS CA C 118 55.670 55.670 55.069 0.601 25277 1305 1 3 . 1 1 118 118 LYS CB C 118 34.510 34.510 33.398 1.112 25277 1306 1 3 . 1 1 118 118 LYS H H 118 8.360 8.360 8.308 0.052 25277 1307 1 3 . 1 1 119 119 GLY N N 119 108.630 108.630 112.032 -3.402 25277 1308 1 3 . 1 1 119 119 GLY CA C 119 43.610 43.610 44.257 -0.647 25277 1309 1 3 . 1 1 119 119 GLY H H 119 8.320 8.320 7.956 0.364 25277 1310 1 3 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.738 0.162 25277 1311 1 3 . 1 1 124 124 TYR C C 124 177.430 177.430 176.455 0.975 25277 1312 1 3 . 1 1 124 124 TYR CA C 124 57.970 57.970 57.305 0.665 25277 1313 1 3 . 1 1 124 124 TYR CB C 124 38.650 38.650 40.593 -1.943 25277 1314 1 3 . 1 1 125 125 ILE N N 125 123.670 123.670 122.531 1.139 25277 1315 1 3 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.162 -0.322 25277 1316 1 3 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.484 0.246 25277 1317 1 3 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.398 0.112 25277 1318 1 3 . 1 1 125 125 ILE H H 125 8.340 8.340 8.060 0.280 25277 1319 1 3 . 1 1 126 126 SER HA H 126 4.070 4.070 4.406 -0.336 25277 1320 1 3 . 1 1 126 126 SER C C 126 176.290 176.290 175.055 1.235 25277 1321 1 3 . 1 1 126 126 SER CA C 126 59.190 59.190 58.544 0.646 25277 1322 1 3 . 1 1 126 126 SER CB C 126 63.200 63.200 63.780 -0.580 25277 1323 1 3 . 1 1 127 127 LEU N N 127 127.030 127.030 124.068 2.962 25277 1324 1 3 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.309 -0.369 25277 1325 1 3 . 1 1 127 127 LEU C C 127 176.660 176.660 178.311 -1.651 25277 1326 1 3 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.666 0.444 25277 1327 1 3 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.655 1.275 25277 1328 1 3 . 1 1 127 127 LEU H H 127 8.790 8.790 8.381 0.409 25277 1329 1 3 . 1 1 128 128 GLY N N 128 106.600 106.600 108.907 -2.307 25277 1330 1 3 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.611 0.919 25277 1331 1 3 . 1 1 128 128 GLY H H 128 8.450 8.450 8.319 0.131 25277 1332 1 3 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.101 0.129 25277 1333 1 3 . 1 1 129 129 ALA C C 129 180.410 180.410 179.417 0.993 25277 1334 1 3 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.663 0.257 25277 1335 1 3 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.240 0.890 25277 1336 1 3 . 1 1 130 130 LEU N N 130 122.550 122.550 120.533 2.017 25277 1337 1 3 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.034 -0.114 25277 1338 1 3 . 1 1 130 130 LEU C C 130 179.020 179.020 178.488 0.532 25277 1339 1 3 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.406 0.224 25277 1340 1 3 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.619 0.521 25277 1341 1 3 . 1 1 130 130 LEU H H 130 8.040 8.040 7.453 0.587 25277 1342 1 3 . 1 1 131 131 LEU N N 131 121.910 121.910 119.197 2.713 25277 1343 1 3 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.855 0.065 25277 1344 1 3 . 1 1 131 131 LEU C C 131 177.910 177.910 178.531 -0.621 25277 1345 1 3 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.089 0.481 25277 1346 1 3 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.397 -0.677 25277 1347 1 3 . 1 1 131 131 LEU H H 131 9.060 9.060 7.890 1.170 25277 1348 1 3 . 1 1 132 132 SER N N 132 115.530 115.530 113.694 1.836 25277 1349 1 3 . 1 1 132 132 SER HA H 132 3.970 3.970 4.072 -0.102 25277 1350 1 3 . 1 1 132 132 SER C C 132 177.140 177.140 176.540 0.600 25277 1351 1 3 . 1 1 132 132 SER CA C 132 62.340 62.340 62.099 0.241 25277 1352 1 3 . 1 1 132 132 SER CB C 132 62.370 62.370 62.920 -0.550 25277 1353 1 3 . 1 1 132 132 SER H H 132 8.730 8.730 8.223 0.507 25277 1354 1 3 . 1 1 133 133 THR N N 133 116.960 116.960 117.912 -0.952 25277 1355 1 3 . 1 1 133 133 THR HA H 133 3.860 3.860 4.006 -0.146 25277 1356 1 3 . 1 1 133 133 THR C C 133 175.670 175.670 176.603 -0.933 25277 1357 1 3 . 1 1 133 133 THR CA C 133 66.930 66.930 67.342 -0.412 25277 1358 1 3 . 1 1 133 133 THR CB C 133 68.880 68.880 68.463 0.417 25277 1359 1 3 . 1 1 133 133 THR H H 133 7.750 7.750 7.802 -0.052 25277 1360 1 3 . 1 1 134 134 THR N N 134 118.830 118.830 118.917 -0.087 25277 1361 1 3 . 1 1 134 134 THR HA H 134 3.780 3.780 4.078 -0.298 25277 1362 1 3 . 1 1 134 134 THR C C 134 176.750 176.750 176.212 0.538 25277 1363 1 3 . 1 1 134 134 THR CA C 134 67.650 67.650 66.618 1.032 25277 1364 1 3 . 1 1 134 134 THR CB C 134 67.560 67.560 68.334 -0.774 25277 1365 1 3 . 1 1 134 134 THR H H 134 7.570 7.570 7.735 -0.165 25277 1366 1 3 . 1 1 135 135 LEU N N 135 121.420 121.420 122.000 -0.580 25277 1367 1 3 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.902 0.588 25277 1368 1 3 . 1 1 135 135 LEU C C 135 180.050 180.050 178.951 1.099 25277 1369 1 3 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.363 -1.353 25277 1370 1 3 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.366 -0.756 25277 1371 1 3 . 1 1 135 135 LEU H H 135 8.650 8.650 8.349 0.301 25277 1372 1 3 . 1 1 136 136 ASN N N 136 117.010 117.010 117.631 -0.621 25277 1373 1 3 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.457 0.083 25277 1374 1 3 . 1 1 136 136 ASN C C 136 175.980 175.980 177.891 -1.911 25277 1375 1 3 . 1 1 136 136 ASN CA C 136 54.770 54.770 55.791 -1.021 25277 1376 1 3 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.236 0.204 25277 1377 1 3 . 1 1 136 136 ASN H H 136 7.360 7.360 7.811 -0.451 25277 1378 1 3 . 1 1 137 137 LEU N N 137 116.940 116.940 120.797 -3.857 25277 1379 1 3 . 1 1 137 137 LEU HA H 137 4.160 4.160 3.986 0.174 25277 1380 1 3 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.802 -2.372 25277 1381 1 3 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.556 0.014 25277 1382 1 3 . 1 1 137 137 LEU H H 137 7.810 7.810 7.567 0.243 25277 1383 1 3 . 1 1 138 138 CYS N N 138 115.430 115.430 116.115 -0.685 25277 1384 1 3 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.195 0.215 25277 1385 1 3 . 1 1 138 138 CYS CA C 138 55.480 55.480 61.590 -6.110 25277 1386 1 3 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.427 14.773 25277 1387 1 3 . 1 1 138 138 CYS H H 138 7.450 7.450 8.146 -0.696 25277 1388 1 3 . 1 1 139 139 GLY C C 139 178.800 178.800 173.644 5.156 25277 1389 1 3 . 1 1 139 139 GLY CA C 139 45.500 45.500 44.934 0.565 25277 1390 1 3 . 1 1 140 140 LYS N N 140 119.830 119.830 122.181 -2.351 25277 1391 1 3 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.430 -0.110 25277 1392 1 3 . 1 1 140 140 LYS C C 140 175.820 175.820 176.804 -0.984 25277 1393 1 3 . 1 1 140 140 LYS CA C 140 55.680 55.680 55.655 0.025 25277 1394 1 3 . 1 1 140 140 LYS CB C 140 32.800 32.800 33.135 -0.335 25277 1395 1 3 . 1 1 140 140 LYS H H 140 7.760 7.760 7.427 0.333 25277 1396 1 4 . 1 1 27 27 PRO CA C 27 63.230 63.230 62.373 0.856 25277 1397 1 4 . 1 1 27 27 PRO CB C 27 32.050 32.050 32.296 -0.246 25277 1398 1 4 . 1 1 28 28 ASP N N 28 120.030 120.030 119.369 0.661 25277 1399 1 4 . 1 1 28 28 ASP C C 28 176.130 176.130 176.360 -0.230 25277 1400 1 4 . 1 1 28 28 ASP CA C 28 54.170 54.170 53.936 0.234 25277 1401 1 4 . 1 1 28 28 ASP CB C 28 40.860 40.860 41.197 -0.337 25277 1402 1 4 . 1 1 28 28 ASP H H 28 8.260 8.260 8.322 -0.062 25277 1403 1 4 . 1 1 29 29 LEU N N 29 123.030 123.030 124.556 -1.526 25277 1404 1 4 . 1 1 29 29 LEU C C 29 177.870 177.870 178.032 -0.162 25277 1405 1 4 . 1 1 29 29 LEU CA C 29 55.160 55.160 54.450 0.710 25277 1406 1 4 . 1 1 29 29 LEU CB C 29 42.270 42.270 42.868 -0.598 25277 1407 1 4 . 1 1 29 29 LEU H H 29 8.120 8.120 8.484 -0.364 25277 1408 1 4 . 1 1 30 30 GLY N N 30 109.350 109.350 109.292 0.058 25277 1409 1 4 . 1 1 30 30 GLY CA C 30 45.340 45.340 45.261 0.079 25277 1410 1 4 . 1 1 30 30 GLY H H 30 8.410 8.410 8.343 0.067 25277 1411 1 4 . 1 1 44 44 PRO CA C 44 63.590 63.590 62.324 1.266 25277 1412 1 4 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.249 -0.259 25277 1413 1 4 . 1 1 45 45 ALA N N 45 122.140 122.140 121.825 0.315 25277 1414 1 4 . 1 1 45 45 ALA CA C 45 52.670 52.670 52.293 0.377 25277 1415 1 4 . 1 1 45 45 ALA H H 45 8.350 8.350 8.027 0.323 25277 1416 1 4 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.464 -0.164 25277 1417 1 4 . 1 1 49 49 PRO CA C 49 62.950 62.950 63.074 -0.124 25277 1418 1 4 . 1 1 49 49 PRO CB C 49 31.990 31.990 31.887 0.103 25277 1419 1 4 . 1 1 50 50 VAL N N 50 124.190 124.190 126.042 -1.852 25277 1420 1 4 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.287 0.033 25277 1421 1 4 . 1 1 50 50 VAL CA C 50 59.850 59.850 60.016 -0.166 25277 1422 1 4 . 1 1 50 50 VAL CB C 50 32.480 32.480 32.448 0.032 25277 1423 1 4 . 1 1 50 50 VAL H H 50 8.070 8.070 7.880 0.190 25277 1424 1 4 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.306 0.044 25277 1425 1 4 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.243 -0.313 25277 1426 1 4 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.170 -0.190 25277 1427 1 4 . 1 1 52 52 LEU N N 52 124.500 124.500 121.768 2.732 25277 1428 1 4 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.292 0.198 25277 1429 1 4 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.762 -0.872 25277 1430 1 4 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.468 0.722 25277 1431 1 4 . 1 1 52 52 LEU H H 52 8.360 8.360 8.222 0.138 25277 1432 1 4 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.604 -0.194 25277 1433 1 4 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.021 0.309 25277 1434 1 4 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.358 -0.368 25277 1435 1 4 . 1 1 54 54 SER N N 54 117.380 117.380 115.613 1.767 25277 1436 1 4 . 1 1 54 54 SER HA H 54 4.600 4.600 4.455 0.145 25277 1437 1 4 . 1 1 54 54 SER CA C 54 56.710 56.710 58.061 -1.351 25277 1438 1 4 . 1 1 54 54 SER CB C 54 62.500 62.500 62.756 -0.256 25277 1439 1 4 . 1 1 54 54 SER H H 54 8.400 8.400 8.338 0.062 25277 1440 1 4 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.582 -0.032 25277 1441 1 4 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.438 0.102 25277 1442 1 4 . 1 1 55 55 PRO CB C 55 32.620 32.620 32.093 0.527 25277 1443 1 4 . 1 1 57 57 SER HA H 57 4.420 4.420 4.288 0.132 25277 1444 1 4 . 1 1 57 57 SER CA C 57 57.580 57.580 60.578 -2.998 25277 1445 1 4 . 1 1 57 57 SER CB C 57 63.780 63.780 63.087 0.693 25277 1446 1 4 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.358 0.632 25277 1447 1 4 . 1 1 58 58 ASN C C 58 172.230 172.230 173.903 -1.673 25277 1448 1 4 . 1 1 58 58 ASN CA C 58 53.670 53.670 54.781 -1.111 25277 1449 1 4 . 1 1 58 58 ASN CB C 58 37.850 37.850 37.495 0.355 25277 1450 1 4 . 1 1 59 59 LYS N N 59 117.660 117.660 114.892 2.768 25277 1451 1 4 . 1 1 59 59 LYS HA H 59 5.360 5.360 4.971 0.389 25277 1452 1 4 . 1 1 59 59 LYS C C 59 175.120 175.120 174.610 0.510 25277 1453 1 4 . 1 1 59 59 LYS CA C 59 54.860 54.860 55.502 -0.642 25277 1454 1 4 . 1 1 59 59 LYS CB C 59 36.450 36.450 36.523 -0.073 25277 1455 1 4 . 1 1 59 59 LYS H H 59 7.640 7.640 7.748 -0.108 25277 1456 1 4 . 1 1 60 60 GLN N N 60 120.680 120.680 118.990 1.690 25277 1457 1 4 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.692 -0.202 25277 1458 1 4 . 1 1 60 60 GLN C C 60 173.640 173.640 173.434 0.206 25277 1459 1 4 . 1 1 60 60 GLN CA C 60 55.480 55.480 54.880 0.600 25277 1460 1 4 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.122 -0.132 25277 1461 1 4 . 1 1 60 60 GLN H H 60 8.930 8.930 8.442 0.488 25277 1462 1 4 . 1 1 61 61 ASP N N 61 126.170 126.170 121.426 4.744 25277 1463 1 4 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.843 0.207 25277 1464 1 4 . 1 1 61 61 ASP C C 61 175.000 175.000 175.269 -0.269 25277 1465 1 4 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.340 0.540 25277 1466 1 4 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.493 -0.723 25277 1467 1 4 . 1 1 61 61 ASP H H 61 8.540 8.540 8.593 -0.053 25277 1468 1 4 . 1 1 62 62 ILE N N 62 121.100 121.100 125.874 -4.774 25277 1469 1 4 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.524 0.256 25277 1470 1 4 . 1 1 62 62 ILE C C 62 171.480 171.480 173.653 -2.173 25277 1471 1 4 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.385 0.705 25277 1472 1 4 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.327 0.813 25277 1473 1 4 . 1 1 62 62 ILE H H 62 8.970 8.970 8.366 0.604 25277 1474 1 4 . 1 1 63 63 SER N N 63 119.430 119.430 122.119 -2.689 25277 1475 1 4 . 1 1 63 63 SER HA H 63 4.680 4.680 4.530 0.150 25277 1476 1 4 . 1 1 63 63 SER C C 63 174.030 174.030 174.585 -0.555 25277 1477 1 4 . 1 1 63 63 SER CA C 63 56.550 56.550 56.694 -0.144 25277 1478 1 4 . 1 1 63 63 SER CB C 63 67.320 67.320 66.147 1.173 25277 1479 1 4 . 1 1 63 63 SER H H 63 8.520 8.520 8.441 0.079 25277 1480 1 4 . 1 1 64 64 GLU N N 64 121.250 121.250 119.644 1.606 25277 1481 1 4 . 1 1 64 64 GLU HA H 64 2.770 2.770 3.007 -0.237 25277 1482 1 4 . 1 1 64 64 GLU C C 64 177.190 177.190 177.960 -0.770 25277 1483 1 4 . 1 1 64 64 GLU CA C 64 58.590 58.590 58.952 -0.362 25277 1484 1 4 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.604 -0.464 25277 1485 1 4 . 1 1 64 64 GLU H H 64 7.400 7.400 7.670 -0.270 25277 1486 1 4 . 1 1 65 65 ALA N N 65 119.250 119.250 121.523 -2.273 25277 1487 1 4 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.837 0.023 25277 1488 1 4 . 1 1 65 65 ALA C C 65 179.630 179.630 179.379 0.251 25277 1489 1 4 . 1 1 65 65 ALA CA C 65 53.810 53.810 55.050 -1.240 25277 1490 1 4 . 1 1 65 65 ALA CB C 65 18.400 18.400 18.218 0.182 25277 1491 1 4 . 1 1 65 65 ALA H H 65 7.700 7.700 8.288 -0.588 25277 1492 1 4 . 1 1 66 66 ASN N N 66 112.360 112.360 115.471 -3.111 25277 1493 1 4 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.595 0.435 25277 1494 1 4 . 1 1 66 66 ASN C C 66 174.580 174.580 176.808 -2.228 25277 1495 1 4 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.956 -0.406 25277 1496 1 4 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.706 1.224 25277 1497 1 4 . 1 1 66 66 ASN H H 66 7.960 7.960 7.317 0.643 25277 1498 1 4 . 1 1 67 67 LEU N N 67 115.390 115.390 117.384 -1.994 25277 1499 1 4 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.494 0.156 25277 1500 1 4 . 1 1 67 67 LEU C C 67 176.500 176.500 176.375 0.125 25277 1501 1 4 . 1 1 67 67 LEU CA C 67 54.350 54.350 54.924 -0.574 25277 1502 1 4 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.261 2.409 25277 1503 1 4 . 1 1 67 67 LEU H H 67 7.050 7.050 7.492 -0.442 25277 1504 1 4 . 1 1 68 68 ALA N N 68 125.680 125.680 121.692 3.988 25277 1505 1 4 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.747 0.143 25277 1506 1 4 . 1 1 68 68 ALA C C 68 177.480 177.480 177.764 -0.284 25277 1507 1 4 . 1 1 68 68 ALA CA C 68 53.550 53.550 54.017 -0.467 25277 1508 1 4 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.162 -0.012 25277 1509 1 4 . 1 1 68 68 ALA H H 68 8.880 8.880 7.989 0.891 25277 1510 1 4 . 1 1 69 69 TYR N N 69 119.780 119.780 118.405 1.375 25277 1511 1 4 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.263 0.227 25277 1512 1 4 . 1 1 69 69 TYR C C 69 175.340 175.340 177.304 -1.964 25277 1513 1 4 . 1 1 69 69 TYR CA C 69 58.640 58.640 61.195 -2.555 25277 1514 1 4 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.126 -0.846 25277 1515 1 4 . 1 1 69 69 TYR H H 69 7.420 7.420 8.439 -1.019 25277 1516 1 4 . 1 1 70 70 LEU N N 70 118.820 118.820 116.954 1.866 25277 1517 1 4 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.146 0.144 25277 1518 1 4 . 1 1 70 70 LEU C C 70 176.770 176.770 177.329 -0.559 25277 1519 1 4 . 1 1 70 70 LEU CA C 70 53.880 53.880 56.489 -2.609 25277 1520 1 4 . 1 1 70 70 LEU CB C 70 41.300 41.300 41.831 -0.531 25277 1521 1 4 . 1 1 70 70 LEU H H 70 7.690 7.690 7.542 0.148 25277 1522 1 4 . 1 1 71 71 TRP N N 71 124.110 124.110 122.160 1.950 25277 1523 1 4 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.536 0.054 25277 1524 1 4 . 1 1 71 71 TRP CA C 71 54.150 54.150 56.172 -2.022 25277 1525 1 4 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.399 -0.189 25277 1526 1 4 . 1 1 71 71 TRP H H 71 8.130 8.130 7.608 0.522 25277 1527 1 4 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.382 0.198 25277 1528 1 4 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.201 0.389 25277 1529 1 4 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.753 -1.693 25277 1530 1 4 . 1 1 73 73 LEU N N 73 118.760 118.760 117.904 0.856 25277 1531 1 4 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.583 0.817 25277 1532 1 4 . 1 1 73 73 LEU C C 73 176.620 176.620 178.314 -1.694 25277 1533 1 4 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.712 -0.662 25277 1534 1 4 . 1 1 73 73 LEU CB C 73 44.260 44.260 42.684 1.576 25277 1535 1 4 . 1 1 73 73 LEU H H 73 5.190 5.190 6.633 -1.443 25277 1536 1 4 . 1 1 74 74 THR N N 74 110.120 110.120 114.873 -4.753 25277 1537 1 4 . 1 1 74 74 THR HA H 74 4.250 4.250 4.200 0.050 25277 1538 1 4 . 1 1 74 74 THR C C 74 176.080 176.080 175.709 0.371 25277 1539 1 4 . 1 1 74 74 THR CA C 74 62.690 62.690 64.274 -1.584 25277 1540 1 4 . 1 1 74 74 THR CB C 74 67.930 67.930 69.284 -1.354 25277 1541 1 4 . 1 1 74 74 THR H H 74 9.010 9.010 8.568 0.442 25277 1542 1 4 . 1 1 75 75 VAL N N 75 113.030 113.030 118.014 -4.984 25277 1543 1 4 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.244 0.566 25277 1544 1 4 . 1 1 75 75 VAL C C 75 176.010 176.010 177.281 -1.271 25277 1545 1 4 . 1 1 75 75 VAL CA C 75 59.100 59.100 62.540 -3.440 25277 1546 1 4 . 1 1 75 75 VAL CB C 75 33.220 33.220 33.020 0.200 25277 1547 1 4 . 1 1 75 75 VAL H H 75 6.660 6.660 7.629 -0.969 25277 1548 1 4 . 1 1 76 76 ASP N N 76 119.590 119.590 123.918 -4.328 25277 1549 1 4 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.657 -0.167 25277 1550 1 4 . 1 1 76 76 ASP C C 76 175.060 175.060 176.062 -1.002 25277 1551 1 4 . 1 1 76 76 ASP CA C 76 55.110 55.110 57.069 -1.959 25277 1552 1 4 . 1 1 76 76 ASP CB C 76 41.300 41.300 41.080 0.220 25277 1553 1 4 . 1 1 76 76 ASP H H 76 8.770 8.770 9.054 -0.284 25277 1554 1 4 . 1 1 77 77 HIS N N 77 113.300 113.300 112.044 1.256 25277 1555 1 4 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.702 0.388 25277 1556 1 4 . 1 1 77 77 HIS C C 77 171.370 171.370 173.850 -2.480 25277 1557 1 4 . 1 1 77 77 HIS CA C 77 55.590 55.590 54.552 1.038 25277 1558 1 4 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.596 -2.406 25277 1559 1 4 . 1 1 77 77 HIS H H 77 7.650 7.650 7.679 -0.029 25277 1560 1 4 . 1 1 78 78 GLY N N 78 101.350 101.350 105.695 -4.345 25277 1561 1 4 . 1 1 78 78 GLY C C 78 172.110 172.110 172.140 -0.030 25277 1562 1 4 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.820 -0.010 25277 1563 1 4 . 1 1 78 78 GLY H H 78 8.450 8.450 8.791 -0.341 25277 1564 1 4 . 1 1 79 79 THR N N 79 120.230 120.230 117.386 2.844 25277 1565 1 4 . 1 1 79 79 THR HA H 79 5.110 5.110 4.898 0.212 25277 1566 1 4 . 1 1 79 79 THR C C 79 172.920 172.920 173.903 -0.983 25277 1567 1 4 . 1 1 79 79 THR CA C 79 61.480 61.480 61.751 -0.271 25277 1568 1 4 . 1 1 79 79 THR CB C 79 72.130 72.130 70.871 1.259 25277 1569 1 4 . 1 1 79 79 THR H H 79 8.080 8.080 8.506 -0.426 25277 1570 1 4 . 1 1 80 80 ILE N N 80 119.620 119.620 120.769 -1.149 25277 1571 1 4 . 1 1 80 80 ILE HA H 80 5.140 5.140 4.937 0.203 25277 1572 1 4 . 1 1 80 80 ILE C C 80 174.340 174.340 174.004 0.336 25277 1573 1 4 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.441 -0.090 25277 1574 1 4 . 1 1 80 80 ILE CB C 80 39.550 39.550 40.150 -0.600 25277 1575 1 4 . 1 1 80 80 ILE H H 80 8.970 8.970 8.696 0.274 25277 1576 1 4 . 1 1 81 81 GLU N N 81 119.960 119.960 125.662 -5.702 25277 1577 1 4 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.118 -0.118 25277 1578 1 4 . 1 1 81 81 GLU C C 81 176.130 176.130 174.571 1.559 25277 1579 1 4 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.816 -0.256 25277 1580 1 4 . 1 1 81 81 GLU CB C 81 33.390 33.390 34.519 -1.129 25277 1581 1 4 . 1 1 81 81 GLU H H 81 8.350 8.350 8.319 0.031 25277 1582 1 4 . 1 1 82 82 CYS N N 82 123.110 123.110 124.751 -1.641 25277 1583 1 4 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.044 -0.114 25277 1584 1 4 . 1 1 82 82 CYS C C 82 174.430 174.430 175.041 -0.611 25277 1585 1 4 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.193 -4.952 25277 1586 1 4 . 1 1 82 82 CYS CB C 82 43.720 43.720 26.527 17.193 25277 1587 1 4 . 1 1 82 82 CYS H H 82 8.220 8.220 8.384 -0.164 25277 1588 1 4 . 1 1 83 83 LEU N N 83 131.660 131.660 127.079 4.581 25277 1589 1 4 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.753 -0.223 25277 1590 1 4 . 1 1 83 83 LEU CA C 83 53.900 53.900 52.782 1.118 25277 1591 1 4 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.184 -1.984 25277 1592 1 4 . 1 1 83 83 LEU H H 83 8.910 8.910 8.080 0.830 25277 1593 1 4 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.246 0.124 25277 1594 1 4 . 1 1 84 84 PRO CA C 84 63.190 63.190 65.034 -1.844 25277 1595 1 4 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.752 0.178 25277 1596 1 4 . 1 1 85 85 SER N N 85 117.620 117.620 113.079 4.541 25277 1597 1 4 . 1 1 85 85 SER HA H 85 3.870 3.870 4.286 -0.416 25277 1598 1 4 . 1 1 85 85 SER C C 85 174.350 174.350 174.883 -0.533 25277 1599 1 4 . 1 1 85 85 SER CA C 85 58.970 58.970 58.451 0.519 25277 1600 1 4 . 1 1 85 85 SER CB C 85 63.820 63.820 63.277 0.543 25277 1601 1 4 . 1 1 85 85 SER H H 85 7.660 7.660 8.106 -0.446 25277 1602 1 4 . 1 1 86 86 ASP N N 86 117.590 117.590 120.671 -3.081 25277 1603 1 4 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.313 -0.173 25277 1604 1 4 . 1 1 86 86 ASP C C 86 174.480 174.480 173.772 0.708 25277 1605 1 4 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.454 -0.474 25277 1606 1 4 . 1 1 86 86 ASP CB C 86 37.850 37.850 39.889 -2.039 25277 1607 1 4 . 1 1 86 86 ASP H H 86 8.490 8.490 8.326 0.164 25277 1608 1 4 . 1 1 87 87 ASN N N 87 117.160 117.160 114.081 3.079 25277 1609 1 4 . 1 1 87 87 ASN HA H 87 4.530 4.530 5.170 -0.640 25277 1610 1 4 . 1 1 87 87 ASN CA C 87 52.480 52.480 51.380 1.100 25277 1611 1 4 . 1 1 87 87 ASN CB C 87 40.040 40.040 41.404 -1.365 25277 1612 1 4 . 1 1 87 87 ASN H H 87 7.260 7.260 7.630 -0.370 25277 1613 1 4 . 1 1 88 88 ALA HA H 88 4.730 4.730 4.732 -0.002 25277 1614 1 4 . 1 1 88 88 ALA C C 88 174.620 174.620 176.172 -1.552 25277 1615 1 4 . 1 1 88 88 ALA CA C 88 51.230 51.230 50.746 0.484 25277 1616 1 4 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.350 0.190 25277 1617 1 4 . 1 1 89 89 VAL N N 89 116.580 116.580 118.890 -2.310 25277 1618 1 4 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.015 0.085 25277 1619 1 4 . 1 1 89 89 VAL C C 89 172.750 172.750 173.534 -0.784 25277 1620 1 4 . 1 1 89 89 VAL CA C 89 58.980 58.980 59.505 -0.525 25277 1621 1 4 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.431 0.790 25277 1622 1 4 . 1 1 89 89 VAL H H 89 8.740 8.740 8.302 0.438 25277 1623 1 4 . 1 1 90 90 PHE N N 90 120.300 120.300 123.270 -2.970 25277 1624 1 4 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.111 0.039 25277 1625 1 4 . 1 1 90 90 PHE C C 90 172.910 172.910 173.725 -0.815 25277 1626 1 4 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.482 0.318 25277 1627 1 4 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.484 1.166 25277 1628 1 4 . 1 1 90 90 PHE H H 90 8.950 8.950 9.042 -0.092 25277 1629 1 4 . 1 1 91 91 VAL N N 91 129.020 129.020 127.481 1.539 25277 1630 1 4 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.624 -0.164 25277 1631 1 4 . 1 1 91 91 VAL C C 91 175.910 175.910 173.959 1.951 25277 1632 1 4 . 1 1 91 91 VAL CA C 91 60.780 60.780 60.511 0.269 25277 1633 1 4 . 1 1 91 91 VAL CB C 91 32.020 32.020 34.002 -1.982 25277 1634 1 4 . 1 1 91 91 VAL H H 91 9.090 9.090 8.691 0.399 25277 1635 1 4 . 1 1 92 92 ALA N N 92 129.760 129.760 129.421 0.339 25277 1636 1 4 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.754 -0.254 25277 1637 1 4 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.731 2.119 25277 1638 1 4 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.531 -1.481 25277 1639 1 4 . 1 1 92 92 ALA H H 92 8.680 8.680 8.395 0.285 25277 1640 1 4 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.070 0.090 25277 1641 1 4 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.098 0.302 25277 1642 1 4 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.616 0.324 25277 1643 1 4 . 1 1 94 94 ASP N N 94 113.220 113.220 114.938 -1.718 25277 1644 1 4 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.469 -0.049 25277 1645 1 4 . 1 1 94 94 ASP C C 94 176.980 176.980 177.479 -0.499 25277 1646 1 4 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.971 -0.442 25277 1647 1 4 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.855 -0.275 25277 1648 1 4 . 1 1 94 94 ASP H H 94 7.890 7.890 7.802 0.088 25277 1649 1 4 . 1 1 95 95 GLY N N 95 109.120 109.120 108.555 0.565 25277 1650 1 4 . 1 1 95 95 GLY C C 95 174.440 174.440 174.358 0.082 25277 1651 1 4 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.078 -0.518 25277 1652 1 4 . 1 1 95 95 GLY H H 95 8.500 8.500 8.160 0.340 25277 1653 1 4 . 1 1 96 96 THR N N 96 120.350 120.350 118.011 2.339 25277 1654 1 4 . 1 1 96 96 THR HA H 96 3.780 3.780 4.388 -0.608 25277 1655 1 4 . 1 1 96 96 THR C C 96 172.590 172.590 173.451 -0.861 25277 1656 1 4 . 1 1 96 96 THR CA C 96 64.660 64.660 62.348 2.312 25277 1657 1 4 . 1 1 96 96 THR CB C 96 68.330 68.330 70.095 -1.765 25277 1658 1 4 . 1 1 96 96 THR H H 96 8.100 8.100 8.455 -0.355 25277 1659 1 4 . 1 1 97 97 THR N N 97 122.660 122.660 121.451 1.209 25277 1660 1 4 . 1 1 97 97 THR HA H 97 4.590 4.590 4.710 -0.120 25277 1661 1 4 . 1 1 97 97 THR C C 97 173.000 173.000 173.270 -0.270 25277 1662 1 4 . 1 1 97 97 THR CA C 97 62.700 62.700 61.738 0.962 25277 1663 1 4 . 1 1 97 97 THR CB C 97 68.840 68.840 69.868 -1.028 25277 1664 1 4 . 1 1 97 97 THR H H 97 7.850 7.850 8.355 -0.505 25277 1665 1 4 . 1 1 98 98 TYR N N 98 122.890 122.890 124.833 -1.943 25277 1666 1 4 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.189 -0.249 25277 1667 1 4 . 1 1 98 98 TYR C C 98 178.970 178.970 174.973 3.997 25277 1668 1 4 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.205 0.305 25277 1669 1 4 . 1 1 98 98 TYR CB C 98 42.950 42.950 41.976 0.974 25277 1670 1 4 . 1 1 98 98 TYR H H 98 9.460 9.460 9.095 0.365 25277 1671 1 4 . 1 1 99 99 ALA N N 99 121.760 121.760 123.452 -1.692 25277 1672 1 4 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.669 -0.559 25277 1673 1 4 . 1 1 99 99 ALA C C 99 178.010 178.010 176.218 1.792 25277 1674 1 4 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.244 1.026 25277 1675 1 4 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.782 2.268 25277 1676 1 4 . 1 1 99 99 ALA H H 99 9.110 9.110 8.928 0.182 25277 1677 1 4 . 1 1 100 100 LEU N N 100 119.330 119.330 124.380 -5.050 25277 1678 1 4 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.244 0.226 25277 1679 1 4 . 1 1 100 100 LEU C C 100 174.720 174.720 177.278 -2.558 25277 1680 1 4 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.524 -2.384 25277 1681 1 4 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.778 1.852 25277 1682 1 4 . 1 1 100 100 LEU H H 100 8.950 8.950 8.213 0.737 25277 1683 1 4 . 1 1 101 101 ASN N N 101 112.600 112.600 115.535 -2.935 25277 1684 1 4 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.820 0.100 25277 1685 1 4 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.436 -1.506 25277 1686 1 4 . 1 1 101 101 ASN CB C 101 40.600 40.600 40.057 0.543 25277 1687 1 4 . 1 1 101 101 ASN H H 101 7.550 7.550 7.614 -0.064 25277 1688 1 4 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.448 -0.258 25277 1689 1 4 . 1 1 102 102 ASP C C 102 178.770 178.770 178.225 0.545 25277 1690 1 4 . 1 1 102 102 ASP CA C 102 56.880 56.880 57.602 -0.722 25277 1691 1 4 . 1 1 102 102 ASP CB C 102 39.980 39.980 40.899 -0.919 25277 1692 1 4 . 1 1 103 103 ARG N N 103 119.370 119.370 118.853 0.517 25277 1693 1 4 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.045 -0.215 25277 1694 1 4 . 1 1 103 103 ARG C C 103 178.550 178.550 178.464 0.086 25277 1695 1 4 . 1 1 103 103 ARG CA C 103 59.380 59.380 59.046 0.334 25277 1696 1 4 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.957 -0.458 25277 1697 1 4 . 1 1 103 103 ARG H H 103 7.970 7.970 8.190 -0.220 25277 1698 1 4 . 1 1 104 104 ALA N N 104 120.110 120.110 121.615 -1.505 25277 1699 1 4 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.130 0.080 25277 1700 1 4 . 1 1 104 104 ALA C C 104 179.510 179.510 179.628 -0.118 25277 1701 1 4 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.243 -0.493 25277 1702 1 4 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.435 1.235 25277 1703 1 4 . 1 1 104 104 ALA H H 104 7.610 7.610 8.649 -1.039 25277 1704 1 4 . 1 1 105 105 GLU N N 105 120.460 120.460 118.632 1.828 25277 1705 1 4 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.312 0.398 25277 1706 1 4 . 1 1 105 105 GLU C C 105 181.710 181.710 179.593 2.117 25277 1707 1 4 . 1 1 105 105 GLU CA C 105 58.680 58.680 59.403 -0.723 25277 1708 1 4 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.459 0.031 25277 1709 1 4 . 1 1 105 105 GLU H H 105 7.750 7.750 7.763 -0.013 25277 1710 1 4 . 1 1 106 106 LYS N N 106 121.980 121.980 120.564 1.416 25277 1711 1 4 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.072 -0.052 25277 1712 1 4 . 1 1 106 106 LYS C C 106 177.890 177.890 177.959 -0.069 25277 1713 1 4 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.699 -0.229 25277 1714 1 4 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.430 -0.700 25277 1715 1 4 . 1 1 106 106 LYS H H 106 8.380 8.380 7.899 0.481 25277 1716 1 4 . 1 1 107 107 ALA N N 107 119.850 119.850 118.901 0.949 25277 1717 1 4 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.252 0.008 25277 1718 1 4 . 1 1 107 107 ALA C C 107 177.210 177.210 177.480 -0.270 25277 1719 1 4 . 1 1 107 107 ALA CA C 107 52.270 52.270 52.130 0.140 25277 1720 1 4 . 1 1 107 107 ALA CB C 107 18.740 18.740 18.930 -0.190 25277 1721 1 4 . 1 1 107 107 ALA H H 107 7.400 7.400 7.645 -0.245 25277 1722 1 4 . 1 1 108 108 GLY N N 108 104.560 104.560 105.997 -1.437 25277 1723 1 4 . 1 1 108 108 GLY C C 108 174.300 174.300 174.415 -0.115 25277 1724 1 4 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.006 -0.396 25277 1725 1 4 . 1 1 108 108 GLY H H 108 7.560 7.560 7.832 -0.272 25277 1726 1 4 . 1 1 109 109 HIS N N 109 122.550 122.550 120.472 2.078 25277 1727 1 4 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.962 -0.192 25277 1728 1 4 . 1 1 109 109 HIS CA C 109 54.580 54.580 53.921 0.659 25277 1729 1 4 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.628 -1.038 25277 1730 1 4 . 1 1 109 109 HIS H H 109 7.590 7.590 7.650 -0.060 25277 1731 1 4 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.796 -0.236 25277 1732 1 4 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.202 0.528 25277 1733 1 4 . 1 1 111 111 PRO CB C 111 32.800 32.800 33.208 -0.408 25277 1734 1 4 . 1 1 112 112 ILE N N 112 119.770 119.770 119.428 0.342 25277 1735 1 4 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.533 0.327 25277 1736 1 4 . 1 1 112 112 ILE C C 112 172.800 172.800 177.534 -4.734 25277 1737 1 4 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.396 -2.206 25277 1738 1 4 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.286 3.154 25277 1739 1 4 . 1 1 112 112 ILE H H 112 7.890 7.890 8.214 -0.324 25277 1740 1 4 . 1 1 113 113 THR N N 113 113.610 113.610 116.398 -2.788 25277 1741 1 4 . 1 1 113 113 THR HA H 113 3.010 3.010 3.971 -0.961 25277 1742 1 4 . 1 1 113 113 THR CA C 113 66.860 66.860 67.985 -1.125 25277 1743 1 4 . 1 1 113 113 THR CB C 113 66.920 66.920 67.265 -0.345 25277 1744 1 4 . 1 1 113 113 THR H H 113 7.070 7.070 8.571 -1.501 25277 1745 1 4 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.337 0.003 25277 1746 1 4 . 1 1 114 114 PRO CA C 114 66.080 66.080 65.032 1.048 25277 1747 1 4 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.517 0.563 25277 1748 1 4 . 1 1 115 115 ILE N N 115 134.770 134.770 109.395 25.375 25277 1749 1 4 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.433 0.177 25277 1750 1 4 . 1 1 115 115 ILE C C 115 174.800 174.800 174.928 -0.128 25277 1751 1 4 . 1 1 115 115 ILE CA C 115 60.000 60.000 59.755 0.245 25277 1752 1 4 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.672 0.188 25277 1753 1 4 . 1 1 115 115 ILE H H 115 7.510 7.510 7.520 -0.010 25277 1754 1 4 . 1 1 116 116 ARG N N 116 120.890 120.890 122.151 -1.261 25277 1755 1 4 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.182 -0.212 25277 1756 1 4 . 1 1 116 116 ARG C C 116 174.910 174.910 175.317 -0.407 25277 1757 1 4 . 1 1 116 116 ARG CA C 116 57.780 57.780 55.782 1.998 25277 1758 1 4 . 1 1 116 116 ARG CB C 116 31.870 31.870 31.473 0.397 25277 1759 1 4 . 1 1 116 116 ARG H H 116 7.280 7.280 7.566 -0.286 25277 1760 1 4 . 1 1 117 117 ALA N N 117 125.400 125.400 129.313 -3.913 25277 1761 1 4 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.412 -0.182 25277 1762 1 4 . 1 1 117 117 ALA C C 117 176.290 176.290 176.557 -0.267 25277 1763 1 4 . 1 1 117 117 ALA CA C 117 50.780 50.780 51.417 -0.638 25277 1764 1 4 . 1 1 117 117 ALA CB C 117 20.290 20.290 20.497 -0.207 25277 1765 1 4 . 1 1 117 117 ALA H H 117 8.150 8.150 8.395 -0.245 25277 1766 1 4 . 1 1 118 118 LYS N N 118 119.890 119.890 121.278 -1.388 25277 1767 1 4 . 1 1 118 118 LYS HA H 118 4.590 4.590 3.732 0.858 25277 1768 1 4 . 1 1 118 118 LYS C C 118 177.400 177.400 176.346 1.054 25277 1769 1 4 . 1 1 118 118 LYS CA C 118 55.670 55.670 55.749 -0.079 25277 1770 1 4 . 1 1 118 118 LYS CB C 118 34.510 34.510 33.300 1.210 25277 1771 1 4 . 1 1 118 118 LYS H H 118 8.360 8.360 8.258 0.102 25277 1772 1 4 . 1 1 119 119 GLY N N 119 108.630 108.630 110.121 -1.491 25277 1773 1 4 . 1 1 119 119 GLY CA C 119 43.610 43.610 43.913 -0.303 25277 1774 1 4 . 1 1 119 119 GLY H H 119 8.320 8.320 7.964 0.356 25277 1775 1 4 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.671 0.229 25277 1776 1 4 . 1 1 124 124 TYR C C 124 177.430 177.430 176.288 1.142 25277 1777 1 4 . 1 1 124 124 TYR CA C 124 57.970 57.970 57.020 0.951 25277 1778 1 4 . 1 1 124 124 TYR CB C 124 38.650 38.650 40.492 -1.842 25277 1779 1 4 . 1 1 125 125 ILE N N 125 123.670 123.670 122.304 1.366 25277 1780 1 4 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.138 -0.298 25277 1781 1 4 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.495 0.235 25277 1782 1 4 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.304 0.206 25277 1783 1 4 . 1 1 125 125 ILE H H 125 8.340 8.340 8.090 0.250 25277 1784 1 4 . 1 1 126 126 SER HA H 126 4.070 4.070 4.347 -0.277 25277 1785 1 4 . 1 1 126 126 SER C C 126 176.290 176.290 175.083 1.207 25277 1786 1 4 . 1 1 126 126 SER CA C 126 59.190 59.190 58.846 0.344 25277 1787 1 4 . 1 1 126 126 SER CB C 126 63.200 63.200 63.746 -0.546 25277 1788 1 4 . 1 1 127 127 LEU N N 127 127.030 127.030 124.266 2.764 25277 1789 1 4 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.359 -0.419 25277 1790 1 4 . 1 1 127 127 LEU C C 127 176.660 176.660 178.248 -1.588 25277 1791 1 4 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.642 0.468 25277 1792 1 4 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.647 1.283 25277 1793 1 4 . 1 1 127 127 LEU H H 127 8.790 8.790 8.411 0.379 25277 1794 1 4 . 1 1 128 128 GLY N N 128 106.600 106.600 108.947 -2.347 25277 1795 1 4 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.628 0.902 25277 1796 1 4 . 1 1 128 128 GLY H H 128 8.450 8.450 8.308 0.142 25277 1797 1 4 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.027 0.203 25277 1798 1 4 . 1 1 129 129 ALA C C 129 180.410 180.410 179.259 1.151 25277 1799 1 4 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.651 0.269 25277 1800 1 4 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.283 0.847 25277 1801 1 4 . 1 1 130 130 LEU N N 130 122.550 122.550 120.451 2.099 25277 1802 1 4 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.048 -0.128 25277 1803 1 4 . 1 1 130 130 LEU C C 130 179.020 179.020 178.514 0.506 25277 1804 1 4 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.380 0.249 25277 1805 1 4 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.622 0.518 25277 1806 1 4 . 1 1 130 130 LEU H H 130 8.040 8.040 7.477 0.563 25277 1807 1 4 . 1 1 131 131 LEU N N 131 121.910 121.910 119.404 2.506 25277 1808 1 4 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.862 0.058 25277 1809 1 4 . 1 1 131 131 LEU C C 131 177.910 177.910 178.411 -0.501 25277 1810 1 4 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.173 0.397 25277 1811 1 4 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.580 -0.860 25277 1812 1 4 . 1 1 131 131 LEU H H 131 9.060 9.060 7.941 1.119 25277 1813 1 4 . 1 1 132 132 SER N N 132 115.530 115.530 115.189 0.341 25277 1814 1 4 . 1 1 132 132 SER HA H 132 3.970 3.970 4.078 -0.108 25277 1815 1 4 . 1 1 132 132 SER C C 132 177.140 177.140 176.584 0.556 25277 1816 1 4 . 1 1 132 132 SER CA C 132 62.340 62.340 62.081 0.259 25277 1817 1 4 . 1 1 132 132 SER CB C 132 62.370 62.370 62.946 -0.576 25277 1818 1 4 . 1 1 132 132 SER H H 132 8.730 8.730 8.215 0.515 25277 1819 1 4 . 1 1 133 133 THR N N 133 116.960 116.960 118.777 -1.817 25277 1820 1 4 . 1 1 133 133 THR HA H 133 3.860 3.860 4.047 -0.187 25277 1821 1 4 . 1 1 133 133 THR C C 133 175.670 175.670 176.541 -0.871 25277 1822 1 4 . 1 1 133 133 THR CA C 133 66.930 66.930 67.175 -0.245 25277 1823 1 4 . 1 1 133 133 THR CB C 133 68.880 68.880 68.703 0.177 25277 1824 1 4 . 1 1 133 133 THR H H 133 7.750 7.750 7.763 -0.013 25277 1825 1 4 . 1 1 134 134 THR N N 134 118.830 118.830 119.348 -0.518 25277 1826 1 4 . 1 1 134 134 THR HA H 134 3.780 3.780 4.053 -0.273 25277 1827 1 4 . 1 1 134 134 THR C C 134 176.750 176.750 176.232 0.518 25277 1828 1 4 . 1 1 134 134 THR CA C 134 67.650 67.650 67.571 0.079 25277 1829 1 4 . 1 1 134 134 THR CB C 134 67.560 67.560 68.530 -0.970 25277 1830 1 4 . 1 1 134 134 THR H H 134 7.570 7.570 7.725 -0.155 25277 1831 1 4 . 1 1 135 135 LEU N N 135 121.420 121.420 121.729 -0.309 25277 1832 1 4 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.912 0.578 25277 1833 1 4 . 1 1 135 135 LEU C C 135 180.050 180.050 178.787 1.263 25277 1834 1 4 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.245 -1.234 25277 1835 1 4 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.346 -0.736 25277 1836 1 4 . 1 1 135 135 LEU H H 135 8.650 8.650 8.262 0.388 25277 1837 1 4 . 1 1 136 136 ASN N N 136 117.010 117.010 117.657 -0.647 25277 1838 1 4 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.462 0.078 25277 1839 1 4 . 1 1 136 136 ASN C C 136 175.980 175.980 177.818 -1.838 25277 1840 1 4 . 1 1 136 136 ASN CA C 136 54.770 54.770 55.754 -0.984 25277 1841 1 4 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.235 0.205 25277 1842 1 4 . 1 1 136 136 ASN H H 136 7.360 7.360 7.806 -0.446 25277 1843 1 4 . 1 1 137 137 LEU N N 137 116.940 116.940 120.516 -3.576 25277 1844 1 4 . 1 1 137 137 LEU HA H 137 4.160 4.160 3.999 0.161 25277 1845 1 4 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.648 -2.218 25277 1846 1 4 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.635 -0.065 25277 1847 1 4 . 1 1 137 137 LEU H H 137 7.810 7.810 7.498 0.312 25277 1848 1 4 . 1 1 138 138 CYS N N 138 115.430 115.430 114.722 0.708 25277 1849 1 4 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.215 0.195 25277 1850 1 4 . 1 1 138 138 CYS CA C 138 55.480 55.480 60.642 -5.162 25277 1851 1 4 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.552 14.648 25277 1852 1 4 . 1 1 138 138 CYS H H 138 7.450 7.450 7.814 -0.364 25277 1853 1 4 . 1 1 139 139 GLY C C 139 178.800 178.800 173.807 4.993 25277 1854 1 4 . 1 1 139 139 GLY CA C 139 45.500 45.500 44.849 0.651 25277 1855 1 4 . 1 1 140 140 LYS N N 140 119.830 119.830 122.198 -2.368 25277 1856 1 4 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.355 -0.035 25277 1857 1 4 . 1 1 140 140 LYS C C 140 175.820 175.820 176.888 -1.068 25277 1858 1 4 . 1 1 140 140 LYS CA C 140 55.680 55.680 56.745 -1.065 25277 1859 1 4 . 1 1 140 140 LYS CB C 140 32.800 32.800 33.059 -0.259 25277 1860 1 4 . 1 1 140 140 LYS H H 140 7.760 7.760 7.535 0.225 25277 1861 1 5 . 1 1 27 27 PRO CA C 27 63.230 63.230 63.075 0.155 25277 1862 1 5 . 1 1 27 27 PRO CB C 27 32.050 32.050 31.545 0.505 25277 1863 1 5 . 1 1 28 28 ASP N N 28 120.030 120.030 123.659 -3.629 25277 1864 1 5 . 1 1 28 28 ASP C C 28 176.130 176.130 174.744 1.386 25277 1865 1 5 . 1 1 28 28 ASP CA C 28 54.170 54.170 53.287 0.883 25277 1866 1 5 . 1 1 28 28 ASP CB C 28 40.860 40.860 41.594 -0.734 25277 1867 1 5 . 1 1 28 28 ASP H H 28 8.260 8.260 8.377 -0.117 25277 1868 1 5 . 1 1 29 29 LEU N N 29 123.030 123.030 121.396 1.634 25277 1869 1 5 . 1 1 29 29 LEU C C 29 177.870 177.870 176.803 1.067 25277 1870 1 5 . 1 1 29 29 LEU CA C 29 55.160 55.160 54.399 0.761 25277 1871 1 5 . 1 1 29 29 LEU CB C 29 42.270 42.270 43.068 -0.798 25277 1872 1 5 . 1 1 29 29 LEU H H 29 8.120 8.120 8.312 -0.192 25277 1873 1 5 . 1 1 30 30 GLY N N 30 109.350 109.350 112.346 -2.996 25277 1874 1 5 . 1 1 30 30 GLY CA C 30 45.340 45.340 44.550 0.790 25277 1875 1 5 . 1 1 30 30 GLY H H 30 8.410 8.410 8.794 -0.384 25277 1876 1 5 . 1 1 44 44 PRO CA C 44 63.590 63.590 63.706 -0.116 25277 1877 1 5 . 1 1 44 44 PRO CB C 44 31.990 31.990 31.991 -0.001 25277 1878 1 5 . 1 1 45 45 ALA N N 45 122.140 122.140 126.933 -4.793 25277 1879 1 5 . 1 1 45 45 ALA CA C 45 52.670 52.670 51.433 1.237 25277 1880 1 5 . 1 1 45 45 ALA H H 45 8.350 8.350 8.072 0.278 25277 1881 1 5 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.213 0.087 25277 1882 1 5 . 1 1 49 49 PRO CA C 49 62.950 62.950 63.167 -0.217 25277 1883 1 5 . 1 1 49 49 PRO CB C 49 31.990 31.990 32.212 -0.222 25277 1884 1 5 . 1 1 50 50 VAL N N 50 124.190 124.190 122.973 1.217 25277 1885 1 5 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.310 0.010 25277 1886 1 5 . 1 1 50 50 VAL CA C 50 59.850 59.850 59.750 0.100 25277 1887 1 5 . 1 1 50 50 VAL CB C 50 32.480 32.480 32.030 0.450 25277 1888 1 5 . 1 1 50 50 VAL H H 50 8.070 8.070 8.166 -0.096 25277 1889 1 5 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.318 0.032 25277 1890 1 5 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.140 -0.210 25277 1891 1 5 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.197 -0.217 25277 1892 1 5 . 1 1 52 52 LEU N N 52 124.500 124.500 121.091 3.409 25277 1893 1 5 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.282 0.208 25277 1894 1 5 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.763 -0.873 25277 1895 1 5 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.502 0.688 25277 1896 1 5 . 1 1 52 52 LEU H H 52 8.360 8.360 8.200 0.160 25277 1897 1 5 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.549 -0.139 25277 1898 1 5 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.257 0.073 25277 1899 1 5 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.282 -0.292 25277 1900 1 5 . 1 1 54 54 SER N N 54 117.380 117.380 116.739 0.641 25277 1901 1 5 . 1 1 54 54 SER HA H 54 4.600 4.600 4.442 0.158 25277 1902 1 5 . 1 1 54 54 SER CA C 54 56.710 56.710 58.074 -1.364 25277 1903 1 5 . 1 1 54 54 SER CB C 54 62.500 62.500 63.148 -0.648 25277 1904 1 5 . 1 1 54 54 SER H H 54 8.400 8.400 8.361 0.039 25277 1905 1 5 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.577 -0.027 25277 1906 1 5 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.454 0.086 25277 1907 1 5 . 1 1 55 55 PRO CB C 55 32.620 32.620 32.021 0.599 25277 1908 1 5 . 1 1 57 57 SER HA H 57 4.420 4.420 4.281 0.139 25277 1909 1 5 . 1 1 57 57 SER CA C 57 57.580 57.580 60.436 -2.856 25277 1910 1 5 . 1 1 57 57 SER CB C 57 63.780 63.780 63.212 0.568 25277 1911 1 5 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.240 0.750 25277 1912 1 5 . 1 1 58 58 ASN C C 58 172.230 172.230 173.797 -1.567 25277 1913 1 5 . 1 1 58 58 ASN CA C 58 53.670 53.670 54.863 -1.193 25277 1914 1 5 . 1 1 58 58 ASN CB C 58 37.850 37.850 37.195 0.655 25277 1915 1 5 . 1 1 59 59 LYS N N 59 117.660 117.660 117.656 0.004 25277 1916 1 5 . 1 1 59 59 LYS HA H 59 5.360 5.360 5.068 0.292 25277 1917 1 5 . 1 1 59 59 LYS C C 59 175.120 175.120 175.188 -0.068 25277 1918 1 5 . 1 1 59 59 LYS CA C 59 54.860 54.860 55.547 -0.687 25277 1919 1 5 . 1 1 59 59 LYS CB C 59 36.450 36.450 37.181 -0.731 25277 1920 1 5 . 1 1 59 59 LYS H H 59 7.640 7.640 7.817 -0.177 25277 1921 1 5 . 1 1 60 60 GLN N N 60 120.680 120.680 119.166 1.514 25277 1922 1 5 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.626 -0.136 25277 1923 1 5 . 1 1 60 60 GLN C C 60 173.640 173.640 173.263 0.377 25277 1924 1 5 . 1 1 60 60 GLN CA C 60 55.480 55.480 54.762 0.718 25277 1925 1 5 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.232 -0.242 25277 1926 1 5 . 1 1 60 60 GLN H H 60 8.930 8.930 8.547 0.383 25277 1927 1 5 . 1 1 61 61 ASP N N 61 126.170 126.170 121.738 4.432 25277 1928 1 5 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.835 0.215 25277 1929 1 5 . 1 1 61 61 ASP C C 61 175.000 175.000 175.234 -0.234 25277 1930 1 5 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.430 0.450 25277 1931 1 5 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.423 -0.653 25277 1932 1 5 . 1 1 61 61 ASP H H 61 8.540 8.540 8.580 -0.040 25277 1933 1 5 . 1 1 62 62 ILE N N 62 121.100 121.100 125.653 -4.553 25277 1934 1 5 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.562 0.218 25277 1935 1 5 . 1 1 62 62 ILE C C 62 171.480 171.480 173.648 -2.168 25277 1936 1 5 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.623 0.467 25277 1937 1 5 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.572 0.568 25277 1938 1 5 . 1 1 62 62 ILE H H 62 8.970 8.970 8.417 0.553 25277 1939 1 5 . 1 1 63 63 SER N N 63 119.430 119.430 121.280 -1.850 25277 1940 1 5 . 1 1 63 63 SER HA H 63 4.680 4.680 4.521 0.159 25277 1941 1 5 . 1 1 63 63 SER C C 63 174.030 174.030 174.357 -0.327 25277 1942 1 5 . 1 1 63 63 SER CA C 63 56.550 56.550 56.582 -0.032 25277 1943 1 5 . 1 1 63 63 SER CB C 63 67.320 67.320 66.124 1.196 25277 1944 1 5 . 1 1 63 63 SER H H 63 8.520 8.520 8.063 0.457 25277 1945 1 5 . 1 1 64 64 GLU N N 64 121.250 121.250 120.117 1.133 25277 1946 1 5 . 1 1 64 64 GLU HA H 64 2.770 2.770 2.962 -0.192 25277 1947 1 5 . 1 1 64 64 GLU C C 64 177.190 177.190 177.867 -0.677 25277 1948 1 5 . 1 1 64 64 GLU CA C 64 58.590 58.590 58.884 -0.294 25277 1949 1 5 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.628 -0.489 25277 1950 1 5 . 1 1 64 64 GLU H H 64 7.400 7.400 7.616 -0.216 25277 1951 1 5 . 1 1 65 65 ALA N N 65 119.250 119.250 122.014 -2.764 25277 1952 1 5 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.885 -0.025 25277 1953 1 5 . 1 1 65 65 ALA C C 65 179.630 179.630 179.395 0.235 25277 1954 1 5 . 1 1 65 65 ALA CA C 65 53.810 53.810 54.710 -0.900 25277 1955 1 5 . 1 1 65 65 ALA CB C 65 18.400 18.400 17.988 0.412 25277 1956 1 5 . 1 1 65 65 ALA H H 65 7.700 7.700 8.287 -0.587 25277 1957 1 5 . 1 1 66 66 ASN N N 66 112.360 112.360 115.675 -3.315 25277 1958 1 5 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.449 0.581 25277 1959 1 5 . 1 1 66 66 ASN C C 66 174.580 174.580 176.951 -2.371 25277 1960 1 5 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.472 0.077 25277 1961 1 5 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.571 1.359 25277 1962 1 5 . 1 1 66 66 ASN H H 66 7.960 7.960 7.442 0.518 25277 1963 1 5 . 1 1 67 67 LEU N N 67 115.390 115.390 118.627 -3.237 25277 1964 1 5 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.257 0.393 25277 1965 1 5 . 1 1 67 67 LEU C C 67 176.500 176.500 176.697 -0.197 25277 1966 1 5 . 1 1 67 67 LEU CA C 67 54.350 54.350 56.105 -1.755 25277 1967 1 5 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.310 2.360 25277 1968 1 5 . 1 1 67 67 LEU H H 67 7.050 7.050 7.509 -0.459 25277 1969 1 5 . 1 1 68 68 ALA N N 68 125.680 125.680 120.349 5.331 25277 1970 1 5 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.746 0.144 25277 1971 1 5 . 1 1 68 68 ALA C C 68 177.480 177.480 178.279 -0.799 25277 1972 1 5 . 1 1 68 68 ALA CA C 68 53.550 53.550 53.348 0.202 25277 1973 1 5 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.176 -0.026 25277 1974 1 5 . 1 1 68 68 ALA H H 68 8.880 8.880 7.998 0.882 25277 1975 1 5 . 1 1 69 69 TYR N N 69 119.780 119.780 120.134 -0.354 25277 1976 1 5 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.307 0.183 25277 1977 1 5 . 1 1 69 69 TYR C C 69 175.340 175.340 177.336 -1.996 25277 1978 1 5 . 1 1 69 69 TYR CA C 69 58.640 58.640 60.710 -2.070 25277 1979 1 5 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.036 -0.756 25277 1980 1 5 . 1 1 69 69 TYR H H 69 7.420 7.420 8.465 -1.045 25277 1981 1 5 . 1 1 70 70 LEU N N 70 118.820 118.820 116.915 1.905 25277 1982 1 5 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.153 0.137 25277 1983 1 5 . 1 1 70 70 LEU C C 70 176.770 176.770 177.466 -0.696 25277 1984 1 5 . 1 1 70 70 LEU CA C 70 53.880 53.880 55.602 -1.722 25277 1985 1 5 . 1 1 70 70 LEU CB C 70 41.300 41.300 41.797 -0.497 25277 1986 1 5 . 1 1 70 70 LEU H H 70 7.690 7.690 7.457 0.233 25277 1987 1 5 . 1 1 71 71 TRP N N 71 124.110 124.110 122.652 1.458 25277 1988 1 5 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.544 0.046 25277 1989 1 5 . 1 1 71 71 TRP CA C 71 54.150 54.150 56.047 -1.897 25277 1990 1 5 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.422 -0.212 25277 1991 1 5 . 1 1 71 71 TRP H H 71 8.130 8.130 7.678 0.452 25277 1992 1 5 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.393 0.187 25277 1993 1 5 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.173 0.417 25277 1994 1 5 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.767 -1.707 25277 1995 1 5 . 1 1 73 73 LEU N N 73 118.760 118.760 117.818 0.942 25277 1996 1 5 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.606 0.794 25277 1997 1 5 . 1 1 73 73 LEU C C 73 176.620 176.620 178.316 -1.696 25277 1998 1 5 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.737 -0.687 25277 1999 1 5 . 1 1 73 73 LEU CB C 73 44.260 44.260 43.135 1.125 25277 2000 1 5 . 1 1 73 73 LEU H H 73 5.190 5.190 6.636 -1.446 25277 2001 1 5 . 1 1 74 74 THR N N 74 110.120 110.120 115.310 -5.190 25277 2002 1 5 . 1 1 74 74 THR HA H 74 4.250 4.250 4.216 0.034 25277 2003 1 5 . 1 1 74 74 THR C C 74 176.080 176.080 175.503 0.577 25277 2004 1 5 . 1 1 74 74 THR CA C 74 62.690 62.690 64.055 -1.365 25277 2005 1 5 . 1 1 74 74 THR CB C 74 67.930 67.930 69.188 -1.258 25277 2006 1 5 . 1 1 74 74 THR H H 74 9.010 9.010 8.649 0.361 25277 2007 1 5 . 1 1 75 75 VAL N N 75 113.030 113.030 118.961 -5.931 25277 2008 1 5 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.261 0.549 25277 2009 1 5 . 1 1 75 75 VAL C C 75 176.010 176.010 177.242 -1.232 25277 2010 1 5 . 1 1 75 75 VAL CA C 75 59.100 59.100 62.770 -3.670 25277 2011 1 5 . 1 1 75 75 VAL CB C 75 33.220 33.220 32.740 0.480 25277 2012 1 5 . 1 1 75 75 VAL H H 75 6.660 6.660 7.531 -0.871 25277 2013 1 5 . 1 1 76 76 ASP N N 76 119.590 119.590 123.927 -4.337 25277 2014 1 5 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.671 -0.181 25277 2015 1 5 . 1 1 76 76 ASP C C 76 175.060 175.060 176.159 -1.099 25277 2016 1 5 . 1 1 76 76 ASP CA C 76 55.110 55.110 57.096 -1.986 25277 2017 1 5 . 1 1 76 76 ASP CB C 76 41.300 41.300 41.088 0.212 25277 2018 1 5 . 1 1 76 76 ASP H H 76 8.770 8.770 9.049 -0.279 25277 2019 1 5 . 1 1 77 77 HIS N N 77 113.300 113.300 112.054 1.246 25277 2020 1 5 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.727 0.363 25277 2021 1 5 . 1 1 77 77 HIS C C 77 171.370 171.370 173.861 -2.491 25277 2022 1 5 . 1 1 77 77 HIS CA C 77 55.590 55.590 54.551 1.039 25277 2023 1 5 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.603 -2.413 25277 2024 1 5 . 1 1 77 77 HIS H H 77 7.650 7.650 7.678 -0.028 25277 2025 1 5 . 1 1 78 78 GLY N N 78 101.350 101.350 105.339 -3.989 25277 2026 1 5 . 1 1 78 78 GLY C C 78 172.110 172.110 172.402 -0.292 25277 2027 1 5 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.811 -0.001 25277 2028 1 5 . 1 1 78 78 GLY H H 78 8.450 8.450 8.745 -0.295 25277 2029 1 5 . 1 1 79 79 THR N N 79 120.230 120.230 116.994 3.236 25277 2030 1 5 . 1 1 79 79 THR HA H 79 5.110 5.110 4.923 0.187 25277 2031 1 5 . 1 1 79 79 THR C C 79 172.920 172.920 173.798 -0.878 25277 2032 1 5 . 1 1 79 79 THR CA C 79 61.480 61.480 62.043 -0.563 25277 2033 1 5 . 1 1 79 79 THR CB C 79 72.130 72.130 70.806 1.324 25277 2034 1 5 . 1 1 79 79 THR H H 79 8.080 8.080 8.489 -0.409 25277 2035 1 5 . 1 1 80 80 ILE N N 80 119.620 119.620 120.702 -1.082 25277 2036 1 5 . 1 1 80 80 ILE HA H 80 5.140 5.140 5.029 0.111 25277 2037 1 5 . 1 1 80 80 ILE C C 80 174.340 174.340 174.070 0.270 25277 2038 1 5 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.155 0.195 25277 2039 1 5 . 1 1 80 80 ILE CB C 80 39.550 39.550 40.354 -0.804 25277 2040 1 5 . 1 1 80 80 ILE H H 80 8.970 8.970 8.733 0.237 25277 2041 1 5 . 1 1 81 81 GLU N N 81 119.960 119.960 121.770 -1.810 25277 2042 1 5 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.191 -0.191 25277 2043 1 5 . 1 1 81 81 GLU C C 81 176.130 176.130 174.808 1.322 25277 2044 1 5 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.257 0.303 25277 2045 1 5 . 1 1 81 81 GLU CB C 81 33.390 33.390 33.648 -0.258 25277 2046 1 5 . 1 1 81 81 GLU H H 81 8.350 8.350 8.332 0.018 25277 2047 1 5 . 1 1 82 82 CYS N N 82 123.110 123.110 121.971 1.139 25277 2048 1 5 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.175 -0.245 25277 2049 1 5 . 1 1 82 82 CYS C C 82 174.430 174.430 175.195 -0.765 25277 2050 1 5 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.371 -5.131 25277 2051 1 5 . 1 1 82 82 CYS CB C 82 43.720 43.720 27.184 16.536 25277 2052 1 5 . 1 1 82 82 CYS H H 82 8.220 8.220 8.357 -0.137 25277 2053 1 5 . 1 1 83 83 LEU N N 83 131.660 131.660 127.079 4.581 25277 2054 1 5 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.743 -0.213 25277 2055 1 5 . 1 1 83 83 LEU CA C 83 53.900 53.900 53.012 0.888 25277 2056 1 5 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.495 -2.295 25277 2057 1 5 . 1 1 83 83 LEU H H 83 8.910 8.910 8.215 0.695 25277 2058 1 5 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.228 0.142 25277 2059 1 5 . 1 1 84 84 PRO CA C 84 63.190 63.190 65.247 -2.057 25277 2060 1 5 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.829 0.101 25277 2061 1 5 . 1 1 85 85 SER N N 85 117.620 117.620 111.736 5.884 25277 2062 1 5 . 1 1 85 85 SER HA H 85 3.870 3.870 4.348 -0.478 25277 2063 1 5 . 1 1 85 85 SER C C 85 174.350 174.350 174.585 -0.235 25277 2064 1 5 . 1 1 85 85 SER CA C 85 58.970 58.970 58.187 0.783 25277 2065 1 5 . 1 1 85 85 SER CB C 85 63.820 63.820 62.998 0.822 25277 2066 1 5 . 1 1 85 85 SER H H 85 7.660 7.660 7.940 -0.280 25277 2067 1 5 . 1 1 86 86 ASP N N 86 117.590 117.590 118.404 -0.814 25277 2068 1 5 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.307 -0.167 25277 2069 1 5 . 1 1 86 86 ASP C C 86 174.480 174.480 174.112 0.368 25277 2070 1 5 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.691 -0.711 25277 2071 1 5 . 1 1 86 86 ASP CB C 86 37.850 37.850 38.334 -0.484 25277 2072 1 5 . 1 1 86 86 ASP H H 86 8.490 8.490 8.519 -0.029 25277 2073 1 5 . 1 1 87 87 ASN N N 87 117.160 117.160 116.894 0.266 25277 2074 1 5 . 1 1 87 87 ASN HA H 87 4.530 4.530 5.036 -0.506 25277 2075 1 5 . 1 1 87 87 ASN CA C 87 52.480 52.480 52.354 0.126 25277 2076 1 5 . 1 1 87 87 ASN CB C 87 40.040 40.040 41.761 -1.721 25277 2077 1 5 . 1 1 87 87 ASN H H 87 7.260 7.260 7.769 -0.509 25277 2078 1 5 . 1 1 88 88 ALA HA H 88 4.730 4.730 4.854 -0.124 25277 2079 1 5 . 1 1 88 88 ALA C C 88 174.620 174.620 176.253 -1.633 25277 2080 1 5 . 1 1 88 88 ALA CA C 88 51.230 51.230 50.803 0.427 25277 2081 1 5 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.341 0.199 25277 2082 1 5 . 1 1 89 89 VAL N N 89 116.580 116.580 117.839 -1.259 25277 2083 1 5 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.153 -0.053 25277 2084 1 5 . 1 1 89 89 VAL C C 89 172.750 172.750 173.525 -0.775 25277 2085 1 5 . 1 1 89 89 VAL CA C 89 58.980 58.980 59.481 -0.501 25277 2086 1 5 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.457 0.763 25277 2087 1 5 . 1 1 89 89 VAL H H 89 8.740 8.740 8.330 0.410 25277 2088 1 5 . 1 1 90 90 PHE N N 90 120.300 120.300 123.619 -3.319 25277 2089 1 5 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.096 0.054 25277 2090 1 5 . 1 1 90 90 PHE C C 90 172.910 172.910 173.665 -0.755 25277 2091 1 5 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.660 0.140 25277 2092 1 5 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.066 1.584 25277 2093 1 5 . 1 1 90 90 PHE H H 90 8.950 8.950 9.078 -0.128 25277 2094 1 5 . 1 1 91 91 VAL N N 91 129.020 129.020 127.636 1.384 25277 2095 1 5 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.665 -0.205 25277 2096 1 5 . 1 1 91 91 VAL C C 91 175.910 175.910 173.974 1.936 25277 2097 1 5 . 1 1 91 91 VAL CA C 91 60.780 60.780 60.504 0.276 25277 2098 1 5 . 1 1 91 91 VAL CB C 91 32.020 32.020 34.022 -2.002 25277 2099 1 5 . 1 1 91 91 VAL H H 91 9.090 9.090 8.713 0.377 25277 2100 1 5 . 1 1 92 92 ALA N N 92 129.760 129.760 129.467 0.293 25277 2101 1 5 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.754 -0.254 25277 2102 1 5 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.750 2.100 25277 2103 1 5 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.502 -1.452 25277 2104 1 5 . 1 1 92 92 ALA H H 92 8.680 8.680 8.420 0.260 25277 2105 1 5 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.069 0.091 25277 2106 1 5 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.091 0.309 25277 2107 1 5 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.611 0.329 25277 2108 1 5 . 1 1 94 94 ASP N N 94 113.220 113.220 114.942 -1.722 25277 2109 1 5 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.464 -0.044 25277 2110 1 5 . 1 1 94 94 ASP C C 94 176.980 176.980 177.471 -0.491 25277 2111 1 5 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.977 -0.447 25277 2112 1 5 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.858 -0.278 25277 2113 1 5 . 1 1 94 94 ASP H H 94 7.890 7.890 7.802 0.088 25277 2114 1 5 . 1 1 95 95 GLY N N 95 109.120 109.120 108.671 0.449 25277 2115 1 5 . 1 1 95 95 GLY C C 95 174.440 174.440 174.236 0.204 25277 2116 1 5 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.121 -0.561 25277 2117 1 5 . 1 1 95 95 GLY H H 95 8.500 8.500 8.161 0.339 25277 2118 1 5 . 1 1 96 96 THR N N 96 120.350 120.350 117.963 2.387 25277 2119 1 5 . 1 1 96 96 THR HA H 96 3.780 3.780 4.339 -0.559 25277 2120 1 5 . 1 1 96 96 THR C C 96 172.590 172.590 173.410 -0.820 25277 2121 1 5 . 1 1 96 96 THR CA C 96 64.660 64.660 61.750 2.910 25277 2122 1 5 . 1 1 96 96 THR CB C 96 68.330 68.330 70.172 -1.842 25277 2123 1 5 . 1 1 96 96 THR H H 96 8.100 8.100 8.428 -0.328 25277 2124 1 5 . 1 1 97 97 THR N N 97 122.660 122.660 120.842 1.818 25277 2125 1 5 . 1 1 97 97 THR HA H 97 4.590 4.590 4.761 -0.171 25277 2126 1 5 . 1 1 97 97 THR C C 97 173.000 173.000 173.345 -0.345 25277 2127 1 5 . 1 1 97 97 THR CA C 97 62.700 62.700 61.588 1.112 25277 2128 1 5 . 1 1 97 97 THR CB C 97 68.840 68.840 69.850 -1.010 25277 2129 1 5 . 1 1 97 97 THR H H 97 7.850 7.850 8.249 -0.399 25277 2130 1 5 . 1 1 98 98 TYR N N 98 122.890 122.890 125.301 -2.411 25277 2131 1 5 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.074 -0.134 25277 2132 1 5 . 1 1 98 98 TYR C C 98 178.970 178.970 174.917 4.053 25277 2133 1 5 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.493 0.017 25277 2134 1 5 . 1 1 98 98 TYR CB C 98 42.950 42.950 41.949 1.001 25277 2135 1 5 . 1 1 98 98 TYR H H 98 9.460 9.460 9.176 0.284 25277 2136 1 5 . 1 1 99 99 ALA N N 99 121.760 121.760 123.844 -2.084 25277 2137 1 5 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.706 -0.596 25277 2138 1 5 . 1 1 99 99 ALA C C 99 178.010 178.010 176.252 1.758 25277 2139 1 5 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.257 1.013 25277 2140 1 5 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.772 2.278 25277 2141 1 5 . 1 1 99 99 ALA H H 99 9.110 9.110 8.888 0.222 25277 2142 1 5 . 1 1 100 100 LEU N N 100 119.330 119.330 124.145 -4.815 25277 2143 1 5 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.260 0.210 25277 2144 1 5 . 1 1 100 100 LEU C C 100 174.720 174.720 177.400 -2.680 25277 2145 1 5 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.395 -2.255 25277 2146 1 5 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.726 1.904 25277 2147 1 5 . 1 1 100 100 LEU H H 100 8.950 8.950 8.282 0.668 25277 2148 1 5 . 1 1 101 101 ASN N N 101 112.600 112.600 116.210 -3.610 25277 2149 1 5 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.824 0.096 25277 2150 1 5 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.558 -1.628 25277 2151 1 5 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.985 0.615 25277 2152 1 5 . 1 1 101 101 ASN H H 101 7.550 7.550 7.626 -0.076 25277 2153 1 5 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.288 -0.098 25277 2154 1 5 . 1 1 102 102 ASP C C 102 178.770 178.770 177.682 1.088 25277 2155 1 5 . 1 1 102 102 ASP CA C 102 56.880 56.880 57.719 -0.840 25277 2156 1 5 . 1 1 102 102 ASP CB C 102 39.980 39.980 41.255 -1.275 25277 2157 1 5 . 1 1 103 103 ARG N N 103 119.370 119.370 119.359 0.011 25277 2158 1 5 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.070 -0.240 25277 2159 1 5 . 1 1 103 103 ARG C C 103 178.550 178.550 178.350 0.200 25277 2160 1 5 . 1 1 103 103 ARG CA C 103 59.380 59.380 59.133 0.247 25277 2161 1 5 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.943 -0.443 25277 2162 1 5 . 1 1 103 103 ARG H H 103 7.970 7.970 8.087 -0.117 25277 2163 1 5 . 1 1 104 104 ALA N N 104 120.110 120.110 122.167 -2.057 25277 2164 1 5 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.068 0.142 25277 2165 1 5 . 1 1 104 104 ALA C C 104 179.510 179.510 179.544 -0.034 25277 2166 1 5 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.316 -0.566 25277 2167 1 5 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.325 1.345 25277 2168 1 5 . 1 1 104 104 ALA H H 104 7.610 7.610 8.457 -0.847 25277 2169 1 5 . 1 1 105 105 GLU N N 105 120.460 120.460 118.312 2.148 25277 2170 1 5 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.145 0.565 25277 2171 1 5 . 1 1 105 105 GLU C C 105 181.710 181.710 179.903 1.807 25277 2172 1 5 . 1 1 105 105 GLU CA C 105 58.680 58.680 58.754 -0.074 25277 2173 1 5 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.280 0.210 25277 2174 1 5 . 1 1 105 105 GLU H H 105 7.750 7.750 7.822 -0.072 25277 2175 1 5 . 1 1 106 106 LYS N N 106 121.980 121.980 120.207 1.773 25277 2176 1 5 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.068 -0.048 25277 2177 1 5 . 1 1 106 106 LYS C C 106 177.890 177.890 178.542 -0.652 25277 2178 1 5 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.706 -0.236 25277 2179 1 5 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.076 -0.346 25277 2180 1 5 . 1 1 106 106 LYS H H 106 8.380 8.380 7.983 0.397 25277 2181 1 5 . 1 1 107 107 ALA N N 107 119.850 119.850 119.312 0.538 25277 2182 1 5 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.202 0.058 25277 2183 1 5 . 1 1 107 107 ALA C C 107 177.210 177.210 177.658 -0.448 25277 2184 1 5 . 1 1 107 107 ALA CA C 107 52.270 52.270 52.030 0.240 25277 2185 1 5 . 1 1 107 107 ALA CB C 107 18.740 18.740 18.547 0.193 25277 2186 1 5 . 1 1 107 107 ALA H H 107 7.400 7.400 7.602 -0.202 25277 2187 1 5 . 1 1 108 108 GLY N N 108 104.560 104.560 105.827 -1.267 25277 2188 1 5 . 1 1 108 108 GLY C C 108 174.300 174.300 174.495 -0.195 25277 2189 1 5 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.012 -0.402 25277 2190 1 5 . 1 1 108 108 GLY H H 108 7.560 7.560 7.762 -0.202 25277 2191 1 5 . 1 1 109 109 HIS N N 109 122.550 122.550 120.563 1.987 25277 2192 1 5 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.906 -0.136 25277 2193 1 5 . 1 1 109 109 HIS CA C 109 54.580 54.580 53.455 1.125 25277 2194 1 5 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.096 -0.506 25277 2195 1 5 . 1 1 109 109 HIS H H 109 7.590 7.590 7.579 0.011 25277 2196 1 5 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.824 -0.264 25277 2197 1 5 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.174 0.556 25277 2198 1 5 . 1 1 111 111 PRO CB C 111 32.800 32.800 33.164 -0.364 25277 2199 1 5 . 1 1 112 112 ILE N N 112 119.770 119.770 119.690 0.080 25277 2200 1 5 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.399 0.461 25277 2201 1 5 . 1 1 112 112 ILE C C 112 172.800 172.800 177.467 -4.667 25277 2202 1 5 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.339 -2.149 25277 2203 1 5 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.262 3.178 25277 2204 1 5 . 1 1 112 112 ILE H H 112 7.890 7.890 8.541 -0.651 25277 2205 1 5 . 1 1 113 113 THR N N 113 113.610 113.610 116.417 -2.807 25277 2206 1 5 . 1 1 113 113 THR HA H 113 3.010 3.010 3.971 -0.961 25277 2207 1 5 . 1 1 113 113 THR CA C 113 66.860 66.860 68.017 -1.157 25277 2208 1 5 . 1 1 113 113 THR CB C 113 66.920 66.920 67.293 -0.373 25277 2209 1 5 . 1 1 113 113 THR H H 113 7.070 7.070 8.544 -1.474 25277 2210 1 5 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.340 0.000 25277 2211 1 5 . 1 1 114 114 PRO CA C 114 66.080 66.080 65.026 1.054 25277 2212 1 5 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.542 0.538 25277 2213 1 5 . 1 1 115 115 ILE N N 115 134.770 134.770 110.057 24.713 25277 2214 1 5 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.401 0.209 25277 2215 1 5 . 1 1 115 115 ILE C C 115 174.800 174.800 174.980 -0.180 25277 2216 1 5 . 1 1 115 115 ILE CA C 115 60.000 60.000 59.915 0.085 25277 2217 1 5 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.560 0.300 25277 2218 1 5 . 1 1 115 115 ILE H H 115 7.510 7.510 7.587 -0.077 25277 2219 1 5 . 1 1 116 116 ARG N N 116 120.890 120.890 122.210 -1.320 25277 2220 1 5 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.152 -0.182 25277 2221 1 5 . 1 1 116 116 ARG C C 116 174.910 174.910 175.775 -0.865 25277 2222 1 5 . 1 1 116 116 ARG CA C 116 57.780 57.780 56.035 1.745 25277 2223 1 5 . 1 1 116 116 ARG CB C 116 31.870 31.870 31.442 0.428 25277 2224 1 5 . 1 1 116 116 ARG H H 116 7.280 7.280 7.540 -0.260 25277 2225 1 5 . 1 1 117 117 ALA N N 117 125.400 125.400 128.495 -3.095 25277 2226 1 5 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.385 -0.155 25277 2227 1 5 . 1 1 117 117 ALA C C 117 176.290 176.290 175.804 0.486 25277 2228 1 5 . 1 1 117 117 ALA CA C 117 50.780 50.780 51.151 -0.372 25277 2229 1 5 . 1 1 117 117 ALA CB C 117 20.290 20.290 20.780 -0.490 25277 2230 1 5 . 1 1 117 117 ALA H H 117 8.150 8.150 8.512 -0.362 25277 2231 1 5 . 1 1 118 118 LYS N N 118 119.890 119.890 121.887 -1.997 25277 2232 1 5 . 1 1 118 118 LYS HA H 118 4.590 4.590 3.613 0.977 25277 2233 1 5 . 1 1 118 118 LYS C C 118 177.400 177.400 176.780 0.620 25277 2234 1 5 . 1 1 118 118 LYS CA C 118 55.670 55.670 55.362 0.308 25277 2235 1 5 . 1 1 118 118 LYS CB C 118 34.510 34.510 32.971 1.539 25277 2236 1 5 . 1 1 118 118 LYS H H 118 8.360 8.360 8.226 0.134 25277 2237 1 5 . 1 1 119 119 GLY N N 119 108.630 108.630 112.811 -4.181 25277 2238 1 5 . 1 1 119 119 GLY CA C 119 43.610 43.610 44.178 -0.568 25277 2239 1 5 . 1 1 119 119 GLY H H 119 8.320 8.320 7.851 0.469 25277 2240 1 5 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.683 0.217 25277 2241 1 5 . 1 1 124 124 TYR C C 124 177.430 177.430 176.551 0.879 25277 2242 1 5 . 1 1 124 124 TYR CA C 124 57.970 57.970 57.583 0.387 25277 2243 1 5 . 1 1 124 124 TYR CB C 124 38.650 38.650 40.452 -1.802 25277 2244 1 5 . 1 1 125 125 ILE N N 125 123.670 123.670 122.496 1.174 25277 2245 1 5 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.140 -0.300 25277 2246 1 5 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.450 0.280 25277 2247 1 5 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.332 0.178 25277 2248 1 5 . 1 1 125 125 ILE H H 125 8.340 8.340 8.071 0.269 25277 2249 1 5 . 1 1 126 126 SER HA H 126 4.070 4.070 4.391 -0.321 25277 2250 1 5 . 1 1 126 126 SER C C 126 176.290 176.290 175.002 1.288 25277 2251 1 5 . 1 1 126 126 SER CA C 126 59.190 59.190 59.082 0.108 25277 2252 1 5 . 1 1 126 126 SER CB C 126 63.200 63.200 63.834 -0.634 25277 2253 1 5 . 1 1 127 127 LEU N N 127 127.030 127.030 124.206 2.824 25277 2254 1 5 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.346 -0.406 25277 2255 1 5 . 1 1 127 127 LEU C C 127 176.660 176.660 178.197 -1.537 25277 2256 1 5 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.677 0.433 25277 2257 1 5 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.549 1.381 25277 2258 1 5 . 1 1 127 127 LEU H H 127 8.790 8.790 8.383 0.407 25277 2259 1 5 . 1 1 128 128 GLY N N 128 106.600 106.600 108.953 -2.353 25277 2260 1 5 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.616 0.914 25277 2261 1 5 . 1 1 128 128 GLY H H 128 8.450 8.450 8.308 0.142 25277 2262 1 5 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.113 0.117 25277 2263 1 5 . 1 1 129 129 ALA C C 129 180.410 180.410 179.407 1.003 25277 2264 1 5 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.620 0.299 25277 2265 1 5 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.254 0.876 25277 2266 1 5 . 1 1 130 130 LEU N N 130 122.550 122.550 120.617 1.933 25277 2267 1 5 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.041 -0.121 25277 2268 1 5 . 1 1 130 130 LEU C C 130 179.020 179.020 178.490 0.530 25277 2269 1 5 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.367 0.263 25277 2270 1 5 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.614 0.526 25277 2271 1 5 . 1 1 130 130 LEU H H 130 8.040 8.040 7.430 0.610 25277 2272 1 5 . 1 1 131 131 LEU N N 131 121.910 121.910 119.220 2.690 25277 2273 1 5 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.869 0.051 25277 2274 1 5 . 1 1 131 131 LEU C C 131 177.910 177.910 178.512 -0.602 25277 2275 1 5 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.063 0.507 25277 2276 1 5 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.391 -0.671 25277 2277 1 5 . 1 1 131 131 LEU H H 131 9.060 9.060 7.876 1.184 25277 2278 1 5 . 1 1 132 132 SER N N 132 115.530 115.530 113.860 1.670 25277 2279 1 5 . 1 1 132 132 SER HA H 132 3.970 3.970 4.051 -0.081 25277 2280 1 5 . 1 1 132 132 SER C C 132 177.140 177.140 176.635 0.505 25277 2281 1 5 . 1 1 132 132 SER CA C 132 62.340 62.340 61.950 0.390 25277 2282 1 5 . 1 1 132 132 SER CB C 132 62.370 62.370 62.892 -0.522 25277 2283 1 5 . 1 1 132 132 SER H H 132 8.730 8.730 8.017 0.713 25277 2284 1 5 . 1 1 133 133 THR N N 133 116.960 116.960 118.339 -1.379 25277 2285 1 5 . 1 1 133 133 THR HA H 133 3.860 3.860 3.991 -0.131 25277 2286 1 5 . 1 1 133 133 THR C C 133 175.670 175.670 176.456 -0.786 25277 2287 1 5 . 1 1 133 133 THR CA C 133 66.930 66.930 67.244 -0.314 25277 2288 1 5 . 1 1 133 133 THR CB C 133 68.880 68.880 68.861 0.019 25277 2289 1 5 . 1 1 133 133 THR H H 133 7.750 7.750 7.798 -0.048 25277 2290 1 5 . 1 1 134 134 THR N N 134 118.830 118.830 118.861 -0.031 25277 2291 1 5 . 1 1 134 134 THR HA H 134 3.780 3.780 4.078 -0.298 25277 2292 1 5 . 1 1 134 134 THR C C 134 176.750 176.750 176.267 0.483 25277 2293 1 5 . 1 1 134 134 THR CA C 134 67.650 67.650 67.362 0.288 25277 2294 1 5 . 1 1 134 134 THR CB C 134 67.560 67.560 68.447 -0.887 25277 2295 1 5 . 1 1 134 134 THR H H 134 7.570 7.570 7.734 -0.164 25277 2296 1 5 . 1 1 135 135 LEU N N 135 121.420 121.420 121.752 -0.332 25277 2297 1 5 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.909 0.581 25277 2298 1 5 . 1 1 135 135 LEU C C 135 180.050 180.050 178.724 1.326 25277 2299 1 5 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.246 -1.236 25277 2300 1 5 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.375 -0.765 25277 2301 1 5 . 1 1 135 135 LEU H H 135 8.650 8.650 8.265 0.385 25277 2302 1 5 . 1 1 136 136 ASN N N 136 117.010 117.010 117.410 -0.400 25277 2303 1 5 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.455 0.085 25277 2304 1 5 . 1 1 136 136 ASN C C 136 175.980 175.980 177.884 -1.904 25277 2305 1 5 . 1 1 136 136 ASN CA C 136 54.770 54.770 55.789 -1.019 25277 2306 1 5 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.285 0.155 25277 2307 1 5 . 1 1 136 136 ASN H H 136 7.360 7.360 7.864 -0.504 25277 2308 1 5 . 1 1 137 137 LEU N N 137 116.940 116.940 120.626 -3.686 25277 2309 1 5 . 1 1 137 137 LEU HA H 137 4.160 4.160 3.998 0.162 25277 2310 1 5 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.655 -2.225 25277 2311 1 5 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.619 -0.049 25277 2312 1 5 . 1 1 137 137 LEU H H 137 7.810 7.810 7.619 0.191 25277 2313 1 5 . 1 1 138 138 CYS N N 138 115.430 115.430 115.069 0.361 25277 2314 1 5 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.247 0.163 25277 2315 1 5 . 1 1 138 138 CYS CA C 138 55.480 55.480 60.934 -5.454 25277 2316 1 5 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.375 14.825 25277 2317 1 5 . 1 1 138 138 CYS H H 138 7.450 7.450 7.890 -0.440 25277 2318 1 5 . 1 1 139 139 GLY C C 139 178.800 178.800 173.852 4.948 25277 2319 1 5 . 1 1 139 139 GLY CA C 139 45.500 45.500 45.096 0.404 25277 2320 1 5 . 1 1 140 140 LYS N N 140 119.830 119.830 121.845 -2.015 25277 2321 1 5 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.477 -0.157 25277 2322 1 5 . 1 1 140 140 LYS C C 140 175.820 175.820 176.916 -1.096 25277 2323 1 5 . 1 1 140 140 LYS CA C 140 55.680 55.680 55.961 -0.281 25277 2324 1 5 . 1 1 140 140 LYS CB C 140 32.800 32.800 33.414 -0.614 25277 2325 1 5 . 1 1 140 140 LYS H H 140 7.760 7.760 7.419 0.341 25277 2326 1 6 . 1 1 27 27 PRO CA C 27 63.230 63.230 62.311 0.919 25277 2327 1 6 . 1 1 27 27 PRO CB C 27 32.050 32.050 32.310 -0.260 25277 2328 1 6 . 1 1 28 28 ASP N N 28 120.030 120.030 119.324 0.706 25277 2329 1 6 . 1 1 28 28 ASP C C 28 176.130 176.130 176.263 -0.133 25277 2330 1 6 . 1 1 28 28 ASP CA C 28 54.170 54.170 54.175 -0.005 25277 2331 1 6 . 1 1 28 28 ASP CB C 28 40.860 40.860 41.181 -0.321 25277 2332 1 6 . 1 1 28 28 ASP H H 28 8.260 8.260 8.331 -0.071 25277 2333 1 6 . 1 1 29 29 LEU N N 29 123.030 123.030 121.418 1.612 25277 2334 1 6 . 1 1 29 29 LEU C C 29 177.870 177.870 177.638 0.232 25277 2335 1 6 . 1 1 29 29 LEU CA C 29 55.160 55.160 55.147 0.013 25277 2336 1 6 . 1 1 29 29 LEU CB C 29 42.270 42.270 42.470 -0.200 25277 2337 1 6 . 1 1 29 29 LEU H H 29 8.120 8.120 8.356 -0.236 25277 2338 1 6 . 1 1 30 30 GLY N N 30 109.350 109.350 109.331 0.019 25277 2339 1 6 . 1 1 30 30 GLY CA C 30 45.340 45.340 45.096 0.244 25277 2340 1 6 . 1 1 30 30 GLY H H 30 8.410 8.410 8.332 0.078 25277 2341 1 6 . 1 1 44 44 PRO CA C 44 63.590 63.590 63.307 0.283 25277 2342 1 6 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.121 -0.131 25277 2343 1 6 . 1 1 45 45 ALA N N 45 122.140 122.140 126.005 -3.865 25277 2344 1 6 . 1 1 45 45 ALA CA C 45 52.670 52.670 51.683 0.987 25277 2345 1 6 . 1 1 45 45 ALA H H 45 8.350 8.350 8.017 0.333 25277 2346 1 6 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.235 0.065 25277 2347 1 6 . 1 1 49 49 PRO CA C 49 62.950 62.950 63.074 -0.124 25277 2348 1 6 . 1 1 49 49 PRO CB C 49 31.990 31.990 32.117 -0.127 25277 2349 1 6 . 1 1 50 50 VAL N N 50 124.190 124.190 123.448 0.742 25277 2350 1 6 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.295 0.025 25277 2351 1 6 . 1 1 50 50 VAL CA C 50 59.850 59.850 59.665 0.185 25277 2352 1 6 . 1 1 50 50 VAL CB C 50 32.480 32.480 32.672 -0.192 25277 2353 1 6 . 1 1 50 50 VAL H H 50 8.070 8.070 8.169 -0.099 25277 2354 1 6 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.289 0.061 25277 2355 1 6 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.217 -0.287 25277 2356 1 6 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.128 -0.148 25277 2357 1 6 . 1 1 52 52 LEU N N 52 124.500 124.500 121.001 3.499 25277 2358 1 6 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.279 0.211 25277 2359 1 6 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.752 -0.862 25277 2360 1 6 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.434 0.755 25277 2361 1 6 . 1 1 52 52 LEU H H 52 8.360 8.360 8.199 0.161 25277 2362 1 6 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.556 -0.146 25277 2363 1 6 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.211 0.119 25277 2364 1 6 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.287 -0.297 25277 2365 1 6 . 1 1 54 54 SER N N 54 117.380 117.380 116.197 1.183 25277 2366 1 6 . 1 1 54 54 SER HA H 54 4.600 4.600 4.437 0.163 25277 2367 1 6 . 1 1 54 54 SER CA C 54 56.710 56.710 58.111 -1.401 25277 2368 1 6 . 1 1 54 54 SER CB C 54 62.500 62.500 63.040 -0.540 25277 2369 1 6 . 1 1 54 54 SER H H 54 8.400 8.400 8.346 0.054 25277 2370 1 6 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.543 0.007 25277 2371 1 6 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.486 0.054 25277 2372 1 6 . 1 1 55 55 PRO CB C 55 32.620 32.620 31.965 0.655 25277 2373 1 6 . 1 1 57 57 SER HA H 57 4.420 4.420 4.271 0.148 25277 2374 1 6 . 1 1 57 57 SER CA C 57 57.580 57.580 60.522 -2.942 25277 2375 1 6 . 1 1 57 57 SER CB C 57 63.780 63.780 63.217 0.563 25277 2376 1 6 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.321 0.669 25277 2377 1 6 . 1 1 58 58 ASN C C 58 172.230 172.230 173.932 -1.702 25277 2378 1 6 . 1 1 58 58 ASN CA C 58 53.670 53.670 54.815 -1.145 25277 2379 1 6 . 1 1 58 58 ASN CB C 58 37.850 37.850 37.225 0.625 25277 2380 1 6 . 1 1 59 59 LYS N N 59 117.660 117.660 114.604 3.056 25277 2381 1 6 . 1 1 59 59 LYS HA H 59 5.360 5.360 4.915 0.445 25277 2382 1 6 . 1 1 59 59 LYS C C 59 175.120 175.120 174.010 1.110 25277 2383 1 6 . 1 1 59 59 LYS CA C 59 54.860 54.860 55.541 -0.681 25277 2384 1 6 . 1 1 59 59 LYS CB C 59 36.450 36.450 36.386 0.064 25277 2385 1 6 . 1 1 59 59 LYS H H 59 7.640 7.640 7.758 -0.118 25277 2386 1 6 . 1 1 60 60 GLN N N 60 120.680 120.680 118.127 2.553 25277 2387 1 6 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.688 -0.198 25277 2388 1 6 . 1 1 60 60 GLN C C 60 173.640 173.640 173.513 0.127 25277 2389 1 6 . 1 1 60 60 GLN CA C 60 55.480 55.480 54.755 0.725 25277 2390 1 6 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.145 -0.155 25277 2391 1 6 . 1 1 60 60 GLN H H 60 8.930 8.930 8.307 0.623 25277 2392 1 6 . 1 1 61 61 ASP N N 61 126.170 126.170 121.501 4.669 25277 2393 1 6 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.845 0.205 25277 2394 1 6 . 1 1 61 61 ASP C C 61 175.000 175.000 175.239 -0.239 25277 2395 1 6 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.399 0.481 25277 2396 1 6 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.391 -0.621 25277 2397 1 6 . 1 1 61 61 ASP H H 61 8.540 8.540 8.606 -0.066 25277 2398 1 6 . 1 1 62 62 ILE N N 62 121.100 121.100 125.668 -4.568 25277 2399 1 6 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.557 0.223 25277 2400 1 6 . 1 1 62 62 ILE C C 62 171.480 171.480 173.627 -2.147 25277 2401 1 6 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.623 0.467 25277 2402 1 6 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.506 0.634 25277 2403 1 6 . 1 1 62 62 ILE H H 62 8.970 8.970 8.379 0.591 25277 2404 1 6 . 1 1 63 63 SER N N 63 119.430 119.430 121.176 -1.746 25277 2405 1 6 . 1 1 63 63 SER HA H 63 4.680 4.680 4.562 0.118 25277 2406 1 6 . 1 1 63 63 SER C C 63 174.030 174.030 174.400 -0.370 25277 2407 1 6 . 1 1 63 63 SER CA C 63 56.550 56.550 56.528 0.022 25277 2408 1 6 . 1 1 63 63 SER CB C 63 67.320 67.320 66.140 1.180 25277 2409 1 6 . 1 1 63 63 SER H H 63 8.520 8.520 7.990 0.530 25277 2410 1 6 . 1 1 64 64 GLU N N 64 121.250 121.250 119.950 1.300 25277 2411 1 6 . 1 1 64 64 GLU HA H 64 2.770 2.770 2.939 -0.169 25277 2412 1 6 . 1 1 64 64 GLU C C 64 177.190 177.190 177.851 -0.661 25277 2413 1 6 . 1 1 64 64 GLU CA C 64 58.590 58.590 58.834 -0.244 25277 2414 1 6 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.636 -0.496 25277 2415 1 6 . 1 1 64 64 GLU H H 64 7.400 7.400 7.620 -0.220 25277 2416 1 6 . 1 1 65 65 ALA N N 65 119.250 119.250 122.180 -2.930 25277 2417 1 6 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.875 -0.015 25277 2418 1 6 . 1 1 65 65 ALA C C 65 179.630 179.630 179.398 0.232 25277 2419 1 6 . 1 1 65 65 ALA CA C 65 53.810 53.810 54.720 -0.910 25277 2420 1 6 . 1 1 65 65 ALA CB C 65 18.400 18.400 17.992 0.408 25277 2421 1 6 . 1 1 65 65 ALA H H 65 7.700 7.700 8.266 -0.566 25277 2422 1 6 . 1 1 66 66 ASN N N 66 112.360 112.360 115.677 -3.317 25277 2423 1 6 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.427 0.603 25277 2424 1 6 . 1 1 66 66 ASN C C 66 174.580 174.580 176.985 -2.405 25277 2425 1 6 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.553 -0.003 25277 2426 1 6 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.534 1.396 25277 2427 1 6 . 1 1 66 66 ASN H H 66 7.960 7.960 7.444 0.516 25277 2428 1 6 . 1 1 67 67 LEU N N 67 115.390 115.390 118.458 -3.068 25277 2429 1 6 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.252 0.398 25277 2430 1 6 . 1 1 67 67 LEU C C 67 176.500 176.500 176.724 -0.224 25277 2431 1 6 . 1 1 67 67 LEU CA C 67 54.350 54.350 56.065 -1.715 25277 2432 1 6 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.282 2.388 25277 2433 1 6 . 1 1 67 67 LEU H H 67 7.050 7.050 7.476 -0.426 25277 2434 1 6 . 1 1 68 68 ALA N N 68 125.680 125.680 120.085 5.595 25277 2435 1 6 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.765 0.125 25277 2436 1 6 . 1 1 68 68 ALA C C 68 177.480 177.480 178.028 -0.548 25277 2437 1 6 . 1 1 68 68 ALA CA C 68 53.550 53.550 53.283 0.267 25277 2438 1 6 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.236 -0.086 25277 2439 1 6 . 1 1 68 68 ALA H H 68 8.880 8.880 7.968 0.912 25277 2440 1 6 . 1 1 69 69 TYR N N 69 119.780 119.780 120.037 -0.257 25277 2441 1 6 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.320 0.170 25277 2442 1 6 . 1 1 69 69 TYR C C 69 175.340 175.340 177.284 -1.944 25277 2443 1 6 . 1 1 69 69 TYR CA C 69 58.640 58.640 60.669 -2.029 25277 2444 1 6 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.031 -0.750 25277 2445 1 6 . 1 1 69 69 TYR H H 69 7.420 7.420 8.503 -1.083 25277 2446 1 6 . 1 1 70 70 LEU N N 70 118.820 118.820 116.897 1.923 25277 2447 1 6 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.159 0.131 25277 2448 1 6 . 1 1 70 70 LEU C C 70 176.770 176.770 177.449 -0.679 25277 2449 1 6 . 1 1 70 70 LEU CA C 70 53.880 53.880 55.580 -1.700 25277 2450 1 6 . 1 1 70 70 LEU CB C 70 41.300 41.300 41.780 -0.480 25277 2451 1 6 . 1 1 70 70 LEU H H 70 7.690 7.690 7.459 0.231 25277 2452 1 6 . 1 1 71 71 TRP N N 71 124.110 124.110 122.641 1.469 25277 2453 1 6 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.538 0.052 25277 2454 1 6 . 1 1 71 71 TRP CA C 71 54.150 54.150 56.032 -1.882 25277 2455 1 6 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.452 -0.242 25277 2456 1 6 . 1 1 71 71 TRP H H 71 8.130 8.130 7.690 0.440 25277 2457 1 6 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.382 0.198 25277 2458 1 6 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.192 0.398 25277 2459 1 6 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.738 -1.678 25277 2460 1 6 . 1 1 73 73 LEU N N 73 118.760 118.760 117.762 0.998 25277 2461 1 6 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.611 0.789 25277 2462 1 6 . 1 1 73 73 LEU C C 73 176.620 176.620 178.162 -1.542 25277 2463 1 6 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.626 -0.576 25277 2464 1 6 . 1 1 73 73 LEU CB C 73 44.260 44.260 43.294 0.966 25277 2465 1 6 . 1 1 73 73 LEU H H 73 5.190 5.190 6.528 -1.338 25277 2466 1 6 . 1 1 74 74 THR N N 74 110.120 110.120 114.716 -4.596 25277 2467 1 6 . 1 1 74 74 THR HA H 74 4.250 4.250 4.204 0.046 25277 2468 1 6 . 1 1 74 74 THR C C 74 176.080 176.080 175.709 0.371 25277 2469 1 6 . 1 1 74 74 THR CA C 74 62.690 62.690 64.158 -1.468 25277 2470 1 6 . 1 1 74 74 THR CB C 74 67.930 67.930 69.108 -1.178 25277 2471 1 6 . 1 1 74 74 THR H H 74 9.010 9.010 8.524 0.486 25277 2472 1 6 . 1 1 75 75 VAL N N 75 113.030 113.030 118.306 -5.276 25277 2473 1 6 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.200 0.610 25277 2474 1 6 . 1 1 75 75 VAL C C 75 176.010 176.010 177.250 -1.240 25277 2475 1 6 . 1 1 75 75 VAL CA C 75 59.100 59.100 61.877 -2.777 25277 2476 1 6 . 1 1 75 75 VAL CB C 75 33.220 33.220 33.114 0.106 25277 2477 1 6 . 1 1 75 75 VAL H H 75 6.660 6.660 7.518 -0.858 25277 2478 1 6 . 1 1 76 76 ASP N N 76 119.590 119.590 121.511 -1.921 25277 2479 1 6 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.613 -0.123 25277 2480 1 6 . 1 1 76 76 ASP C C 76 175.060 175.060 176.179 -1.119 25277 2481 1 6 . 1 1 76 76 ASP CA C 76 55.110 55.110 56.627 -1.517 25277 2482 1 6 . 1 1 76 76 ASP CB C 76 41.300 41.300 40.897 0.403 25277 2483 1 6 . 1 1 76 76 ASP H H 76 8.770 8.770 9.006 -0.236 25277 2484 1 6 . 1 1 77 77 HIS N N 77 113.300 113.300 113.667 -0.367 25277 2485 1 6 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.775 0.315 25277 2486 1 6 . 1 1 77 77 HIS C C 77 171.370 171.370 173.725 -2.355 25277 2487 1 6 . 1 1 77 77 HIS CA C 77 55.590 55.590 55.043 0.547 25277 2488 1 6 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.756 -2.566 25277 2489 1 6 . 1 1 77 77 HIS H H 77 7.650 7.650 7.603 0.047 25277 2490 1 6 . 1 1 78 78 GLY N N 78 101.350 101.350 105.698 -4.348 25277 2491 1 6 . 1 1 78 78 GLY C C 78 172.110 172.110 172.114 -0.004 25277 2492 1 6 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.830 -0.019 25277 2493 1 6 . 1 1 78 78 GLY H H 78 8.450 8.450 8.797 -0.347 25277 2494 1 6 . 1 1 79 79 THR N N 79 120.230 120.230 117.423 2.807 25277 2495 1 6 . 1 1 79 79 THR HA H 79 5.110 5.110 4.926 0.184 25277 2496 1 6 . 1 1 79 79 THR C C 79 172.920 172.920 173.901 -0.981 25277 2497 1 6 . 1 1 79 79 THR CA C 79 61.480 61.480 61.745 -0.265 25277 2498 1 6 . 1 1 79 79 THR CB C 79 72.130 72.130 70.850 1.280 25277 2499 1 6 . 1 1 79 79 THR H H 79 8.080 8.080 8.520 -0.440 25277 2500 1 6 . 1 1 80 80 ILE N N 80 119.620 119.620 120.636 -1.016 25277 2501 1 6 . 1 1 80 80 ILE HA H 80 5.140 5.140 4.978 0.163 25277 2502 1 6 . 1 1 80 80 ILE C C 80 174.340 174.340 173.990 0.350 25277 2503 1 6 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.250 0.100 25277 2504 1 6 . 1 1 80 80 ILE CB C 80 39.550 39.550 40.474 -0.924 25277 2505 1 6 . 1 1 80 80 ILE H H 80 8.970 8.970 8.675 0.295 25277 2506 1 6 . 1 1 81 81 GLU N N 81 119.960 119.960 125.279 -5.319 25277 2507 1 6 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.085 -0.085 25277 2508 1 6 . 1 1 81 81 GLU C C 81 176.130 176.130 174.450 1.680 25277 2509 1 6 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.848 -0.288 25277 2510 1 6 . 1 1 81 81 GLU CB C 81 33.390 33.390 34.492 -1.102 25277 2511 1 6 . 1 1 81 81 GLU H H 81 8.350 8.350 8.310 0.040 25277 2512 1 6 . 1 1 82 82 CYS N N 82 123.110 123.110 124.476 -1.366 25277 2513 1 6 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.171 -0.241 25277 2514 1 6 . 1 1 82 82 CYS C C 82 174.430 174.430 175.009 -0.579 25277 2515 1 6 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.107 -4.867 25277 2516 1 6 . 1 1 82 82 CYS CB C 82 43.720 43.720 27.018 16.702 25277 2517 1 6 . 1 1 82 82 CYS H H 82 8.220 8.220 8.364 -0.144 25277 2518 1 6 . 1 1 83 83 LEU N N 83 131.660 131.660 127.196 4.464 25277 2519 1 6 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.695 -0.165 25277 2520 1 6 . 1 1 83 83 LEU CA C 83 53.900 53.900 53.238 0.662 25277 2521 1 6 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.562 -2.362 25277 2522 1 6 . 1 1 83 83 LEU H H 83 8.910 8.910 8.204 0.706 25277 2523 1 6 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.255 0.115 25277 2524 1 6 . 1 1 84 84 PRO CA C 84 63.190 63.190 65.128 -1.938 25277 2525 1 6 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.702 0.228 25277 2526 1 6 . 1 1 85 85 SER N N 85 117.620 117.620 111.385 6.235 25277 2527 1 6 . 1 1 85 85 SER HA H 85 3.870 3.870 4.381 -0.511 25277 2528 1 6 . 1 1 85 85 SER C C 85 174.350 174.350 174.574 -0.224 25277 2529 1 6 . 1 1 85 85 SER CA C 85 58.970 58.970 58.135 0.836 25277 2530 1 6 . 1 1 85 85 SER CB C 85 63.820 63.820 62.624 1.196 25277 2531 1 6 . 1 1 85 85 SER H H 85 7.660 7.660 8.137 -0.477 25277 2532 1 6 . 1 1 86 86 ASP N N 86 117.590 117.590 118.979 -1.389 25277 2533 1 6 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.326 -0.186 25277 2534 1 6 . 1 1 86 86 ASP C C 86 174.480 174.480 174.251 0.229 25277 2535 1 6 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.722 -0.742 25277 2536 1 6 . 1 1 86 86 ASP CB C 86 37.850 37.850 38.747 -0.897 25277 2537 1 6 . 1 1 86 86 ASP H H 86 8.490 8.490 8.473 0.017 25277 2538 1 6 . 1 1 87 87 ASN N N 87 117.160 117.160 116.780 0.380 25277 2539 1 6 . 1 1 87 87 ASN HA H 87 4.530 4.530 5.027 -0.497 25277 2540 1 6 . 1 1 87 87 ASN CA C 87 52.480 52.480 52.016 0.464 25277 2541 1 6 . 1 1 87 87 ASN CB C 87 40.040 40.040 41.007 -0.967 25277 2542 1 6 . 1 1 87 87 ASN H H 87 7.260 7.260 7.811 -0.551 25277 2543 1 6 . 1 1 88 88 ALA HA H 88 4.730 4.730 4.730 -0.000 25277 2544 1 6 . 1 1 88 88 ALA C C 88 174.620 174.620 176.251 -1.631 25277 2545 1 6 . 1 1 88 88 ALA CA C 88 51.230 51.230 50.966 0.264 25277 2546 1 6 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.124 0.416 25277 2547 1 6 . 1 1 89 89 VAL N N 89 116.580 116.580 118.422 -1.842 25277 2548 1 6 . 1 1 89 89 VAL HA H 89 5.100 5.100 4.969 0.131 25277 2549 1 6 . 1 1 89 89 VAL C C 89 172.750 172.750 173.560 -0.810 25277 2550 1 6 . 1 1 89 89 VAL CA C 89 58.980 58.980 60.005 -1.025 25277 2551 1 6 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.611 0.609 25277 2552 1 6 . 1 1 89 89 VAL H H 89 8.740 8.740 8.299 0.441 25277 2553 1 6 . 1 1 90 90 PHE N N 90 120.300 120.300 123.494 -3.194 25277 2554 1 6 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.107 0.043 25277 2555 1 6 . 1 1 90 90 PHE C C 90 172.910 172.910 173.802 -0.892 25277 2556 1 6 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.559 0.241 25277 2557 1 6 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.384 1.266 25277 2558 1 6 . 1 1 90 90 PHE H H 90 8.950 8.950 8.868 0.082 25277 2559 1 6 . 1 1 91 91 VAL N N 91 129.020 129.020 127.822 1.198 25277 2560 1 6 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.673 -0.213 25277 2561 1 6 . 1 1 91 91 VAL C C 91 175.910 175.910 174.002 1.908 25277 2562 1 6 . 1 1 91 91 VAL CA C 91 60.780 60.780 60.485 0.295 25277 2563 1 6 . 1 1 91 91 VAL CB C 91 32.020 32.020 33.969 -1.949 25277 2564 1 6 . 1 1 91 91 VAL H H 91 9.090 9.090 8.724 0.366 25277 2565 1 6 . 1 1 92 92 ALA N N 92 129.760 129.760 129.459 0.301 25277 2566 1 6 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.755 -0.255 25277 2567 1 6 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.771 2.079 25277 2568 1 6 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.451 -1.401 25277 2569 1 6 . 1 1 92 92 ALA H H 92 8.680 8.680 8.438 0.242 25277 2570 1 6 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.094 0.066 25277 2571 1 6 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.025 0.375 25277 2572 1 6 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.614 0.326 25277 2573 1 6 . 1 1 94 94 ASP N N 94 113.220 113.220 114.956 -1.736 25277 2574 1 6 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.469 -0.049 25277 2575 1 6 . 1 1 94 94 ASP C C 94 176.980 176.980 177.485 -0.505 25277 2576 1 6 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.995 -0.465 25277 2577 1 6 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.874 -0.294 25277 2578 1 6 . 1 1 94 94 ASP H H 94 7.890 7.890 7.811 0.079 25277 2579 1 6 . 1 1 95 95 GLY N N 95 109.120 109.120 108.308 0.812 25277 2580 1 6 . 1 1 95 95 GLY C C 95 174.440 174.440 174.343 0.097 25277 2581 1 6 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.126 -0.565 25277 2582 1 6 . 1 1 95 95 GLY H H 95 8.500 8.500 8.171 0.329 25277 2583 1 6 . 1 1 96 96 THR N N 96 120.350 120.350 118.597 1.753 25277 2584 1 6 . 1 1 96 96 THR HA H 96 3.780 3.780 4.451 -0.671 25277 2585 1 6 . 1 1 96 96 THR C C 96 172.590 172.590 173.282 -0.692 25277 2586 1 6 . 1 1 96 96 THR CA C 96 64.660 64.660 61.996 2.664 25277 2587 1 6 . 1 1 96 96 THR CB C 96 68.330 68.330 70.077 -1.747 25277 2588 1 6 . 1 1 96 96 THR H H 96 8.100 8.100 8.429 -0.329 25277 2589 1 6 . 1 1 97 97 THR N N 97 122.660 122.660 121.453 1.207 25277 2590 1 6 . 1 1 97 97 THR HA H 97 4.590 4.590 4.749 -0.159 25277 2591 1 6 . 1 1 97 97 THR C C 97 173.000 173.000 173.653 -0.653 25277 2592 1 6 . 1 1 97 97 THR CA C 97 62.700 62.700 62.284 0.416 25277 2593 1 6 . 1 1 97 97 THR CB C 97 68.840 68.840 69.927 -1.087 25277 2594 1 6 . 1 1 97 97 THR H H 97 7.850 7.850 8.404 -0.554 25277 2595 1 6 . 1 1 98 98 TYR N N 98 122.890 122.890 125.426 -2.536 25277 2596 1 6 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.234 -0.294 25277 2597 1 6 . 1 1 98 98 TYR C C 98 178.970 178.970 174.715 4.255 25277 2598 1 6 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.154 0.356 25277 2599 1 6 . 1 1 98 98 TYR CB C 98 42.950 42.950 42.294 0.656 25277 2600 1 6 . 1 1 98 98 TYR H H 98 9.460 9.460 9.262 0.198 25277 2601 1 6 . 1 1 99 99 ALA N N 99 121.760 121.760 123.284 -1.524 25277 2602 1 6 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.641 -0.531 25277 2603 1 6 . 1 1 99 99 ALA C C 99 178.010 178.010 176.167 1.843 25277 2604 1 6 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.129 1.141 25277 2605 1 6 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.824 2.226 25277 2606 1 6 . 1 1 99 99 ALA H H 99 9.110 9.110 8.921 0.189 25277 2607 1 6 . 1 1 100 100 LEU N N 100 119.330 119.330 124.345 -5.015 25277 2608 1 6 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.253 0.217 25277 2609 1 6 . 1 1 100 100 LEU C C 100 174.720 174.720 177.295 -2.575 25277 2610 1 6 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.463 -2.323 25277 2611 1 6 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.720 1.910 25277 2612 1 6 . 1 1 100 100 LEU H H 100 8.950 8.950 8.284 0.665 25277 2613 1 6 . 1 1 101 101 ASN N N 101 112.600 112.600 115.589 -2.989 25277 2614 1 6 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.803 0.117 25277 2615 1 6 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.289 -1.359 25277 2616 1 6 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.365 1.235 25277 2617 1 6 . 1 1 101 101 ASN H H 101 7.550 7.550 7.601 -0.051 25277 2618 1 6 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.377 -0.187 25277 2619 1 6 . 1 1 102 102 ASP C C 102 178.770 178.770 178.314 0.456 25277 2620 1 6 . 1 1 102 102 ASP CA C 102 56.880 56.880 57.854 -0.974 25277 2621 1 6 . 1 1 102 102 ASP CB C 102 39.980 39.980 40.560 -0.580 25277 2622 1 6 . 1 1 103 103 ARG N N 103 119.370 119.370 119.982 -0.612 25277 2623 1 6 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.132 -0.302 25277 2624 1 6 . 1 1 103 103 ARG C C 103 178.550 178.550 178.377 0.173 25277 2625 1 6 . 1 1 103 103 ARG CA C 103 59.380 59.380 59.077 0.303 25277 2626 1 6 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.871 -0.371 25277 2627 1 6 . 1 1 103 103 ARG H H 103 7.970 7.970 8.060 -0.090 25277 2628 1 6 . 1 1 104 104 ALA N N 104 120.110 120.110 122.239 -2.129 25277 2629 1 6 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.091 0.119 25277 2630 1 6 . 1 1 104 104 ALA C C 104 179.510 179.510 179.454 0.056 25277 2631 1 6 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.284 -0.534 25277 2632 1 6 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.356 1.314 25277 2633 1 6 . 1 1 104 104 ALA H H 104 7.610 7.610 8.523 -0.913 25277 2634 1 6 . 1 1 105 105 GLU N N 105 120.460 120.460 118.622 1.838 25277 2635 1 6 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.074 0.636 25277 2636 1 6 . 1 1 105 105 GLU C C 105 181.710 181.710 179.676 2.034 25277 2637 1 6 . 1 1 105 105 GLU CA C 105 58.680 58.680 58.886 -0.206 25277 2638 1 6 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.580 -0.090 25277 2639 1 6 . 1 1 105 105 GLU H H 105 7.750 7.750 7.785 -0.035 25277 2640 1 6 . 1 1 106 106 LYS N N 106 121.980 121.980 120.759 1.221 25277 2641 1 6 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.093 -0.073 25277 2642 1 6 . 1 1 106 106 LYS C C 106 177.890 177.890 178.035 -0.145 25277 2643 1 6 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.721 -0.251 25277 2644 1 6 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.439 -0.709 25277 2645 1 6 . 1 1 106 106 LYS H H 106 8.380 8.380 7.965 0.415 25277 2646 1 6 . 1 1 107 107 ALA N N 107 119.850 119.850 119.000 0.850 25277 2647 1 6 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.304 -0.044 25277 2648 1 6 . 1 1 107 107 ALA C C 107 177.210 177.210 177.584 -0.374 25277 2649 1 6 . 1 1 107 107 ALA CA C 107 52.270 52.270 52.179 0.090 25277 2650 1 6 . 1 1 107 107 ALA CB C 107 18.740 18.740 18.992 -0.252 25277 2651 1 6 . 1 1 107 107 ALA H H 107 7.400 7.400 7.657 -0.257 25277 2652 1 6 . 1 1 108 108 GLY N N 108 104.560 104.560 106.119 -1.559 25277 2653 1 6 . 1 1 108 108 GLY C C 108 174.300 174.300 174.491 -0.191 25277 2654 1 6 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.025 -0.415 25277 2655 1 6 . 1 1 108 108 GLY H H 108 7.560 7.560 7.819 -0.259 25277 2656 1 6 . 1 1 109 109 HIS N N 109 122.550 122.550 120.903 1.647 25277 2657 1 6 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.903 -0.133 25277 2658 1 6 . 1 1 109 109 HIS CA C 109 54.580 54.580 54.702 -0.122 25277 2659 1 6 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.769 -1.179 25277 2660 1 6 . 1 1 109 109 HIS H H 109 7.590 7.590 7.716 -0.126 25277 2661 1 6 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.661 -0.101 25277 2662 1 6 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.219 0.511 25277 2663 1 6 . 1 1 111 111 PRO CB C 111 32.800 32.800 32.974 -0.174 25277 2664 1 6 . 1 1 112 112 ILE N N 112 119.770 119.770 120.552 -0.782 25277 2665 1 6 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.347 0.513 25277 2666 1 6 . 1 1 112 112 ILE C C 112 172.800 172.800 177.462 -4.662 25277 2667 1 6 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.294 -2.104 25277 2668 1 6 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.283 3.157 25277 2669 1 6 . 1 1 112 112 ILE H H 112 7.890 7.890 8.612 -0.722 25277 2670 1 6 . 1 1 113 113 THR N N 113 113.610 113.610 115.859 -2.249 25277 2671 1 6 . 1 1 113 113 THR HA H 113 3.010 3.010 3.959 -0.949 25277 2672 1 6 . 1 1 113 113 THR CA C 113 66.860 66.860 67.857 -0.997 25277 2673 1 6 . 1 1 113 113 THR CB C 113 66.920 66.920 67.652 -0.732 25277 2674 1 6 . 1 1 113 113 THR H H 113 7.070 7.070 8.482 -1.412 25277 2675 1 6 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.327 0.013 25277 2676 1 6 . 1 1 114 114 PRO CA C 114 66.080 66.080 65.084 0.996 25277 2677 1 6 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.514 0.566 25277 2678 1 6 . 1 1 115 115 ILE N N 115 134.770 134.770 109.749 25.021 25277 2679 1 6 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.425 0.185 25277 2680 1 6 . 1 1 115 115 ILE C C 115 174.800 174.800 174.867 -0.067 25277 2681 1 6 . 1 1 115 115 ILE CA C 115 60.000 60.000 59.865 0.135 25277 2682 1 6 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.607 0.253 25277 2683 1 6 . 1 1 115 115 ILE H H 115 7.510 7.510 7.586 -0.076 25277 2684 1 6 . 1 1 116 116 ARG N N 116 120.890 120.890 122.144 -1.254 25277 2685 1 6 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.145 -0.175 25277 2686 1 6 . 1 1 116 116 ARG C C 116 174.910 174.910 175.637 -0.727 25277 2687 1 6 . 1 1 116 116 ARG CA C 116 57.780 57.780 55.949 1.831 25277 2688 1 6 . 1 1 116 116 ARG CB C 116 31.870 31.870 31.458 0.412 25277 2689 1 6 . 1 1 116 116 ARG H H 116 7.280 7.280 7.533 -0.253 25277 2690 1 6 . 1 1 117 117 ALA N N 117 125.400 125.400 127.682 -2.282 25277 2691 1 6 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.445 -0.215 25277 2692 1 6 . 1 1 117 117 ALA C C 117 176.290 176.290 175.869 0.421 25277 2693 1 6 . 1 1 117 117 ALA CA C 117 50.780 50.780 51.009 -0.229 25277 2694 1 6 . 1 1 117 117 ALA CB C 117 20.290 20.290 20.764 -0.474 25277 2695 1 6 . 1 1 117 117 ALA H H 117 8.150 8.150 8.438 -0.288 25277 2696 1 6 . 1 1 118 118 LYS N N 118 119.890 119.890 122.393 -2.503 25277 2697 1 6 . 1 1 118 118 LYS HA H 118 4.590 4.590 4.033 0.557 25277 2698 1 6 . 1 1 118 118 LYS C C 118 177.400 177.400 175.806 1.594 25277 2699 1 6 . 1 1 118 118 LYS CA C 118 55.670 55.670 54.619 1.051 25277 2700 1 6 . 1 1 118 118 LYS CB C 118 34.510 34.510 33.473 1.037 25277 2701 1 6 . 1 1 118 118 LYS H H 118 8.360 8.360 8.163 0.197 25277 2702 1 6 . 1 1 119 119 GLY N N 119 108.630 108.630 110.079 -1.449 25277 2703 1 6 . 1 1 119 119 GLY CA C 119 43.610 43.610 44.038 -0.427 25277 2704 1 6 . 1 1 119 119 GLY H H 119 8.320 8.320 8.004 0.316 25277 2705 1 6 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.717 0.183 25277 2706 1 6 . 1 1 124 124 TYR C C 124 177.430 177.430 175.863 1.567 25277 2707 1 6 . 1 1 124 124 TYR CA C 124 57.970 57.970 56.912 1.058 25277 2708 1 6 . 1 1 124 124 TYR CB C 124 38.650 38.650 40.797 -2.147 25277 2709 1 6 . 1 1 125 125 ILE N N 125 123.670 123.670 123.375 0.295 25277 2710 1 6 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.125 -0.285 25277 2711 1 6 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.629 0.101 25277 2712 1 6 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.514 -0.004 25277 2713 1 6 . 1 1 125 125 ILE H H 125 8.340 8.340 8.257 0.083 25277 2714 1 6 . 1 1 126 126 SER HA H 126 4.070 4.070 4.301 -0.231 25277 2715 1 6 . 1 1 126 126 SER C C 126 176.290 176.290 174.916 1.374 25277 2716 1 6 . 1 1 126 126 SER CA C 126 59.190 59.190 59.741 -0.551 25277 2717 1 6 . 1 1 126 126 SER CB C 126 63.200 63.200 63.695 -0.495 25277 2718 1 6 . 1 1 127 127 LEU N N 127 127.030 127.030 124.167 2.863 25277 2719 1 6 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.367 -0.427 25277 2720 1 6 . 1 1 127 127 LEU C C 127 176.660 176.660 178.241 -1.581 25277 2721 1 6 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.751 0.359 25277 2722 1 6 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.648 1.282 25277 2723 1 6 . 1 1 127 127 LEU H H 127 8.790 8.790 8.385 0.405 25277 2724 1 6 . 1 1 128 128 GLY N N 128 106.600 106.600 108.854 -2.254 25277 2725 1 6 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.636 0.894 25277 2726 1 6 . 1 1 128 128 GLY H H 128 8.450 8.450 8.306 0.144 25277 2727 1 6 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.045 0.185 25277 2728 1 6 . 1 1 129 129 ALA C C 129 180.410 180.410 179.231 1.179 25277 2729 1 6 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.580 0.340 25277 2730 1 6 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.315 0.815 25277 2731 1 6 . 1 1 130 130 LEU N N 130 122.550 122.550 120.609 1.941 25277 2732 1 6 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.055 -0.135 25277 2733 1 6 . 1 1 130 130 LEU C C 130 179.020 179.020 178.492 0.528 25277 2734 1 6 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.398 0.232 25277 2735 1 6 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.630 0.510 25277 2736 1 6 . 1 1 130 130 LEU H H 130 8.040 8.040 7.441 0.599 25277 2737 1 6 . 1 1 131 131 LEU N N 131 121.910 121.910 119.715 2.195 25277 2738 1 6 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.895 0.025 25277 2739 1 6 . 1 1 131 131 LEU C C 131 177.910 177.910 178.222 -0.312 25277 2740 1 6 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.179 0.391 25277 2741 1 6 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.543 -0.823 25277 2742 1 6 . 1 1 131 131 LEU H H 131 9.060 9.060 7.819 1.241 25277 2743 1 6 . 1 1 132 132 SER N N 132 115.530 115.530 115.016 0.514 25277 2744 1 6 . 1 1 132 132 SER HA H 132 3.970 3.970 4.062 -0.092 25277 2745 1 6 . 1 1 132 132 SER C C 132 177.140 177.140 176.632 0.508 25277 2746 1 6 . 1 1 132 132 SER CA C 132 62.340 62.340 62.066 0.274 25277 2747 1 6 . 1 1 132 132 SER CB C 132 62.370 62.370 62.826 -0.456 25277 2748 1 6 . 1 1 132 132 SER H H 132 8.730 8.730 8.139 0.591 25277 2749 1 6 . 1 1 133 133 THR N N 133 116.960 116.960 118.093 -1.133 25277 2750 1 6 . 1 1 133 133 THR HA H 133 3.860 3.860 4.075 -0.215 25277 2751 1 6 . 1 1 133 133 THR C C 133 175.670 175.670 176.817 -1.147 25277 2752 1 6 . 1 1 133 133 THR CA C 133 66.930 66.930 66.852 0.078 25277 2753 1 6 . 1 1 133 133 THR CB C 133 68.880 68.880 68.572 0.308 25277 2754 1 6 . 1 1 133 133 THR H H 133 7.750 7.750 7.784 -0.034 25277 2755 1 6 . 1 1 134 134 THR N N 134 118.830 118.830 118.944 -0.114 25277 2756 1 6 . 1 1 134 134 THR HA H 134 3.780 3.780 4.095 -0.315 25277 2757 1 6 . 1 1 134 134 THR C C 134 176.750 176.750 176.477 0.273 25277 2758 1 6 . 1 1 134 134 THR CA C 134 67.650 67.650 66.835 0.815 25277 2759 1 6 . 1 1 134 134 THR CB C 134 67.560 67.560 68.454 -0.895 25277 2760 1 6 . 1 1 134 134 THR H H 134 7.570 7.570 7.753 -0.183 25277 2761 1 6 . 1 1 135 135 LEU N N 135 121.420 121.420 121.929 -0.509 25277 2762 1 6 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.925 0.566 25277 2763 1 6 . 1 1 135 135 LEU C C 135 180.050 180.050 179.080 0.970 25277 2764 1 6 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.152 -1.142 25277 2765 1 6 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.459 -0.849 25277 2766 1 6 . 1 1 135 135 LEU H H 135 8.650 8.650 8.290 0.360 25277 2767 1 6 . 1 1 136 136 ASN N N 136 117.010 117.010 117.567 -0.557 25277 2768 1 6 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.443 0.097 25277 2769 1 6 . 1 1 136 136 ASN C C 136 175.980 175.980 177.846 -1.866 25277 2770 1 6 . 1 1 136 136 ASN CA C 136 54.770 54.770 55.865 -1.095 25277 2771 1 6 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.231 0.209 25277 2772 1 6 . 1 1 136 136 ASN H H 136 7.360 7.360 7.794 -0.434 25277 2773 1 6 . 1 1 137 137 LEU N N 137 116.940 116.940 120.439 -3.499 25277 2774 1 6 . 1 1 137 137 LEU HA H 137 4.160 4.160 4.011 0.149 25277 2775 1 6 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.548 -2.119 25277 2776 1 6 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.659 -0.089 25277 2777 1 6 . 1 1 137 137 LEU H H 137 7.810 7.810 7.577 0.233 25277 2778 1 6 . 1 1 138 138 CYS N N 138 115.430 115.430 114.621 0.809 25277 2779 1 6 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.169 0.241 25277 2780 1 6 . 1 1 138 138 CYS CA C 138 55.480 55.480 61.493 -6.013 25277 2781 1 6 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.587 14.613 25277 2782 1 6 . 1 1 138 138 CYS H H 138 7.450 7.450 7.918 -0.468 25277 2783 1 6 . 1 1 139 139 GLY C C 139 178.800 178.800 174.285 4.515 25277 2784 1 6 . 1 1 139 139 GLY CA C 139 45.500 45.500 45.269 0.231 25277 2785 1 6 . 1 1 140 140 LYS N N 140 119.830 119.830 121.787 -1.957 25277 2786 1 6 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.563 -0.243 25277 2787 1 6 . 1 1 140 140 LYS C C 140 175.820 175.820 176.292 -0.472 25277 2788 1 6 . 1 1 140 140 LYS CA C 140 55.680 55.680 55.621 0.059 25277 2789 1 6 . 1 1 140 140 LYS CB C 140 32.800 32.800 33.502 -0.702 25277 2790 1 6 . 1 1 140 140 LYS H H 140 7.760 7.760 7.782 -0.022 25277 2791 1 7 . 1 1 27 27 PRO CA C 27 63.230 63.230 62.321 0.909 25277 2792 1 7 . 1 1 27 27 PRO CB C 27 32.050 32.050 32.225 -0.175 25277 2793 1 7 . 1 1 28 28 ASP N N 28 120.030 120.030 119.607 0.423 25277 2794 1 7 . 1 1 28 28 ASP C C 28 176.130 176.130 176.247 -0.117 25277 2795 1 7 . 1 1 28 28 ASP CA C 28 54.170 54.170 54.005 0.165 25277 2796 1 7 . 1 1 28 28 ASP CB C 28 40.860 40.860 41.326 -0.466 25277 2797 1 7 . 1 1 28 28 ASP H H 28 8.260 8.260 8.301 -0.041 25277 2798 1 7 . 1 1 29 29 LEU N N 29 123.030 123.030 121.895 1.135 25277 2799 1 7 . 1 1 29 29 LEU C C 29 177.870 177.870 177.693 0.177 25277 2800 1 7 . 1 1 29 29 LEU CA C 29 55.160 55.160 54.568 0.592 25277 2801 1 7 . 1 1 29 29 LEU CB C 29 42.270 42.270 42.544 -0.274 25277 2802 1 7 . 1 1 29 29 LEU H H 29 8.120 8.120 8.139 -0.019 25277 2803 1 7 . 1 1 30 30 GLY N N 30 109.350 109.350 109.748 -0.398 25277 2804 1 7 . 1 1 30 30 GLY CA C 30 45.340 45.340 45.341 -0.001 25277 2805 1 7 . 1 1 30 30 GLY H H 30 8.410 8.410 8.500 -0.090 25277 2806 1 7 . 1 1 44 44 PRO CA C 44 63.590 63.590 62.802 0.788 25277 2807 1 7 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.395 -0.405 25277 2808 1 7 . 1 1 45 45 ALA N N 45 122.140 122.140 119.245 2.895 25277 2809 1 7 . 1 1 45 45 ALA CA C 45 52.670 52.670 51.090 1.580 25277 2810 1 7 . 1 1 45 45 ALA H H 45 8.350 8.350 7.997 0.353 25277 2811 1 7 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.265 0.035 25277 2812 1 7 . 1 1 49 49 PRO CA C 49 62.950 62.950 62.957 -0.007 25277 2813 1 7 . 1 1 49 49 PRO CB C 49 31.990 31.990 32.117 -0.127 25277 2814 1 7 . 1 1 50 50 VAL N N 50 124.190 124.190 122.992 1.198 25277 2815 1 7 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.209 0.111 25277 2816 1 7 . 1 1 50 50 VAL CA C 50 59.850 59.850 60.404 -0.554 25277 2817 1 7 . 1 1 50 50 VAL CB C 50 32.480 32.480 31.889 0.591 25277 2818 1 7 . 1 1 50 50 VAL H H 50 8.070 8.070 8.249 -0.179 25277 2819 1 7 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.256 0.094 25277 2820 1 7 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.016 -0.086 25277 2821 1 7 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.163 -0.183 25277 2822 1 7 . 1 1 52 52 LEU N N 52 124.500 124.500 121.319 3.181 25277 2823 1 7 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.273 0.217 25277 2824 1 7 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.811 -0.921 25277 2825 1 7 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.800 0.390 25277 2826 1 7 . 1 1 52 52 LEU H H 52 8.360 8.360 8.205 0.155 25277 2827 1 7 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.572 -0.162 25277 2828 1 7 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.231 0.099 25277 2829 1 7 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.373 -0.383 25277 2830 1 7 . 1 1 54 54 SER N N 54 117.380 117.380 116.583 0.797 25277 2831 1 7 . 1 1 54 54 SER HA H 54 4.600 4.600 4.419 0.181 25277 2832 1 7 . 1 1 54 54 SER CA C 54 56.710 56.710 58.105 -1.395 25277 2833 1 7 . 1 1 54 54 SER CB C 54 62.500 62.500 63.064 -0.564 25277 2834 1 7 . 1 1 54 54 SER H H 54 8.400 8.400 8.360 0.040 25277 2835 1 7 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.528 0.022 25277 2836 1 7 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.512 0.028 25277 2837 1 7 . 1 1 55 55 PRO CB C 55 32.620 32.620 32.238 0.382 25277 2838 1 7 . 1 1 57 57 SER HA H 57 4.420 4.420 4.230 0.190 25277 2839 1 7 . 1 1 57 57 SER CA C 57 57.580 57.580 60.215 -2.635 25277 2840 1 7 . 1 1 57 57 SER CB C 57 63.780 63.780 63.445 0.335 25277 2841 1 7 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.341 0.649 25277 2842 1 7 . 1 1 58 58 ASN C C 58 172.230 172.230 173.776 -1.546 25277 2843 1 7 . 1 1 58 58 ASN CA C 58 53.670 53.670 54.987 -1.317 25277 2844 1 7 . 1 1 58 58 ASN CB C 58 37.850 37.850 38.107 -0.257 25277 2845 1 7 . 1 1 59 59 LYS N N 59 117.660 117.660 115.088 2.572 25277 2846 1 7 . 1 1 59 59 LYS HA H 59 5.360 5.360 4.926 0.434 25277 2847 1 7 . 1 1 59 59 LYS C C 59 175.120 175.120 173.992 1.128 25277 2848 1 7 . 1 1 59 59 LYS CA C 59 54.860 54.860 55.382 -0.522 25277 2849 1 7 . 1 1 59 59 LYS CB C 59 36.450 36.450 36.372 0.078 25277 2850 1 7 . 1 1 59 59 LYS H H 59 7.640 7.640 7.718 -0.078 25277 2851 1 7 . 1 1 60 60 GLN N N 60 120.680 120.680 117.895 2.785 25277 2852 1 7 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.673 -0.183 25277 2853 1 7 . 1 1 60 60 GLN C C 60 173.640 173.640 173.465 0.175 25277 2854 1 7 . 1 1 60 60 GLN CA C 60 55.480 55.480 54.708 0.772 25277 2855 1 7 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.203 -0.213 25277 2856 1 7 . 1 1 60 60 GLN H H 60 8.930 8.930 8.293 0.637 25277 2857 1 7 . 1 1 61 61 ASP N N 61 126.170 126.170 121.505 4.665 25277 2858 1 7 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.824 0.226 25277 2859 1 7 . 1 1 61 61 ASP C C 61 175.000 175.000 175.263 -0.263 25277 2860 1 7 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.524 0.356 25277 2861 1 7 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.334 -0.564 25277 2862 1 7 . 1 1 61 61 ASP H H 61 8.540 8.540 8.609 -0.069 25277 2863 1 7 . 1 1 62 62 ILE N N 62 121.100 121.100 125.599 -4.499 25277 2864 1 7 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.524 0.256 25277 2865 1 7 . 1 1 62 62 ILE C C 62 171.480 171.480 173.671 -2.191 25277 2866 1 7 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.183 0.907 25277 2867 1 7 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.261 0.879 25277 2868 1 7 . 1 1 62 62 ILE H H 62 8.970 8.970 8.493 0.477 25277 2869 1 7 . 1 1 63 63 SER N N 63 119.430 119.430 121.612 -2.182 25277 2870 1 7 . 1 1 63 63 SER HA H 63 4.680 4.680 4.544 0.136 25277 2871 1 7 . 1 1 63 63 SER C C 63 174.030 174.030 174.543 -0.513 25277 2872 1 7 . 1 1 63 63 SER CA C 63 56.550 56.550 56.848 -0.298 25277 2873 1 7 . 1 1 63 63 SER CB C 63 67.320 67.320 66.133 1.187 25277 2874 1 7 . 1 1 63 63 SER H H 63 8.520 8.520 8.006 0.514 25277 2875 1 7 . 1 1 64 64 GLU N N 64 121.250 121.250 120.054 1.196 25277 2876 1 7 . 1 1 64 64 GLU HA H 64 2.770 2.770 2.948 -0.178 25277 2877 1 7 . 1 1 64 64 GLU C C 64 177.190 177.190 177.935 -0.745 25277 2878 1 7 . 1 1 64 64 GLU CA C 64 58.590 58.590 58.946 -0.356 25277 2879 1 7 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.599 -0.459 25277 2880 1 7 . 1 1 64 64 GLU H H 64 7.400 7.400 7.685 -0.285 25277 2881 1 7 . 1 1 65 65 ALA N N 65 119.250 119.250 122.241 -2.991 25277 2882 1 7 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.929 -0.069 25277 2883 1 7 . 1 1 65 65 ALA C C 65 179.630 179.630 179.520 0.110 25277 2884 1 7 . 1 1 65 65 ALA CA C 65 53.810 53.810 54.767 -0.957 25277 2885 1 7 . 1 1 65 65 ALA CB C 65 18.400 18.400 18.004 0.396 25277 2886 1 7 . 1 1 65 65 ALA H H 65 7.700 7.700 8.307 -0.607 25277 2887 1 7 . 1 1 66 66 ASN N N 66 112.360 112.360 116.354 -3.994 25277 2888 1 7 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.466 0.564 25277 2889 1 7 . 1 1 66 66 ASN C C 66 174.580 174.580 177.408 -2.828 25277 2890 1 7 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.701 -0.151 25277 2891 1 7 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.468 1.462 25277 2892 1 7 . 1 1 66 66 ASN H H 66 7.960 7.960 7.474 0.486 25277 2893 1 7 . 1 1 67 67 LEU N N 67 115.390 115.390 118.669 -3.279 25277 2894 1 7 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.213 0.437 25277 2895 1 7 . 1 1 67 67 LEU C C 67 176.500 176.500 177.041 -0.541 25277 2896 1 7 . 1 1 67 67 LEU CA C 67 54.350 54.350 56.245 -1.895 25277 2897 1 7 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.090 2.580 25277 2898 1 7 . 1 1 67 67 LEU H H 67 7.050 7.050 7.593 -0.543 25277 2899 1 7 . 1 1 68 68 ALA N N 68 125.680 125.680 120.724 4.956 25277 2900 1 7 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.892 -0.002 25277 2901 1 7 . 1 1 68 68 ALA C C 68 177.480 177.480 178.064 -0.584 25277 2902 1 7 . 1 1 68 68 ALA CA C 68 53.550 53.550 53.645 -0.095 25277 2903 1 7 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.190 -0.040 25277 2904 1 7 . 1 1 68 68 ALA H H 68 8.880 8.880 8.074 0.806 25277 2905 1 7 . 1 1 69 69 TYR N N 69 119.780 119.780 122.192 -2.412 25277 2906 1 7 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.286 0.204 25277 2907 1 7 . 1 1 69 69 TYR C C 69 175.340 175.340 176.766 -1.426 25277 2908 1 7 . 1 1 69 69 TYR CA C 69 58.640 58.640 60.845 -2.205 25277 2909 1 7 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.342 -1.062 25277 2910 1 7 . 1 1 69 69 TYR H H 69 7.420 7.420 8.668 -1.248 25277 2911 1 7 . 1 1 70 70 LEU N N 70 118.820 118.820 117.268 1.552 25277 2912 1 7 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.123 0.167 25277 2913 1 7 . 1 1 70 70 LEU C C 70 176.770 176.770 177.658 -0.888 25277 2914 1 7 . 1 1 70 70 LEU CA C 70 53.880 53.880 56.348 -2.468 25277 2915 1 7 . 1 1 70 70 LEU CB C 70 41.300 41.300 41.521 -0.221 25277 2916 1 7 . 1 1 70 70 LEU H H 70 7.690 7.690 7.574 0.116 25277 2917 1 7 . 1 1 71 71 TRP N N 71 124.110 124.110 122.392 1.718 25277 2918 1 7 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.483 0.107 25277 2919 1 7 . 1 1 71 71 TRP CA C 71 54.150 54.150 56.201 -2.051 25277 2920 1 7 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.213 -0.003 25277 2921 1 7 . 1 1 71 71 TRP H H 71 8.130 8.130 7.659 0.471 25277 2922 1 7 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.281 0.299 25277 2923 1 7 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.105 0.485 25277 2924 1 7 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.718 -1.658 25277 2925 1 7 . 1 1 73 73 LEU N N 73 118.760 118.760 117.637 1.123 25277 2926 1 7 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.570 0.830 25277 2927 1 7 . 1 1 73 73 LEU C C 73 176.620 176.620 178.219 -1.599 25277 2928 1 7 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.531 -0.481 25277 2929 1 7 . 1 1 73 73 LEU CB C 73 44.260 44.260 42.852 1.408 25277 2930 1 7 . 1 1 73 73 LEU H H 73 5.190 5.190 6.547 -1.357 25277 2931 1 7 . 1 1 74 74 THR N N 74 110.120 110.120 114.682 -4.562 25277 2932 1 7 . 1 1 74 74 THR HA H 74 4.250 4.250 4.173 0.077 25277 2933 1 7 . 1 1 74 74 THR C C 74 176.080 176.080 175.622 0.458 25277 2934 1 7 . 1 1 74 74 THR CA C 74 62.690 62.690 64.148 -1.458 25277 2935 1 7 . 1 1 74 74 THR CB C 74 67.930 67.930 69.188 -1.258 25277 2936 1 7 . 1 1 74 74 THR H H 74 9.010 9.010 8.560 0.450 25277 2937 1 7 . 1 1 75 75 VAL N N 75 113.030 113.030 119.590 -6.560 25277 2938 1 7 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.176 0.634 25277 2939 1 7 . 1 1 75 75 VAL C C 75 176.010 176.010 177.192 -1.182 25277 2940 1 7 . 1 1 75 75 VAL CA C 75 59.100 59.100 61.637 -2.537 25277 2941 1 7 . 1 1 75 75 VAL CB C 75 33.220 33.220 32.724 0.496 25277 2942 1 7 . 1 1 75 75 VAL H H 75 6.660 6.660 7.715 -1.055 25277 2943 1 7 . 1 1 76 76 ASP N N 76 119.590 119.590 121.688 -2.098 25277 2944 1 7 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.634 -0.144 25277 2945 1 7 . 1 1 76 76 ASP C C 76 175.060 175.060 176.282 -1.222 25277 2946 1 7 . 1 1 76 76 ASP CA C 76 55.110 55.110 56.636 -1.526 25277 2947 1 7 . 1 1 76 76 ASP CB C 76 41.300 41.300 40.917 0.383 25277 2948 1 7 . 1 1 76 76 ASP H H 76 8.770 8.770 9.006 -0.236 25277 2949 1 7 . 1 1 77 77 HIS N N 77 113.300 113.300 113.716 -0.416 25277 2950 1 7 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.758 0.332 25277 2951 1 7 . 1 1 77 77 HIS C C 77 171.370 171.370 173.746 -2.376 25277 2952 1 7 . 1 1 77 77 HIS CA C 77 55.590 55.590 55.014 0.576 25277 2953 1 7 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.791 -2.601 25277 2954 1 7 . 1 1 77 77 HIS H H 77 7.650 7.650 7.604 0.046 25277 2955 1 7 . 1 1 78 78 GLY N N 78 101.350 101.350 105.291 -3.941 25277 2956 1 7 . 1 1 78 78 GLY C C 78 172.110 172.110 172.402 -0.292 25277 2957 1 7 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.816 -0.006 25277 2958 1 7 . 1 1 78 78 GLY H H 78 8.450 8.450 8.779 -0.329 25277 2959 1 7 . 1 1 79 79 THR N N 79 120.230 120.230 117.001 3.229 25277 2960 1 7 . 1 1 79 79 THR HA H 79 5.110 5.110 4.942 0.168 25277 2961 1 7 . 1 1 79 79 THR C C 79 172.920 172.920 173.832 -0.912 25277 2962 1 7 . 1 1 79 79 THR CA C 79 61.480 61.480 62.028 -0.548 25277 2963 1 7 . 1 1 79 79 THR CB C 79 72.130 72.130 70.776 1.354 25277 2964 1 7 . 1 1 79 79 THR H H 79 8.080 8.080 8.482 -0.402 25277 2965 1 7 . 1 1 80 80 ILE N N 80 119.620 119.620 119.955 -0.335 25277 2966 1 7 . 1 1 80 80 ILE HA H 80 5.140 5.140 4.968 0.172 25277 2967 1 7 . 1 1 80 80 ILE C C 80 174.340 174.340 174.021 0.319 25277 2968 1 7 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.240 0.110 25277 2969 1 7 . 1 1 80 80 ILE CB C 80 39.550 39.550 40.719 -1.169 25277 2970 1 7 . 1 1 80 80 ILE H H 80 8.970 8.970 8.734 0.236 25277 2971 1 7 . 1 1 81 81 GLU N N 81 119.960 119.960 125.106 -5.146 25277 2972 1 7 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.082 -0.082 25277 2973 1 7 . 1 1 81 81 GLU C C 81 176.130 176.130 174.435 1.695 25277 2974 1 7 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.850 -0.290 25277 2975 1 7 . 1 1 81 81 GLU CB C 81 33.390 33.390 34.480 -1.090 25277 2976 1 7 . 1 1 81 81 GLU H H 81 8.350 8.350 8.319 0.031 25277 2977 1 7 . 1 1 82 82 CYS N N 82 123.110 123.110 124.418 -1.308 25277 2978 1 7 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.139 -0.209 25277 2979 1 7 . 1 1 82 82 CYS C C 82 174.430 174.430 175.024 -0.594 25277 2980 1 7 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.091 -4.851 25277 2981 1 7 . 1 1 82 82 CYS CB C 82 43.720 43.720 27.046 16.674 25277 2982 1 7 . 1 1 82 82 CYS H H 82 8.220 8.220 8.357 -0.137 25277 2983 1 7 . 1 1 83 83 LEU N N 83 131.660 131.660 127.437 4.223 25277 2984 1 7 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.672 -0.142 25277 2985 1 7 . 1 1 83 83 LEU CA C 83 53.900 53.900 53.134 0.766 25277 2986 1 7 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.417 -2.217 25277 2987 1 7 . 1 1 83 83 LEU H H 83 8.910 8.910 8.314 0.596 25277 2988 1 7 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.242 0.128 25277 2989 1 7 . 1 1 84 84 PRO CA C 84 63.190 63.190 64.936 -1.746 25277 2990 1 7 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.622 0.308 25277 2991 1 7 . 1 1 85 85 SER N N 85 117.620 117.620 113.319 4.301 25277 2992 1 7 . 1 1 85 85 SER HA H 85 3.870 3.870 4.441 -0.571 25277 2993 1 7 . 1 1 85 85 SER C C 85 174.350 174.350 174.574 -0.224 25277 2994 1 7 . 1 1 85 85 SER CA C 85 58.970 58.970 58.032 0.938 25277 2995 1 7 . 1 1 85 85 SER CB C 85 63.820 63.820 62.671 1.149 25277 2996 1 7 . 1 1 85 85 SER H H 85 7.660 7.660 8.177 -0.517 25277 2997 1 7 . 1 1 86 86 ASP N N 86 117.590 117.590 118.266 -0.676 25277 2998 1 7 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.326 -0.186 25277 2999 1 7 . 1 1 86 86 ASP C C 86 174.480 174.480 174.215 0.265 25277 3000 1 7 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.674 -0.694 25277 3001 1 7 . 1 1 86 86 ASP CB C 86 37.850 37.850 38.622 -0.772 25277 3002 1 7 . 1 1 86 86 ASP H H 86 8.490 8.490 8.145 0.345 25277 3003 1 7 . 1 1 87 87 ASN N N 87 117.160 117.160 117.264 -0.104 25277 3004 1 7 . 1 1 87 87 ASN HA H 87 4.530 4.530 5.041 -0.511 25277 3005 1 7 . 1 1 87 87 ASN CA C 87 52.480 52.480 52.068 0.412 25277 3006 1 7 . 1 1 87 87 ASN CB C 87 40.040 40.040 40.843 -0.803 25277 3007 1 7 . 1 1 87 87 ASN H H 87 7.260 7.260 7.642 -0.382 25277 3008 1 7 . 1 1 88 88 ALA HA H 88 4.730 4.730 4.787 -0.057 25277 3009 1 7 . 1 1 88 88 ALA C C 88 174.620 174.620 176.280 -1.660 25277 3010 1 7 . 1 1 88 88 ALA CA C 88 51.230 51.230 50.790 0.440 25277 3011 1 7 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.174 0.366 25277 3012 1 7 . 1 1 89 89 VAL N N 89 116.580 116.580 117.027 -0.447 25277 3013 1 7 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.065 0.035 25277 3014 1 7 . 1 1 89 89 VAL C C 89 172.750 172.750 173.568 -0.818 25277 3015 1 7 . 1 1 89 89 VAL CA C 89 58.980 58.980 59.468 -0.488 25277 3016 1 7 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.522 0.699 25277 3017 1 7 . 1 1 89 89 VAL H H 89 8.740 8.740 8.307 0.433 25277 3018 1 7 . 1 1 90 90 PHE N N 90 120.300 120.300 123.978 -3.678 25277 3019 1 7 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.104 0.046 25277 3020 1 7 . 1 1 90 90 PHE C C 90 172.910 172.910 173.594 -0.684 25277 3021 1 7 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.625 0.175 25277 3022 1 7 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.477 1.173 25277 3023 1 7 . 1 1 90 90 PHE H H 90 8.950 8.950 9.073 -0.123 25277 3024 1 7 . 1 1 91 91 VAL N N 91 129.020 129.020 128.075 0.945 25277 3025 1 7 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.706 -0.246 25277 3026 1 7 . 1 1 91 91 VAL C C 91 175.910 175.910 174.141 1.769 25277 3027 1 7 . 1 1 91 91 VAL CA C 91 60.780 60.780 59.524 1.256 25277 3028 1 7 . 1 1 91 91 VAL CB C 91 32.020 32.020 33.348 -1.328 25277 3029 1 7 . 1 1 91 91 VAL H H 91 9.090 9.090 8.667 0.423 25277 3030 1 7 . 1 1 92 92 ALA N N 92 129.760 129.760 130.012 -0.252 25277 3031 1 7 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.749 -0.249 25277 3032 1 7 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.708 2.142 25277 3033 1 7 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.628 -1.579 25277 3034 1 7 . 1 1 92 92 ALA H H 92 8.680 8.680 8.473 0.207 25277 3035 1 7 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.095 0.065 25277 3036 1 7 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.038 0.362 25277 3037 1 7 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.623 0.317 25277 3038 1 7 . 1 1 94 94 ASP N N 94 113.220 113.220 114.911 -1.691 25277 3039 1 7 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.472 -0.052 25277 3040 1 7 . 1 1 94 94 ASP C C 94 176.980 176.980 177.478 -0.498 25277 3041 1 7 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.970 -0.440 25277 3042 1 7 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.863 -0.283 25277 3043 1 7 . 1 1 94 94 ASP H H 94 7.890 7.890 7.806 0.084 25277 3044 1 7 . 1 1 95 95 GLY N N 95 109.120 109.120 108.312 0.808 25277 3045 1 7 . 1 1 95 95 GLY C C 95 174.440 174.440 174.353 0.087 25277 3046 1 7 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.146 -0.586 25277 3047 1 7 . 1 1 95 95 GLY H H 95 8.500 8.500 8.171 0.329 25277 3048 1 7 . 1 1 96 96 THR N N 96 120.350 120.350 118.611 1.739 25277 3049 1 7 . 1 1 96 96 THR HA H 96 3.780 3.780 4.450 -0.670 25277 3050 1 7 . 1 1 96 96 THR C C 96 172.590 172.590 173.287 -0.697 25277 3051 1 7 . 1 1 96 96 THR CA C 96 64.660 64.660 61.989 2.671 25277 3052 1 7 . 1 1 96 96 THR CB C 96 68.330 68.330 70.052 -1.722 25277 3053 1 7 . 1 1 96 96 THR H H 96 8.100 8.100 8.454 -0.354 25277 3054 1 7 . 1 1 97 97 THR N N 97 122.660 122.660 121.568 1.092 25277 3055 1 7 . 1 1 97 97 THR HA H 97 4.590 4.590 4.739 -0.149 25277 3056 1 7 . 1 1 97 97 THR C C 97 173.000 173.000 173.754 -0.754 25277 3057 1 7 . 1 1 97 97 THR CA C 97 62.700 62.700 62.342 0.358 25277 3058 1 7 . 1 1 97 97 THR CB C 97 68.840 68.840 69.904 -1.064 25277 3059 1 7 . 1 1 97 97 THR H H 97 7.850 7.850 8.442 -0.592 25277 3060 1 7 . 1 1 98 98 TYR N N 98 122.890 122.890 125.889 -2.999 25277 3061 1 7 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.286 -0.346 25277 3062 1 7 . 1 1 98 98 TYR C C 98 178.970 178.970 174.692 4.278 25277 3063 1 7 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.142 0.368 25277 3064 1 7 . 1 1 98 98 TYR CB C 98 42.950 42.950 42.074 0.876 25277 3065 1 7 . 1 1 98 98 TYR H H 98 9.460 9.460 9.301 0.159 25277 3066 1 7 . 1 1 99 99 ALA N N 99 121.760 121.760 123.839 -2.079 25277 3067 1 7 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.621 -0.511 25277 3068 1 7 . 1 1 99 99 ALA C C 99 178.010 178.010 176.578 1.432 25277 3069 1 7 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.157 1.113 25277 3070 1 7 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.613 2.437 25277 3071 1 7 . 1 1 99 99 ALA H H 99 9.110 9.110 8.895 0.215 25277 3072 1 7 . 1 1 100 100 LEU N N 100 119.330 119.330 124.897 -5.567 25277 3073 1 7 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.224 0.246 25277 3074 1 7 . 1 1 100 100 LEU C C 100 174.720 174.720 177.323 -2.603 25277 3075 1 7 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.604 -2.464 25277 3076 1 7 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.643 1.987 25277 3077 1 7 . 1 1 100 100 LEU H H 100 8.950 8.950 8.298 0.652 25277 3078 1 7 . 1 1 101 101 ASN N N 101 112.600 112.600 116.018 -3.418 25277 3079 1 7 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.827 0.093 25277 3080 1 7 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.384 -1.454 25277 3081 1 7 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.600 1.000 25277 3082 1 7 . 1 1 101 101 ASN H H 101 7.550 7.550 7.547 0.003 25277 3083 1 7 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.335 -0.145 25277 3084 1 7 . 1 1 102 102 ASP C C 102 178.770 178.770 178.054 0.716 25277 3085 1 7 . 1 1 102 102 ASP CA C 102 56.880 56.880 57.461 -0.581 25277 3086 1 7 . 1 1 102 102 ASP CB C 102 39.980 39.980 40.791 -0.811 25277 3087 1 7 . 1 1 103 103 ARG N N 103 119.370 119.370 120.414 -1.044 25277 3088 1 7 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.085 -0.255 25277 3089 1 7 . 1 1 103 103 ARG C C 103 178.550 178.550 178.370 0.180 25277 3090 1 7 . 1 1 103 103 ARG CA C 103 59.380 59.380 58.924 0.456 25277 3091 1 7 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.911 -0.411 25277 3092 1 7 . 1 1 103 103 ARG H H 103 7.970 7.970 7.859 0.111 25277 3093 1 7 . 1 1 104 104 ALA N N 104 120.110 120.110 122.185 -2.075 25277 3094 1 7 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.071 0.139 25277 3095 1 7 . 1 1 104 104 ALA C C 104 179.510 179.510 179.430 0.080 25277 3096 1 7 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.252 -0.502 25277 3097 1 7 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.336 1.334 25277 3098 1 7 . 1 1 104 104 ALA H H 104 7.610 7.610 8.514 -0.904 25277 3099 1 7 . 1 1 105 105 GLU N N 105 120.460 120.460 118.635 1.825 25277 3100 1 7 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.273 0.437 25277 3101 1 7 . 1 1 105 105 GLU C C 105 181.710 181.710 179.732 1.978 25277 3102 1 7 . 1 1 105 105 GLU CA C 105 58.680 58.680 58.658 0.021 25277 3103 1 7 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.596 -0.106 25277 3104 1 7 . 1 1 105 105 GLU H H 105 7.750 7.750 7.812 -0.062 25277 3105 1 7 . 1 1 106 106 LYS N N 106 121.980 121.980 120.756 1.224 25277 3106 1 7 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.090 -0.070 25277 3107 1 7 . 1 1 106 106 LYS C C 106 177.890 177.890 178.012 -0.122 25277 3108 1 7 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.428 0.042 25277 3109 1 7 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.216 -0.486 25277 3110 1 7 . 1 1 106 106 LYS H H 106 8.380 8.380 7.985 0.395 25277 3111 1 7 . 1 1 107 107 ALA N N 107 119.850 119.850 118.861 0.989 25277 3112 1 7 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.354 -0.094 25277 3113 1 7 . 1 1 107 107 ALA C C 107 177.210 177.210 177.723 -0.513 25277 3114 1 7 . 1 1 107 107 ALA CA C 107 52.270 52.270 52.109 0.161 25277 3115 1 7 . 1 1 107 107 ALA CB C 107 18.740 18.740 18.913 -0.173 25277 3116 1 7 . 1 1 107 107 ALA H H 107 7.400 7.400 7.641 -0.241 25277 3117 1 7 . 1 1 108 108 GLY N N 108 104.560 104.560 106.079 -1.519 25277 3118 1 7 . 1 1 108 108 GLY C C 108 174.300 174.300 174.475 -0.175 25277 3119 1 7 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.024 -0.414 25277 3120 1 7 . 1 1 108 108 GLY H H 108 7.560 7.560 7.845 -0.285 25277 3121 1 7 . 1 1 109 109 HIS N N 109 122.550 122.550 120.785 1.765 25277 3122 1 7 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.904 -0.134 25277 3123 1 7 . 1 1 109 109 HIS CA C 109 54.580 54.580 54.830 -0.250 25277 3124 1 7 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.896 -1.306 25277 3125 1 7 . 1 1 109 109 HIS H H 109 7.590 7.590 7.734 -0.144 25277 3126 1 7 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.692 -0.132 25277 3127 1 7 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.093 0.638 25277 3128 1 7 . 1 1 111 111 PRO CB C 111 32.800 32.800 33.107 -0.307 25277 3129 1 7 . 1 1 112 112 ILE N N 112 119.770 119.770 119.659 0.111 25277 3130 1 7 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.365 0.495 25277 3131 1 7 . 1 1 112 112 ILE C C 112 172.800 172.800 177.421 -4.621 25277 3132 1 7 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.175 -1.985 25277 3133 1 7 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.227 3.213 25277 3134 1 7 . 1 1 112 112 ILE H H 112 7.890 7.890 8.556 -0.666 25277 3135 1 7 . 1 1 113 113 THR N N 113 113.610 113.610 116.372 -2.762 25277 3136 1 7 . 1 1 113 113 THR HA H 113 3.010 3.010 3.961 -0.951 25277 3137 1 7 . 1 1 113 113 THR CA C 113 66.860 66.860 67.935 -1.075 25277 3138 1 7 . 1 1 113 113 THR CB C 113 66.920 66.920 67.317 -0.397 25277 3139 1 7 . 1 1 113 113 THR H H 113 7.070 7.070 8.535 -1.465 25277 3140 1 7 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.326 0.014 25277 3141 1 7 . 1 1 114 114 PRO CA C 114 66.080 66.080 65.140 0.940 25277 3142 1 7 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.469 0.611 25277 3143 1 7 . 1 1 115 115 ILE N N 115 134.770 134.770 109.946 24.824 25277 3144 1 7 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.431 0.179 25277 3145 1 7 . 1 1 115 115 ILE C C 115 174.800 174.800 174.757 0.043 25277 3146 1 7 . 1 1 115 115 ILE CA C 115 60.000 60.000 59.768 0.232 25277 3147 1 7 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.616 0.244 25277 3148 1 7 . 1 1 115 115 ILE H H 115 7.510 7.510 7.521 -0.011 25277 3149 1 7 . 1 1 116 116 ARG N N 116 120.890 120.890 122.244 -1.354 25277 3150 1 7 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.146 -0.176 25277 3151 1 7 . 1 1 116 116 ARG C C 116 174.910 174.910 175.630 -0.720 25277 3152 1 7 . 1 1 116 116 ARG CA C 116 57.780 57.780 55.880 1.899 25277 3153 1 7 . 1 1 116 116 ARG CB C 116 31.870 31.870 31.433 0.437 25277 3154 1 7 . 1 1 116 116 ARG H H 116 7.280 7.280 7.544 -0.264 25277 3155 1 7 . 1 1 117 117 ALA N N 117 125.400 125.400 128.132 -2.732 25277 3156 1 7 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.396 -0.166 25277 3157 1 7 . 1 1 117 117 ALA C C 117 176.290 176.290 175.889 0.401 25277 3158 1 7 . 1 1 117 117 ALA CA C 117 50.780 50.780 51.062 -0.282 25277 3159 1 7 . 1 1 117 117 ALA CB C 117 20.290 20.290 20.513 -0.223 25277 3160 1 7 . 1 1 117 117 ALA H H 117 8.150 8.150 8.408 -0.258 25277 3161 1 7 . 1 1 118 118 LYS N N 118 119.890 119.890 122.540 -2.650 25277 3162 1 7 . 1 1 118 118 LYS HA H 118 4.590 4.590 3.873 0.717 25277 3163 1 7 . 1 1 118 118 LYS C C 118 177.400 177.400 175.828 1.572 25277 3164 1 7 . 1 1 118 118 LYS CA C 118 55.670 55.670 54.506 1.164 25277 3165 1 7 . 1 1 118 118 LYS CB C 118 34.510 34.510 33.010 1.500 25277 3166 1 7 . 1 1 118 118 LYS H H 118 8.360 8.360 8.170 0.190 25277 3167 1 7 . 1 1 119 119 GLY N N 119 108.630 108.630 111.655 -3.025 25277 3168 1 7 . 1 1 119 119 GLY CA C 119 43.610 43.610 43.180 0.430 25277 3169 1 7 . 1 1 119 119 GLY H H 119 8.320 8.320 7.835 0.485 25277 3170 1 7 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.710 0.190 25277 3171 1 7 . 1 1 124 124 TYR C C 124 177.430 177.430 176.279 1.151 25277 3172 1 7 . 1 1 124 124 TYR CA C 124 57.970 57.970 57.098 0.872 25277 3173 1 7 . 1 1 124 124 TYR CB C 124 38.650 38.650 40.751 -2.100 25277 3174 1 7 . 1 1 125 125 ILE N N 125 123.670 123.670 122.544 1.126 25277 3175 1 7 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.150 -0.310 25277 3176 1 7 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.417 0.313 25277 3177 1 7 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.493 0.017 25277 3178 1 7 . 1 1 125 125 ILE H H 125 8.340 8.340 8.275 0.065 25277 3179 1 7 . 1 1 126 126 SER HA H 126 4.070 4.070 4.280 -0.210 25277 3180 1 7 . 1 1 126 126 SER C C 126 176.290 176.290 174.771 1.519 25277 3181 1 7 . 1 1 126 126 SER CA C 126 59.190 59.190 59.598 -0.408 25277 3182 1 7 . 1 1 126 126 SER CB C 126 63.200 63.200 63.611 -0.411 25277 3183 1 7 . 1 1 127 127 LEU N N 127 127.030 127.030 124.097 2.933 25277 3184 1 7 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.307 -0.367 25277 3185 1 7 . 1 1 127 127 LEU C C 127 176.660 176.660 178.322 -1.662 25277 3186 1 7 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.664 0.446 25277 3187 1 7 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.781 1.149 25277 3188 1 7 . 1 1 127 127 LEU H H 127 8.790 8.790 8.294 0.496 25277 3189 1 7 . 1 1 128 128 GLY N N 128 106.600 106.600 108.835 -2.235 25277 3190 1 7 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.626 0.904 25277 3191 1 7 . 1 1 128 128 GLY H H 128 8.450 8.450 8.307 0.143 25277 3192 1 7 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.116 0.114 25277 3193 1 7 . 1 1 129 129 ALA C C 129 180.410 180.410 179.398 1.012 25277 3194 1 7 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.615 0.305 25277 3195 1 7 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.272 0.858 25277 3196 1 7 . 1 1 130 130 LEU N N 130 122.550 122.550 120.610 1.940 25277 3197 1 7 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.045 -0.125 25277 3198 1 7 . 1 1 130 130 LEU C C 130 179.020 179.020 178.494 0.526 25277 3199 1 7 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.372 0.258 25277 3200 1 7 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.616 0.524 25277 3201 1 7 . 1 1 130 130 LEU H H 130 8.040 8.040 7.438 0.602 25277 3202 1 7 . 1 1 131 131 LEU N N 131 121.910 121.910 119.551 2.359 25277 3203 1 7 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.889 0.031 25277 3204 1 7 . 1 1 131 131 LEU C C 131 177.910 177.910 178.249 -0.339 25277 3205 1 7 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.121 0.449 25277 3206 1 7 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.387 -0.667 25277 3207 1 7 . 1 1 131 131 LEU H H 131 9.060 9.060 7.772 1.288 25277 3208 1 7 . 1 1 132 132 SER N N 132 115.530 115.530 113.845 1.685 25277 3209 1 7 . 1 1 132 132 SER HA H 132 3.970 3.970 4.067 -0.097 25277 3210 1 7 . 1 1 132 132 SER C C 132 177.140 177.140 176.747 0.393 25277 3211 1 7 . 1 1 132 132 SER CA C 132 62.340 62.340 62.197 0.143 25277 3212 1 7 . 1 1 132 132 SER CB C 132 62.370 62.370 62.821 -0.451 25277 3213 1 7 . 1 1 132 132 SER H H 132 8.730 8.730 8.125 0.605 25277 3214 1 7 . 1 1 133 133 THR N N 133 116.960 116.960 118.433 -1.473 25277 3215 1 7 . 1 1 133 133 THR HA H 133 3.860 3.860 4.047 -0.187 25277 3216 1 7 . 1 1 133 133 THR C C 133 175.670 175.670 176.539 -0.869 25277 3217 1 7 . 1 1 133 133 THR CA C 133 66.930 66.930 67.197 -0.267 25277 3218 1 7 . 1 1 133 133 THR CB C 133 68.880 68.880 68.623 0.257 25277 3219 1 7 . 1 1 133 133 THR H H 133 7.750 7.750 7.867 -0.117 25277 3220 1 7 . 1 1 134 134 THR N N 134 118.830 118.830 119.221 -0.391 25277 3221 1 7 . 1 1 134 134 THR HA H 134 3.780 3.780 4.063 -0.283 25277 3222 1 7 . 1 1 134 134 THR C C 134 176.750 176.750 176.234 0.516 25277 3223 1 7 . 1 1 134 134 THR CA C 134 67.650 67.650 67.362 0.288 25277 3224 1 7 . 1 1 134 134 THR CB C 134 67.560 67.560 68.443 -0.883 25277 3225 1 7 . 1 1 134 134 THR H H 134 7.570 7.570 7.664 -0.094 25277 3226 1 7 . 1 1 135 135 LEU N N 135 121.420 121.420 121.716 -0.296 25277 3227 1 7 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.933 0.557 25277 3228 1 7 . 1 1 135 135 LEU C C 135 180.050 180.050 178.892 1.158 25277 3229 1 7 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.192 -1.182 25277 3230 1 7 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.392 -0.782 25277 3231 1 7 . 1 1 135 135 LEU H H 135 8.650 8.650 8.257 0.393 25277 3232 1 7 . 1 1 136 136 ASN N N 136 117.010 117.010 117.450 -0.440 25277 3233 1 7 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.440 0.100 25277 3234 1 7 . 1 1 136 136 ASN C C 136 175.980 175.980 177.605 -1.625 25277 3235 1 7 . 1 1 136 136 ASN CA C 136 54.770 54.770 56.069 -1.300 25277 3236 1 7 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.689 -0.249 25277 3237 1 7 . 1 1 136 136 ASN H H 136 7.360 7.360 7.800 -0.440 25277 3238 1 7 . 1 1 137 137 LEU N N 137 116.940 116.940 119.300 -2.360 25277 3239 1 7 . 1 1 137 137 LEU HA H 137 4.160 4.160 3.989 0.171 25277 3240 1 7 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.519 -2.089 25277 3241 1 7 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.794 -0.224 25277 3242 1 7 . 1 1 137 137 LEU H H 137 7.810 7.810 7.555 0.255 25277 3243 1 7 . 1 1 138 138 CYS N N 138 115.430 115.430 114.508 0.922 25277 3244 1 7 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.260 0.150 25277 3245 1 7 . 1 1 138 138 CYS CA C 138 55.480 55.480 60.573 -5.093 25277 3246 1 7 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.594 14.606 25277 3247 1 7 . 1 1 138 138 CYS H H 138 7.450 7.450 7.832 -0.382 25277 3248 1 7 . 1 1 139 139 GLY C C 139 178.800 178.800 174.260 4.540 25277 3249 1 7 . 1 1 139 139 GLY CA C 139 45.500 45.500 45.111 0.389 25277 3250 1 7 . 1 1 140 140 LYS N N 140 119.830 119.830 121.873 -2.043 25277 3251 1 7 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.764 -0.444 25277 3252 1 7 . 1 1 140 140 LYS C C 140 175.820 175.820 175.702 0.118 25277 3253 1 7 . 1 1 140 140 LYS CA C 140 55.680 55.680 54.909 0.771 25277 3254 1 7 . 1 1 140 140 LYS CB C 140 32.800 32.800 33.547 -0.747 25277 3255 1 7 . 1 1 140 140 LYS H H 140 7.760 7.760 7.604 0.156 25277 3256 1 8 . 1 1 27 27 PRO CA C 27 63.230 63.230 62.259 0.971 25277 3257 1 8 . 1 1 27 27 PRO CB C 27 32.050 32.050 32.314 -0.264 25277 3258 1 8 . 1 1 28 28 ASP N N 28 120.030 120.030 119.468 0.562 25277 3259 1 8 . 1 1 28 28 ASP C C 28 176.130 176.130 175.462 0.668 25277 3260 1 8 . 1 1 28 28 ASP CA C 28 54.170 54.170 54.181 -0.011 25277 3261 1 8 . 1 1 28 28 ASP CB C 28 40.860 40.860 41.553 -0.693 25277 3262 1 8 . 1 1 28 28 ASP H H 28 8.260 8.260 8.298 -0.038 25277 3263 1 8 . 1 1 29 29 LEU N N 29 123.030 123.030 122.833 0.197 25277 3264 1 8 . 1 1 29 29 LEU C C 29 177.870 177.870 176.991 0.879 25277 3265 1 8 . 1 1 29 29 LEU CA C 29 55.160 55.160 54.703 0.457 25277 3266 1 8 . 1 1 29 29 LEU CB C 29 42.270 42.270 43.045 -0.775 25277 3267 1 8 . 1 1 29 29 LEU H H 29 8.120 8.120 8.235 -0.115 25277 3268 1 8 . 1 1 30 30 GLY N N 30 109.350 109.350 113.272 -3.922 25277 3269 1 8 . 1 1 30 30 GLY CA C 30 45.340 45.340 44.326 1.014 25277 3270 1 8 . 1 1 30 30 GLY H H 30 8.410 8.410 8.328 0.082 25277 3271 1 8 . 1 1 44 44 PRO CA C 44 63.590 63.590 62.106 1.484 25277 3272 1 8 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.123 -0.133 25277 3273 1 8 . 1 1 45 45 ALA N N 45 122.140 122.140 121.603 0.537 25277 3274 1 8 . 1 1 45 45 ALA CA C 45 52.670 52.670 52.811 -0.141 25277 3275 1 8 . 1 1 45 45 ALA H H 45 8.350 8.350 7.974 0.376 25277 3276 1 8 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.235 0.065 25277 3277 1 8 . 1 1 49 49 PRO CA C 49 62.950 62.950 63.106 -0.156 25277 3278 1 8 . 1 1 49 49 PRO CB C 49 31.990 31.990 32.200 -0.211 25277 3279 1 8 . 1 1 50 50 VAL N N 50 124.190 124.190 123.948 0.242 25277 3280 1 8 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.337 -0.017 25277 3281 1 8 . 1 1 50 50 VAL CA C 50 59.850 59.850 59.676 0.174 25277 3282 1 8 . 1 1 50 50 VAL CB C 50 32.480 32.480 31.965 0.515 25277 3283 1 8 . 1 1 50 50 VAL H H 50 8.070 8.070 8.158 -0.088 25277 3284 1 8 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.311 0.039 25277 3285 1 8 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.162 -0.232 25277 3286 1 8 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.240 -0.260 25277 3287 1 8 . 1 1 52 52 LEU N N 52 124.500 124.500 121.356 3.144 25277 3288 1 8 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.282 0.208 25277 3289 1 8 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.804 -0.915 25277 3290 1 8 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.782 0.408 25277 3291 1 8 . 1 1 52 52 LEU H H 52 8.360 8.360 8.220 0.140 25277 3292 1 8 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.594 -0.184 25277 3293 1 8 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.245 0.085 25277 3294 1 8 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.325 -0.335 25277 3295 1 8 . 1 1 54 54 SER N N 54 117.380 117.380 117.183 0.197 25277 3296 1 8 . 1 1 54 54 SER HA H 54 4.600 4.600 4.395 0.205 25277 3297 1 8 . 1 1 54 54 SER CA C 54 56.710 56.710 57.509 -0.799 25277 3298 1 8 . 1 1 54 54 SER CB C 54 62.500 62.500 63.020 -0.520 25277 3299 1 8 . 1 1 54 54 SER H H 54 8.400 8.400 8.295 0.105 25277 3300 1 8 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.643 -0.093 25277 3301 1 8 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.443 0.097 25277 3302 1 8 . 1 1 55 55 PRO CB C 55 32.620 32.620 32.267 0.353 25277 3303 1 8 . 1 1 57 57 SER HA H 57 4.420 4.420 4.215 0.205 25277 3304 1 8 . 1 1 57 57 SER CA C 57 57.580 57.580 59.910 -2.329 25277 3305 1 8 . 1 1 57 57 SER CB C 57 63.780 63.780 63.298 0.482 25277 3306 1 8 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.341 0.649 25277 3307 1 8 . 1 1 58 58 ASN C C 58 172.230 172.230 173.886 -1.656 25277 3308 1 8 . 1 1 58 58 ASN CA C 58 53.670 53.670 55.084 -1.414 25277 3309 1 8 . 1 1 58 58 ASN CB C 58 37.850 37.850 38.200 -0.350 25277 3310 1 8 . 1 1 59 59 LYS N N 59 117.660 117.660 116.646 1.014 25277 3311 1 8 . 1 1 59 59 LYS HA H 59 5.360 5.360 5.057 0.303 25277 3312 1 8 . 1 1 59 59 LYS C C 59 175.120 175.120 174.277 0.843 25277 3313 1 8 . 1 1 59 59 LYS CA C 59 54.860 54.860 55.576 -0.716 25277 3314 1 8 . 1 1 59 59 LYS CB C 59 36.450 36.450 37.287 -0.837 25277 3315 1 8 . 1 1 59 59 LYS H H 59 7.640 7.640 7.791 -0.151 25277 3316 1 8 . 1 1 60 60 GLN N N 60 120.680 120.680 119.160 1.520 25277 3317 1 8 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.629 -0.139 25277 3318 1 8 . 1 1 60 60 GLN C C 60 173.640 173.640 173.248 0.392 25277 3319 1 8 . 1 1 60 60 GLN CA C 60 55.480 55.480 54.797 0.683 25277 3320 1 8 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.177 -0.187 25277 3321 1 8 . 1 1 60 60 GLN H H 60 8.930 8.930 8.399 0.531 25277 3322 1 8 . 1 1 61 61 ASP N N 61 126.170 126.170 121.666 4.504 25277 3323 1 8 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.834 0.216 25277 3324 1 8 . 1 1 61 61 ASP C C 61 175.000 175.000 175.200 -0.200 25277 3325 1 8 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.330 0.550 25277 3326 1 8 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.510 -0.739 25277 3327 1 8 . 1 1 61 61 ASP H H 61 8.540 8.540 8.569 -0.029 25277 3328 1 8 . 1 1 62 62 ILE N N 62 121.100 121.100 125.412 -4.312 25277 3329 1 8 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.567 0.213 25277 3330 1 8 . 1 1 62 62 ILE C C 62 171.480 171.480 173.610 -2.130 25277 3331 1 8 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.640 0.450 25277 3332 1 8 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.417 0.723 25277 3333 1 8 . 1 1 62 62 ILE H H 62 8.970 8.970 8.400 0.570 25277 3334 1 8 . 1 1 63 63 SER N N 63 119.430 119.430 121.352 -1.922 25277 3335 1 8 . 1 1 63 63 SER HA H 63 4.680 4.680 4.521 0.159 25277 3336 1 8 . 1 1 63 63 SER C C 63 174.030 174.030 174.392 -0.362 25277 3337 1 8 . 1 1 63 63 SER CA C 63 56.550 56.550 56.513 0.037 25277 3338 1 8 . 1 1 63 63 SER CB C 63 67.320 67.320 66.252 1.068 25277 3339 1 8 . 1 1 63 63 SER H H 63 8.520 8.520 7.980 0.540 25277 3340 1 8 . 1 1 64 64 GLU N N 64 121.250 121.250 120.289 0.961 25277 3341 1 8 . 1 1 64 64 GLU HA H 64 2.770 2.770 2.940 -0.170 25277 3342 1 8 . 1 1 64 64 GLU C C 64 177.190 177.190 177.812 -0.622 25277 3343 1 8 . 1 1 64 64 GLU CA C 64 58.590 58.590 58.871 -0.281 25277 3344 1 8 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.615 -0.475 25277 3345 1 8 . 1 1 64 64 GLU H H 64 7.400 7.400 7.618 -0.218 25277 3346 1 8 . 1 1 65 65 ALA N N 65 119.250 119.250 122.128 -2.878 25277 3347 1 8 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.859 0.001 25277 3348 1 8 . 1 1 65 65 ALA C C 65 179.630 179.630 179.438 0.192 25277 3349 1 8 . 1 1 65 65 ALA CA C 65 53.810 53.810 54.722 -0.912 25277 3350 1 8 . 1 1 65 65 ALA CB C 65 18.400 18.400 17.958 0.442 25277 3351 1 8 . 1 1 65 65 ALA H H 65 7.700 7.700 8.253 -0.553 25277 3352 1 8 . 1 1 66 66 ASN N N 66 112.360 112.360 115.646 -3.286 25277 3353 1 8 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.442 0.588 25277 3354 1 8 . 1 1 66 66 ASN C C 66 174.580 174.580 176.952 -2.372 25277 3355 1 8 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.476 0.074 25277 3356 1 8 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.550 1.380 25277 3357 1 8 . 1 1 66 66 ASN H H 66 7.960 7.960 7.451 0.509 25277 3358 1 8 . 1 1 67 67 LEU N N 67 115.390 115.390 118.569 -3.179 25277 3359 1 8 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.252 0.398 25277 3360 1 8 . 1 1 67 67 LEU C C 67 176.500 176.500 176.666 -0.166 25277 3361 1 8 . 1 1 67 67 LEU CA C 67 54.350 54.350 56.083 -1.733 25277 3362 1 8 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.275 2.395 25277 3363 1 8 . 1 1 67 67 LEU H H 67 7.050 7.050 7.492 -0.442 25277 3364 1 8 . 1 1 68 68 ALA N N 68 125.680 125.680 120.354 5.326 25277 3365 1 8 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.753 0.137 25277 3366 1 8 . 1 1 68 68 ALA C C 68 177.480 177.480 178.242 -0.762 25277 3367 1 8 . 1 1 68 68 ALA CA C 68 53.550 53.550 53.323 0.227 25277 3368 1 8 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.227 -0.077 25277 3369 1 8 . 1 1 68 68 ALA H H 68 8.880 8.880 7.993 0.887 25277 3370 1 8 . 1 1 69 69 TYR N N 69 119.780 119.780 120.011 -0.231 25277 3371 1 8 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.318 0.172 25277 3372 1 8 . 1 1 69 69 TYR C C 69 175.340 175.340 177.301 -1.961 25277 3373 1 8 . 1 1 69 69 TYR CA C 69 58.640 58.640 60.673 -2.033 25277 3374 1 8 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.032 -0.753 25277 3375 1 8 . 1 1 69 69 TYR H H 69 7.420 7.420 8.495 -1.075 25277 3376 1 8 . 1 1 70 70 LEU N N 70 118.820 118.820 116.932 1.888 25277 3377 1 8 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.160 0.130 25277 3378 1 8 . 1 1 70 70 LEU C C 70 176.770 176.770 177.455 -0.685 25277 3379 1 8 . 1 1 70 70 LEU CA C 70 53.880 53.880 55.591 -1.711 25277 3380 1 8 . 1 1 70 70 LEU CB C 70 41.300 41.300 41.786 -0.486 25277 3381 1 8 . 1 1 70 70 LEU H H 70 7.690 7.690 7.461 0.229 25277 3382 1 8 . 1 1 71 71 TRP N N 71 124.110 124.110 122.667 1.443 25277 3383 1 8 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.537 0.053 25277 3384 1 8 . 1 1 71 71 TRP CA C 71 54.150 54.150 56.029 -1.879 25277 3385 1 8 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.455 -0.245 25277 3386 1 8 . 1 1 71 71 TRP H H 71 8.130 8.130 7.691 0.439 25277 3387 1 8 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.383 0.197 25277 3388 1 8 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.182 0.408 25277 3389 1 8 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.745 -1.685 25277 3390 1 8 . 1 1 73 73 LEU N N 73 118.760 118.760 117.727 1.033 25277 3391 1 8 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.630 0.770 25277 3392 1 8 . 1 1 73 73 LEU C C 73 176.620 176.620 178.219 -1.599 25277 3393 1 8 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.537 -0.487 25277 3394 1 8 . 1 1 73 73 LEU CB C 73 44.260 44.260 42.882 1.378 25277 3395 1 8 . 1 1 73 73 LEU H H 73 5.190 5.190 6.564 -1.374 25277 3396 1 8 . 1 1 74 74 THR N N 74 110.120 110.120 114.886 -4.766 25277 3397 1 8 . 1 1 74 74 THR HA H 74 4.250 4.250 4.210 0.040 25277 3398 1 8 . 1 1 74 74 THR C C 74 176.080 176.080 175.731 0.349 25277 3399 1 8 . 1 1 74 74 THR CA C 74 62.690 62.690 64.236 -1.546 25277 3400 1 8 . 1 1 74 74 THR CB C 74 67.930 67.930 69.315 -1.385 25277 3401 1 8 . 1 1 74 74 THR H H 74 9.010 9.010 8.634 0.376 25277 3402 1 8 . 1 1 75 75 VAL N N 75 113.030 113.030 118.466 -5.436 25277 3403 1 8 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.163 0.647 25277 3404 1 8 . 1 1 75 75 VAL C C 75 176.010 176.010 176.911 -0.901 25277 3405 1 8 . 1 1 75 75 VAL CA C 75 59.100 59.100 62.345 -3.245 25277 3406 1 8 . 1 1 75 75 VAL CB C 75 33.220 33.220 32.623 0.597 25277 3407 1 8 . 1 1 75 75 VAL H H 75 6.660 6.660 7.663 -1.003 25277 3408 1 8 . 1 1 76 76 ASP N N 76 119.590 119.590 123.498 -3.908 25277 3409 1 8 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.685 -0.195 25277 3410 1 8 . 1 1 76 76 ASP C C 76 175.060 175.060 176.260 -1.200 25277 3411 1 8 . 1 1 76 76 ASP CA C 76 55.110 55.110 57.043 -1.933 25277 3412 1 8 . 1 1 76 76 ASP CB C 76 41.300 41.300 41.007 0.293 25277 3413 1 8 . 1 1 76 76 ASP H H 76 8.770 8.770 9.082 -0.312 25277 3414 1 8 . 1 1 77 77 HIS N N 77 113.300 113.300 112.024 1.276 25277 3415 1 8 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.697 0.393 25277 3416 1 8 . 1 1 77 77 HIS C C 77 171.370 171.370 173.840 -2.470 25277 3417 1 8 . 1 1 77 77 HIS CA C 77 55.590 55.590 54.534 1.056 25277 3418 1 8 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.578 -2.388 25277 3419 1 8 . 1 1 77 77 HIS H H 77 7.650 7.650 7.663 -0.013 25277 3420 1 8 . 1 1 78 78 GLY N N 78 101.350 101.350 105.304 -3.954 25277 3421 1 8 . 1 1 78 78 GLY C C 78 172.110 172.110 172.382 -0.272 25277 3422 1 8 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.778 0.032 25277 3423 1 8 . 1 1 78 78 GLY H H 78 8.450 8.450 8.689 -0.239 25277 3424 1 8 . 1 1 79 79 THR N N 79 120.230 120.230 116.974 3.256 25277 3425 1 8 . 1 1 79 79 THR HA H 79 5.110 5.110 4.874 0.236 25277 3426 1 8 . 1 1 79 79 THR C C 79 172.920 172.920 173.741 -0.821 25277 3427 1 8 . 1 1 79 79 THR CA C 79 61.480 61.480 62.073 -0.593 25277 3428 1 8 . 1 1 79 79 THR CB C 79 72.130 72.130 70.749 1.381 25277 3429 1 8 . 1 1 79 79 THR H H 79 8.080 8.080 8.465 -0.385 25277 3430 1 8 . 1 1 80 80 ILE N N 80 119.620 119.620 120.696 -1.076 25277 3431 1 8 . 1 1 80 80 ILE HA H 80 5.140 5.140 5.088 0.052 25277 3432 1 8 . 1 1 80 80 ILE C C 80 174.340 174.340 174.157 0.183 25277 3433 1 8 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.330 0.020 25277 3434 1 8 . 1 1 80 80 ILE CB C 80 39.550 39.550 40.230 -0.680 25277 3435 1 8 . 1 1 80 80 ILE H H 80 8.970 8.970 8.667 0.303 25277 3436 1 8 . 1 1 81 81 GLU N N 81 119.960 119.960 123.703 -3.743 25277 3437 1 8 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.092 -0.092 25277 3438 1 8 . 1 1 81 81 GLU C C 81 176.130 176.130 174.840 1.290 25277 3439 1 8 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.888 -0.327 25277 3440 1 8 . 1 1 81 81 GLU CB C 81 33.390 33.390 34.807 -1.417 25277 3441 1 8 . 1 1 81 81 GLU H H 81 8.350 8.350 8.275 0.075 25277 3442 1 8 . 1 1 82 82 CYS N N 82 123.110 123.110 122.154 0.956 25277 3443 1 8 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.127 -0.197 25277 3444 1 8 . 1 1 82 82 CYS C C 82 174.430 174.430 174.993 -0.563 25277 3445 1 8 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.228 -4.988 25277 3446 1 8 . 1 1 82 82 CYS CB C 82 43.720 43.720 27.010 16.710 25277 3447 1 8 . 1 1 82 82 CYS H H 82 8.220 8.220 8.374 -0.154 25277 3448 1 8 . 1 1 83 83 LEU N N 83 131.660 131.660 127.365 4.295 25277 3449 1 8 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.701 -0.171 25277 3450 1 8 . 1 1 83 83 LEU CA C 83 53.900 53.900 53.251 0.650 25277 3451 1 8 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.412 -2.212 25277 3452 1 8 . 1 1 83 83 LEU H H 83 8.910 8.910 8.376 0.534 25277 3453 1 8 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.238 0.132 25277 3454 1 8 . 1 1 84 84 PRO CA C 84 63.190 63.190 65.106 -1.916 25277 3455 1 8 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.671 0.259 25277 3456 1 8 . 1 1 85 85 SER N N 85 117.620 117.620 112.950 4.670 25277 3457 1 8 . 1 1 85 85 SER HA H 85 3.870 3.870 4.398 -0.528 25277 3458 1 8 . 1 1 85 85 SER C C 85 174.350 174.350 174.567 -0.217 25277 3459 1 8 . 1 1 85 85 SER CA C 85 58.970 58.970 58.536 0.434 25277 3460 1 8 . 1 1 85 85 SER CB C 85 63.820 63.820 62.913 0.907 25277 3461 1 8 . 1 1 85 85 SER H H 85 7.660 7.660 8.033 -0.373 25277 3462 1 8 . 1 1 86 86 ASP N N 86 117.590 117.590 119.641 -2.051 25277 3463 1 8 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.357 -0.217 25277 3464 1 8 . 1 1 86 86 ASP C C 86 174.480 174.480 173.844 0.636 25277 3465 1 8 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.505 -0.525 25277 3466 1 8 . 1 1 86 86 ASP CB C 86 37.850 37.850 39.886 -2.036 25277 3467 1 8 . 1 1 86 86 ASP H H 86 8.490 8.490 8.278 0.212 25277 3468 1 8 . 1 1 87 87 ASN N N 87 117.160 117.160 117.471 -0.311 25277 3469 1 8 . 1 1 87 87 ASN HA H 87 4.530 4.530 5.056 -0.526 25277 3470 1 8 . 1 1 87 87 ASN CA C 87 52.480 52.480 51.771 0.709 25277 3471 1 8 . 1 1 87 87 ASN CB C 87 40.040 40.040 41.082 -1.042 25277 3472 1 8 . 1 1 87 87 ASN H H 87 7.260 7.260 7.675 -0.415 25277 3473 1 8 . 1 1 88 88 ALA HA H 88 4.730 4.730 4.806 -0.076 25277 3474 1 8 . 1 1 88 88 ALA C C 88 174.620 174.620 176.305 -1.685 25277 3475 1 8 . 1 1 88 88 ALA CA C 88 51.230 51.230 50.827 0.403 25277 3476 1 8 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.049 0.491 25277 3477 1 8 . 1 1 89 89 VAL N N 89 116.580 116.580 117.404 -0.824 25277 3478 1 8 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.116 -0.016 25277 3479 1 8 . 1 1 89 89 VAL C C 89 172.750 172.750 173.606 -0.856 25277 3480 1 8 . 1 1 89 89 VAL CA C 89 58.980 58.980 59.448 -0.468 25277 3481 1 8 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.555 0.665 25277 3482 1 8 . 1 1 89 89 VAL H H 89 8.740 8.740 8.277 0.463 25277 3483 1 8 . 1 1 90 90 PHE N N 90 120.300 120.300 123.775 -3.475 25277 3484 1 8 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.113 0.037 25277 3485 1 8 . 1 1 90 90 PHE C C 90 172.910 172.910 173.684 -0.774 25277 3486 1 8 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.652 0.148 25277 3487 1 8 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.326 1.324 25277 3488 1 8 . 1 1 90 90 PHE H H 90 8.950 8.950 9.007 -0.057 25277 3489 1 8 . 1 1 91 91 VAL N N 91 129.020 129.020 127.682 1.338 25277 3490 1 8 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.667 -0.207 25277 3491 1 8 . 1 1 91 91 VAL C C 91 175.910 175.910 173.959 1.951 25277 3492 1 8 . 1 1 91 91 VAL CA C 91 60.780 60.780 60.467 0.313 25277 3493 1 8 . 1 1 91 91 VAL CB C 91 32.020 32.020 34.032 -2.012 25277 3494 1 8 . 1 1 91 91 VAL H H 91 9.090 9.090 8.687 0.403 25277 3495 1 8 . 1 1 92 92 ALA N N 92 129.760 129.760 129.416 0.344 25277 3496 1 8 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.738 -0.238 25277 3497 1 8 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.721 2.128 25277 3498 1 8 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.497 -1.447 25277 3499 1 8 . 1 1 92 92 ALA H H 92 8.680 8.680 8.427 0.253 25277 3500 1 8 . 1 1 93 93 PRO HA H 93 4.160 4.160 3.959 0.201 25277 3501 1 8 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.130 0.270 25277 3502 1 8 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.201 0.740 25277 3503 1 8 . 1 1 94 94 ASP N N 94 113.220 113.220 114.745 -1.525 25277 3504 1 8 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.377 0.043 25277 3505 1 8 . 1 1 94 94 ASP C C 94 176.980 176.980 177.547 -0.567 25277 3506 1 8 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.648 -0.118 25277 3507 1 8 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.198 0.382 25277 3508 1 8 . 1 1 94 94 ASP H H 94 7.890 7.890 8.124 -0.234 25277 3509 1 8 . 1 1 95 95 GLY N N 95 109.120 109.120 108.778 0.342 25277 3510 1 8 . 1 1 95 95 GLY C C 95 174.440 174.440 174.423 0.017 25277 3511 1 8 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.180 -0.620 25277 3512 1 8 . 1 1 95 95 GLY H H 95 8.500 8.500 8.050 0.450 25277 3513 1 8 . 1 1 96 96 THR N N 96 120.350 120.350 118.431 1.919 25277 3514 1 8 . 1 1 96 96 THR HA H 96 3.780 3.780 4.435 -0.655 25277 3515 1 8 . 1 1 96 96 THR C C 96 172.590 172.590 173.362 -0.772 25277 3516 1 8 . 1 1 96 96 THR CA C 96 64.660 64.660 61.973 2.687 25277 3517 1 8 . 1 1 96 96 THR CB C 96 68.330 68.330 70.061 -1.732 25277 3518 1 8 . 1 1 96 96 THR H H 96 8.100 8.100 8.406 -0.306 25277 3519 1 8 . 1 1 97 97 THR N N 97 122.660 122.660 121.175 1.485 25277 3520 1 8 . 1 1 97 97 THR HA H 97 4.590 4.590 4.745 -0.155 25277 3521 1 8 . 1 1 97 97 THR C C 97 173.000 173.000 173.159 -0.159 25277 3522 1 8 . 1 1 97 97 THR CA C 97 62.700 62.700 61.765 0.935 25277 3523 1 8 . 1 1 97 97 THR CB C 97 68.840 68.840 69.985 -1.145 25277 3524 1 8 . 1 1 97 97 THR H H 97 7.850 7.850 8.271 -0.421 25277 3525 1 8 . 1 1 98 98 TYR N N 98 122.890 122.890 124.639 -1.749 25277 3526 1 8 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.124 -0.184 25277 3527 1 8 . 1 1 98 98 TYR C C 98 178.970 178.970 174.726 4.244 25277 3528 1 8 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.253 0.257 25277 3529 1 8 . 1 1 98 98 TYR CB C 98 42.950 42.950 42.241 0.709 25277 3530 1 8 . 1 1 98 98 TYR H H 98 9.460 9.460 9.182 0.278 25277 3531 1 8 . 1 1 99 99 ALA N N 99 121.760 121.760 123.528 -1.768 25277 3532 1 8 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.671 -0.561 25277 3533 1 8 . 1 1 99 99 ALA C C 99 178.010 178.010 176.320 1.690 25277 3534 1 8 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.235 1.035 25277 3535 1 8 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.598 2.452 25277 3536 1 8 . 1 1 99 99 ALA H H 99 9.110 9.110 8.853 0.257 25277 3537 1 8 . 1 1 100 100 LEU N N 100 119.330 119.330 124.217 -4.887 25277 3538 1 8 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.225 0.245 25277 3539 1 8 . 1 1 100 100 LEU C C 100 174.720 174.720 177.283 -2.563 25277 3540 1 8 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.716 -2.576 25277 3541 1 8 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.620 2.010 25277 3542 1 8 . 1 1 100 100 LEU H H 100 8.950 8.950 8.366 0.584 25277 3543 1 8 . 1 1 101 101 ASN N N 101 112.600 112.600 115.950 -3.350 25277 3544 1 8 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.839 0.081 25277 3545 1 8 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.706 -1.776 25277 3546 1 8 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.860 0.740 25277 3547 1 8 . 1 1 101 101 ASN H H 101 7.550 7.550 7.603 -0.053 25277 3548 1 8 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.376 -0.186 25277 3549 1 8 . 1 1 102 102 ASP C C 102 178.770 178.770 178.407 0.363 25277 3550 1 8 . 1 1 102 102 ASP CA C 102 56.880 56.880 57.325 -0.445 25277 3551 1 8 . 1 1 102 102 ASP CB C 102 39.980 39.980 40.503 -0.523 25277 3552 1 8 . 1 1 103 103 ARG N N 103 119.370 119.370 120.941 -1.571 25277 3553 1 8 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.134 -0.304 25277 3554 1 8 . 1 1 103 103 ARG C C 103 178.550 178.550 178.435 0.115 25277 3555 1 8 . 1 1 103 103 ARG CA C 103 59.380 59.380 58.889 0.491 25277 3556 1 8 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.915 -0.415 25277 3557 1 8 . 1 1 103 103 ARG H H 103 7.970 7.970 7.881 0.089 25277 3558 1 8 . 1 1 104 104 ALA N N 104 120.110 120.110 122.032 -1.922 25277 3559 1 8 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.083 0.127 25277 3560 1 8 . 1 1 104 104 ALA C C 104 179.510 179.510 179.118 0.392 25277 3561 1 8 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.368 -0.618 25277 3562 1 8 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.331 1.339 25277 3563 1 8 . 1 1 104 104 ALA H H 104 7.610 7.610 8.485 -0.875 25277 3564 1 8 . 1 1 105 105 GLU N N 105 120.460 120.460 119.230 1.230 25277 3565 1 8 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.115 0.595 25277 3566 1 8 . 1 1 105 105 GLU C C 105 181.710 181.710 179.631 2.079 25277 3567 1 8 . 1 1 105 105 GLU CA C 105 58.680 58.680 59.016 -0.336 25277 3568 1 8 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.715 -0.225 25277 3569 1 8 . 1 1 105 105 GLU H H 105 7.750 7.750 7.778 -0.028 25277 3570 1 8 . 1 1 106 106 LYS N N 106 121.980 121.980 119.666 2.314 25277 3571 1 8 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.061 -0.041 25277 3572 1 8 . 1 1 106 106 LYS C C 106 177.890 177.890 178.384 -0.494 25277 3573 1 8 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.707 -0.237 25277 3574 1 8 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.286 -0.556 25277 3575 1 8 . 1 1 106 106 LYS H H 106 8.380 8.380 8.007 0.373 25277 3576 1 8 . 1 1 107 107 ALA N N 107 119.850 119.850 119.332 0.518 25277 3577 1 8 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.275 -0.015 25277 3578 1 8 . 1 1 107 107 ALA C C 107 177.210 177.210 177.677 -0.467 25277 3579 1 8 . 1 1 107 107 ALA CA C 107 52.270 52.270 52.027 0.243 25277 3580 1 8 . 1 1 107 107 ALA CB C 107 18.740 18.740 18.610 0.130 25277 3581 1 8 . 1 1 107 107 ALA H H 107 7.400 7.400 7.637 -0.237 25277 3582 1 8 . 1 1 108 108 GLY N N 108 104.560 104.560 106.049 -1.489 25277 3583 1 8 . 1 1 108 108 GLY C C 108 174.300 174.300 174.505 -0.205 25277 3584 1 8 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.019 -0.409 25277 3585 1 8 . 1 1 108 108 GLY H H 108 7.560 7.560 7.798 -0.238 25277 3586 1 8 . 1 1 109 109 HIS N N 109 122.550 122.550 121.012 1.538 25277 3587 1 8 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.904 -0.134 25277 3588 1 8 . 1 1 109 109 HIS CA C 109 54.580 54.580 54.126 0.455 25277 3589 1 8 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.381 -0.791 25277 3590 1 8 . 1 1 109 109 HIS H H 109 7.590 7.590 7.641 -0.051 25277 3591 1 8 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.675 -0.115 25277 3592 1 8 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.199 0.531 25277 3593 1 8 . 1 1 111 111 PRO CB C 111 32.800 32.800 33.027 -0.227 25277 3594 1 8 . 1 1 112 112 ILE N N 112 119.770 119.770 120.642 -0.872 25277 3595 1 8 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.322 0.538 25277 3596 1 8 . 1 1 112 112 ILE C C 112 172.800 172.800 177.431 -4.631 25277 3597 1 8 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.500 -2.310 25277 3598 1 8 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.409 3.031 25277 3599 1 8 . 1 1 112 112 ILE H H 112 7.890 7.890 8.655 -0.765 25277 3600 1 8 . 1 1 113 113 THR N N 113 113.610 113.610 115.989 -2.379 25277 3601 1 8 . 1 1 113 113 THR HA H 113 3.010 3.010 4.026 -1.016 25277 3602 1 8 . 1 1 113 113 THR CA C 113 66.860 66.860 67.267 -0.407 25277 3603 1 8 . 1 1 113 113 THR CB C 113 66.920 66.920 67.171 -0.251 25277 3604 1 8 . 1 1 113 113 THR H H 113 7.070 7.070 8.532 -1.462 25277 3605 1 8 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.342 -0.002 25277 3606 1 8 . 1 1 114 114 PRO CA C 114 66.080 66.080 65.105 0.975 25277 3607 1 8 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.456 0.624 25277 3608 1 8 . 1 1 115 115 ILE N N 115 134.770 134.770 109.605 25.165 25277 3609 1 8 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.413 0.197 25277 3610 1 8 . 1 1 115 115 ILE C C 115 174.800 174.800 174.929 -0.129 25277 3611 1 8 . 1 1 115 115 ILE CA C 115 60.000 60.000 59.923 0.077 25277 3612 1 8 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.720 0.140 25277 3613 1 8 . 1 1 115 115 ILE H H 115 7.510 7.510 7.629 -0.119 25277 3614 1 8 . 1 1 116 116 ARG N N 116 120.890 120.890 122.259 -1.369 25277 3615 1 8 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.145 -0.175 25277 3616 1 8 . 1 1 116 116 ARG C C 116 174.910 174.910 175.712 -0.802 25277 3617 1 8 . 1 1 116 116 ARG CA C 116 57.780 57.780 55.846 1.934 25277 3618 1 8 . 1 1 116 116 ARG CB C 116 31.870 31.870 31.382 0.488 25277 3619 1 8 . 1 1 116 116 ARG H H 116 7.280 7.280 7.532 -0.252 25277 3620 1 8 . 1 1 117 117 ALA N N 117 125.400 125.400 128.182 -2.782 25277 3621 1 8 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.374 -0.144 25277 3622 1 8 . 1 1 117 117 ALA C C 117 176.290 176.290 175.749 0.541 25277 3623 1 8 . 1 1 117 117 ALA CA C 117 50.780 50.780 51.291 -0.511 25277 3624 1 8 . 1 1 117 117 ALA CB C 117 20.290 20.290 20.643 -0.353 25277 3625 1 8 . 1 1 117 117 ALA H H 117 8.150 8.150 8.426 -0.276 25277 3626 1 8 . 1 1 118 118 LYS N N 118 119.890 119.890 123.168 -3.278 25277 3627 1 8 . 1 1 118 118 LYS HA H 118 4.590 4.590 3.924 0.666 25277 3628 1 8 . 1 1 118 118 LYS C C 118 177.400 177.400 176.305 1.095 25277 3629 1 8 . 1 1 118 118 LYS CA C 118 55.670 55.670 55.152 0.518 25277 3630 1 8 . 1 1 118 118 LYS CB C 118 34.510 34.510 33.991 0.519 25277 3631 1 8 . 1 1 118 118 LYS H H 118 8.360 8.360 8.308 0.052 25277 3632 1 8 . 1 1 119 119 GLY N N 119 108.630 108.630 111.813 -3.183 25277 3633 1 8 . 1 1 119 119 GLY CA C 119 43.610 43.610 44.281 -0.671 25277 3634 1 8 . 1 1 119 119 GLY H H 119 8.320 8.320 8.126 0.194 25277 3635 1 8 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.762 0.138 25277 3636 1 8 . 1 1 124 124 TYR C C 124 177.430 177.430 176.552 0.878 25277 3637 1 8 . 1 1 124 124 TYR CA C 124 57.970 57.970 56.762 1.208 25277 3638 1 8 . 1 1 124 124 TYR CB C 124 38.650 38.650 40.465 -1.815 25277 3639 1 8 . 1 1 125 125 ILE N N 125 123.670 123.670 124.670 -1.000 25277 3640 1 8 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.079 -0.239 25277 3641 1 8 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.828 -0.098 25277 3642 1 8 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.422 0.088 25277 3643 1 8 . 1 1 125 125 ILE H H 125 8.340 8.340 8.176 0.164 25277 3644 1 8 . 1 1 126 126 SER HA H 126 4.070 4.070 4.330 -0.260 25277 3645 1 8 . 1 1 126 126 SER C C 126 176.290 176.290 174.861 1.429 25277 3646 1 8 . 1 1 126 126 SER CA C 126 59.190 59.190 59.528 -0.338 25277 3647 1 8 . 1 1 126 126 SER CB C 126 63.200 63.200 63.642 -0.442 25277 3648 1 8 . 1 1 127 127 LEU N N 127 127.030 127.030 124.432 2.598 25277 3649 1 8 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.378 -0.438 25277 3650 1 8 . 1 1 127 127 LEU C C 127 176.660 176.660 178.210 -1.550 25277 3651 1 8 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.712 0.398 25277 3652 1 8 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.637 1.293 25277 3653 1 8 . 1 1 127 127 LEU H H 127 8.790 8.790 8.365 0.425 25277 3654 1 8 . 1 1 128 128 GLY N N 128 106.600 106.600 108.865 -2.265 25277 3655 1 8 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.608 0.922 25277 3656 1 8 . 1 1 128 128 GLY H H 128 8.450 8.450 8.319 0.131 25277 3657 1 8 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.117 0.113 25277 3658 1 8 . 1 1 129 129 ALA C C 129 180.410 180.410 179.391 1.019 25277 3659 1 8 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.624 0.296 25277 3660 1 8 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.272 0.858 25277 3661 1 8 . 1 1 130 130 LEU N N 130 122.550 122.550 120.629 1.921 25277 3662 1 8 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.054 -0.134 25277 3663 1 8 . 1 1 130 130 LEU C C 130 179.020 179.020 178.505 0.515 25277 3664 1 8 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.396 0.234 25277 3665 1 8 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.649 0.491 25277 3666 1 8 . 1 1 130 130 LEU H H 130 8.040 8.040 7.454 0.586 25277 3667 1 8 . 1 1 131 131 LEU N N 131 121.910 121.910 119.371 2.539 25277 3668 1 8 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.906 0.014 25277 3669 1 8 . 1 1 131 131 LEU C C 131 177.910 177.910 178.374 -0.464 25277 3670 1 8 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.212 0.358 25277 3671 1 8 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.391 -0.671 25277 3672 1 8 . 1 1 131 131 LEU H H 131 9.060 9.060 7.801 1.259 25277 3673 1 8 . 1 1 132 132 SER N N 132 115.530 115.530 113.762 1.768 25277 3674 1 8 . 1 1 132 132 SER HA H 132 3.970 3.970 4.101 -0.131 25277 3675 1 8 . 1 1 132 132 SER C C 132 177.140 177.140 176.741 0.399 25277 3676 1 8 . 1 1 132 132 SER CA C 132 62.340 62.340 62.260 0.080 25277 3677 1 8 . 1 1 132 132 SER CB C 132 62.370 62.370 62.922 -0.553 25277 3678 1 8 . 1 1 132 132 SER H H 132 8.730 8.730 8.208 0.522 25277 3679 1 8 . 1 1 133 133 THR N N 133 116.960 116.960 118.845 -1.885 25277 3680 1 8 . 1 1 133 133 THR HA H 133 3.860 3.860 3.953 -0.093 25277 3681 1 8 . 1 1 133 133 THR C C 133 175.670 175.670 176.563 -0.893 25277 3682 1 8 . 1 1 133 133 THR CA C 133 66.930 66.930 67.457 -0.527 25277 3683 1 8 . 1 1 133 133 THR CB C 133 68.880 68.880 68.781 0.099 25277 3684 1 8 . 1 1 133 133 THR H H 133 7.750 7.750 7.768 -0.018 25277 3685 1 8 . 1 1 134 134 THR N N 134 118.830 118.830 119.142 -0.312 25277 3686 1 8 . 1 1 134 134 THR HA H 134 3.780 3.780 3.972 -0.192 25277 3687 1 8 . 1 1 134 134 THR C C 134 176.750 176.750 176.288 0.462 25277 3688 1 8 . 1 1 134 134 THR CA C 134 67.650 67.650 67.239 0.411 25277 3689 1 8 . 1 1 134 134 THR CB C 134 67.560 67.560 68.702 -1.142 25277 3690 1 8 . 1 1 134 134 THR H H 134 7.570 7.570 7.683 -0.113 25277 3691 1 8 . 1 1 135 135 LEU N N 135 121.420 121.420 121.730 -0.310 25277 3692 1 8 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.928 0.562 25277 3693 1 8 . 1 1 135 135 LEU C C 135 180.050 180.050 178.709 1.341 25277 3694 1 8 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.093 -1.083 25277 3695 1 8 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.436 -0.826 25277 3696 1 8 . 1 1 135 135 LEU H H 135 8.650 8.650 8.184 0.466 25277 3697 1 8 . 1 1 136 136 ASN N N 136 117.010 117.010 117.816 -0.806 25277 3698 1 8 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.414 0.126 25277 3699 1 8 . 1 1 136 136 ASN C C 136 175.980 175.980 177.653 -1.673 25277 3700 1 8 . 1 1 136 136 ASN CA C 136 54.770 54.770 56.356 -1.586 25277 3701 1 8 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.940 -0.500 25277 3702 1 8 . 1 1 136 136 ASN H H 136 7.360 7.360 7.781 -0.421 25277 3703 1 8 . 1 1 137 137 LEU N N 137 116.940 116.940 119.652 -2.712 25277 3704 1 8 . 1 1 137 137 LEU HA H 137 4.160 4.160 4.015 0.145 25277 3705 1 8 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.584 -2.154 25277 3706 1 8 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.687 -0.117 25277 3707 1 8 . 1 1 137 137 LEU H H 137 7.810 7.810 7.635 0.175 25277 3708 1 8 . 1 1 138 138 CYS N N 138 115.430 115.430 114.573 0.857 25277 3709 1 8 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.201 0.209 25277 3710 1 8 . 1 1 138 138 CYS CA C 138 55.480 55.480 61.347 -5.867 25277 3711 1 8 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.467 14.733 25277 3712 1 8 . 1 1 138 138 CYS H H 138 7.450 7.450 7.977 -0.527 25277 3713 1 8 . 1 1 139 139 GLY C C 139 178.800 178.800 174.114 4.686 25277 3714 1 8 . 1 1 139 139 GLY CA C 139 45.500 45.500 45.020 0.480 25277 3715 1 8 . 1 1 140 140 LYS N N 140 119.830 119.830 122.083 -2.253 25277 3716 1 8 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.570 -0.250 25277 3717 1 8 . 1 1 140 140 LYS C C 140 175.820 175.820 175.698 0.122 25277 3718 1 8 . 1 1 140 140 LYS CA C 140 55.680 55.680 56.063 -0.383 25277 3719 1 8 . 1 1 140 140 LYS CB C 140 32.800 32.800 33.497 -0.697 25277 3720 1 8 . 1 1 140 140 LYS H H 140 7.760 7.760 7.793 -0.033 25277 3721 1 9 . 1 1 27 27 PRO CA C 27 63.230 63.230 62.543 0.687 25277 3722 1 9 . 1 1 27 27 PRO CB C 27 32.050 32.050 32.335 -0.285 25277 3723 1 9 . 1 1 28 28 ASP N N 28 120.030 120.030 121.384 -1.354 25277 3724 1 9 . 1 1 28 28 ASP C C 28 176.130 176.130 176.132 -0.002 25277 3725 1 9 . 1 1 28 28 ASP CA C 28 54.170 54.170 54.047 0.123 25277 3726 1 9 . 1 1 28 28 ASP CB C 28 40.860 40.860 41.512 -0.652 25277 3727 1 9 . 1 1 28 28 ASP H H 28 8.260 8.260 8.195 0.065 25277 3728 1 9 . 1 1 29 29 LEU N N 29 123.030 123.030 121.236 1.794 25277 3729 1 9 . 1 1 29 29 LEU C C 29 177.870 177.870 177.554 0.316 25277 3730 1 9 . 1 1 29 29 LEU CA C 29 55.160 55.160 55.069 0.091 25277 3731 1 9 . 1 1 29 29 LEU CB C 29 42.270 42.270 42.254 0.016 25277 3732 1 9 . 1 1 29 29 LEU H H 29 8.120 8.120 8.343 -0.223 25277 3733 1 9 . 1 1 30 30 GLY N N 30 109.350 109.350 109.842 -0.492 25277 3734 1 9 . 1 1 30 30 GLY CA C 30 45.340 45.340 44.971 0.369 25277 3735 1 9 . 1 1 30 30 GLY H H 30 8.410 8.410 8.321 0.089 25277 3736 1 9 . 1 1 44 44 PRO CA C 44 63.590 63.590 62.529 1.061 25277 3737 1 9 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.187 -0.197 25277 3738 1 9 . 1 1 45 45 ALA N N 45 122.140 122.140 121.017 1.123 25277 3739 1 9 . 1 1 45 45 ALA CA C 45 52.670 52.670 51.636 1.034 25277 3740 1 9 . 1 1 45 45 ALA H H 45 8.350 8.350 7.987 0.363 25277 3741 1 9 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.231 0.069 25277 3742 1 9 . 1 1 49 49 PRO CA C 49 62.950 62.950 63.060 -0.111 25277 3743 1 9 . 1 1 49 49 PRO CB C 49 31.990 31.990 32.152 -0.162 25277 3744 1 9 . 1 1 50 50 VAL N N 50 124.190 124.190 121.194 2.996 25277 3745 1 9 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.329 -0.009 25277 3746 1 9 . 1 1 50 50 VAL CA C 50 59.850 59.850 59.241 0.609 25277 3747 1 9 . 1 1 50 50 VAL CB C 50 32.480 32.480 31.841 0.639 25277 3748 1 9 . 1 1 50 50 VAL H H 50 8.070 8.070 8.270 -0.200 25277 3749 1 9 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.299 0.051 25277 3750 1 9 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.227 -0.297 25277 3751 1 9 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.193 -0.213 25277 3752 1 9 . 1 1 52 52 LEU N N 52 124.500 124.500 121.253 3.247 25277 3753 1 9 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.279 0.211 25277 3754 1 9 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.788 -0.898 25277 3755 1 9 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.581 0.609 25277 3756 1 9 . 1 1 52 52 LEU H H 52 8.360 8.360 8.205 0.155 25277 3757 1 9 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.512 -0.102 25277 3758 1 9 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.277 0.053 25277 3759 1 9 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.287 -0.297 25277 3760 1 9 . 1 1 54 54 SER N N 54 117.380 117.380 116.560 0.820 25277 3761 1 9 . 1 1 54 54 SER HA H 54 4.600 4.600 4.430 0.170 25277 3762 1 9 . 1 1 54 54 SER CA C 54 56.710 56.710 57.863 -1.153 25277 3763 1 9 . 1 1 54 54 SER CB C 54 62.500 62.500 62.850 -0.350 25277 3764 1 9 . 1 1 54 54 SER H H 54 8.400 8.400 8.353 0.047 25277 3765 1 9 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.544 0.006 25277 3766 1 9 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.380 0.160 25277 3767 1 9 . 1 1 55 55 PRO CB C 55 32.620 32.620 32.370 0.250 25277 3768 1 9 . 1 1 57 57 SER HA H 57 4.420 4.420 4.253 0.167 25277 3769 1 9 . 1 1 57 57 SER CA C 57 57.580 57.580 59.959 -2.380 25277 3770 1 9 . 1 1 57 57 SER CB C 57 63.780 63.780 63.147 0.633 25277 3771 1 9 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.542 0.448 25277 3772 1 9 . 1 1 58 58 ASN C C 58 172.230 172.230 174.103 -1.873 25277 3773 1 9 . 1 1 58 58 ASN CA C 58 53.670 53.670 54.829 -1.159 25277 3774 1 9 . 1 1 58 58 ASN CB C 58 37.850 37.850 37.209 0.641 25277 3775 1 9 . 1 1 59 59 LYS N N 59 117.660 117.660 116.921 0.739 25277 3776 1 9 . 1 1 59 59 LYS HA H 59 5.360 5.360 5.028 0.332 25277 3777 1 9 . 1 1 59 59 LYS C C 59 175.120 175.120 174.288 0.832 25277 3778 1 9 . 1 1 59 59 LYS CA C 59 54.860 54.860 55.745 -0.885 25277 3779 1 9 . 1 1 59 59 LYS CB C 59 36.450 36.450 37.486 -1.036 25277 3780 1 9 . 1 1 59 59 LYS H H 59 7.640 7.640 7.852 -0.212 25277 3781 1 9 . 1 1 60 60 GLN N N 60 120.680 120.680 118.943 1.737 25277 3782 1 9 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.636 -0.146 25277 3783 1 9 . 1 1 60 60 GLN C C 60 173.640 173.640 173.234 0.406 25277 3784 1 9 . 1 1 60 60 GLN CA C 60 55.480 55.480 54.959 0.521 25277 3785 1 9 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.202 -0.212 25277 3786 1 9 . 1 1 60 60 GLN H H 60 8.930 8.930 8.494 0.436 25277 3787 1 9 . 1 1 61 61 ASP N N 61 126.170 126.170 121.550 4.620 25277 3788 1 9 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.851 0.199 25277 3789 1 9 . 1 1 61 61 ASP C C 61 175.000 175.000 175.225 -0.225 25277 3790 1 9 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.372 0.508 25277 3791 1 9 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.554 -0.784 25277 3792 1 9 . 1 1 61 61 ASP H H 61 8.540 8.540 8.589 -0.049 25277 3793 1 9 . 1 1 62 62 ILE N N 62 121.100 121.100 125.066 -3.966 25277 3794 1 9 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.535 0.245 25277 3795 1 9 . 1 1 62 62 ILE C C 62 171.480 171.480 173.616 -2.136 25277 3796 1 9 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.417 0.673 25277 3797 1 9 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.363 0.777 25277 3798 1 9 . 1 1 62 62 ILE H H 62 8.970 8.970 8.414 0.556 25277 3799 1 9 . 1 1 63 63 SER N N 63 119.430 119.430 121.478 -2.048 25277 3800 1 9 . 1 1 63 63 SER HA H 63 4.680 4.680 4.534 0.146 25277 3801 1 9 . 1 1 63 63 SER C C 63 174.030 174.030 174.459 -0.429 25277 3802 1 9 . 1 1 63 63 SER CA C 63 56.550 56.550 56.686 -0.136 25277 3803 1 9 . 1 1 63 63 SER CB C 63 67.320 67.320 65.940 1.380 25277 3804 1 9 . 1 1 63 63 SER H H 63 8.520 8.520 8.006 0.514 25277 3805 1 9 . 1 1 64 64 GLU N N 64 121.250 121.250 119.959 1.291 25277 3806 1 9 . 1 1 64 64 GLU HA H 64 2.770 2.770 2.963 -0.193 25277 3807 1 9 . 1 1 64 64 GLU C C 64 177.190 177.190 177.858 -0.668 25277 3808 1 9 . 1 1 64 64 GLU CA C 64 58.590 58.590 58.880 -0.291 25277 3809 1 9 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.598 -0.458 25277 3810 1 9 . 1 1 64 64 GLU H H 64 7.400 7.400 7.633 -0.233 25277 3811 1 9 . 1 1 65 65 ALA N N 65 119.250 119.250 122.158 -2.908 25277 3812 1 9 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.870 -0.010 25277 3813 1 9 . 1 1 65 65 ALA C C 65 179.630 179.630 179.123 0.507 25277 3814 1 9 . 1 1 65 65 ALA CA C 65 53.810 53.810 54.680 -0.870 25277 3815 1 9 . 1 1 65 65 ALA CB C 65 18.400 18.400 17.988 0.412 25277 3816 1 9 . 1 1 65 65 ALA H H 65 7.700 7.700 8.245 -0.545 25277 3817 1 9 . 1 1 66 66 ASN N N 66 112.360 112.360 115.395 -3.035 25277 3818 1 9 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.444 0.586 25277 3819 1 9 . 1 1 66 66 ASN C C 66 174.580 174.580 176.950 -2.370 25277 3820 1 9 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.481 0.069 25277 3821 1 9 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.587 1.343 25277 3822 1 9 . 1 1 66 66 ASN H H 66 7.960 7.960 7.442 0.518 25277 3823 1 9 . 1 1 67 67 LEU N N 67 115.390 115.390 118.539 -3.149 25277 3824 1 9 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.250 0.400 25277 3825 1 9 . 1 1 67 67 LEU C C 67 176.500 176.500 176.737 -0.237 25277 3826 1 9 . 1 1 67 67 LEU CA C 67 54.350 54.350 56.174 -1.824 25277 3827 1 9 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.330 2.340 25277 3828 1 9 . 1 1 67 67 LEU H H 67 7.050 7.050 7.494 -0.444 25277 3829 1 9 . 1 1 68 68 ALA N N 68 125.680 125.680 120.364 5.316 25277 3830 1 9 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.743 0.147 25277 3831 1 9 . 1 1 68 68 ALA C C 68 177.480 177.480 178.321 -0.841 25277 3832 1 9 . 1 1 68 68 ALA CA C 68 53.550 53.550 53.413 0.137 25277 3833 1 9 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.133 0.017 25277 3834 1 9 . 1 1 68 68 ALA H H 68 8.880 8.880 8.014 0.866 25277 3835 1 9 . 1 1 69 69 TYR N N 69 119.780 119.780 120.225 -0.445 25277 3836 1 9 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.308 0.182 25277 3837 1 9 . 1 1 69 69 TYR C C 69 175.340 175.340 177.331 -1.991 25277 3838 1 9 . 1 1 69 69 TYR CA C 69 58.640 58.640 60.721 -2.081 25277 3839 1 9 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.052 -0.772 25277 3840 1 9 . 1 1 69 69 TYR H H 69 7.420 7.420 8.461 -1.041 25277 3841 1 9 . 1 1 70 70 LEU N N 70 118.820 118.820 116.785 2.035 25277 3842 1 9 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.162 0.128 25277 3843 1 9 . 1 1 70 70 LEU C C 70 176.770 176.770 177.446 -0.676 25277 3844 1 9 . 1 1 70 70 LEU CA C 70 53.880 53.880 55.548 -1.668 25277 3845 1 9 . 1 1 70 70 LEU CB C 70 41.300 41.300 41.795 -0.495 25277 3846 1 9 . 1 1 70 70 LEU H H 70 7.690 7.690 7.462 0.228 25277 3847 1 9 . 1 1 71 71 TRP N N 71 124.110 124.110 122.719 1.391 25277 3848 1 9 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.538 0.052 25277 3849 1 9 . 1 1 71 71 TRP CA C 71 54.150 54.150 56.015 -1.865 25277 3850 1 9 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.413 -0.203 25277 3851 1 9 . 1 1 71 71 TRP H H 71 8.130 8.130 7.669 0.461 25277 3852 1 9 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.381 0.199 25277 3853 1 9 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.138 0.452 25277 3854 1 9 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.727 -1.667 25277 3855 1 9 . 1 1 73 73 LEU N N 73 118.760 118.760 117.794 0.966 25277 3856 1 9 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.522 0.878 25277 3857 1 9 . 1 1 73 73 LEU C C 73 176.620 176.620 178.262 -1.642 25277 3858 1 9 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.774 -0.724 25277 3859 1 9 . 1 1 73 73 LEU CB C 73 44.260 44.260 43.121 1.139 25277 3860 1 9 . 1 1 73 73 LEU H H 73 5.190 5.190 6.582 -1.392 25277 3861 1 9 . 1 1 74 74 THR N N 74 110.120 110.120 115.484 -5.364 25277 3862 1 9 . 1 1 74 74 THR HA H 74 4.250 4.250 4.233 0.017 25277 3863 1 9 . 1 1 74 74 THR C C 74 176.080 176.080 175.521 0.559 25277 3864 1 9 . 1 1 74 74 THR CA C 74 62.690 62.690 63.906 -1.216 25277 3865 1 9 . 1 1 74 74 THR CB C 74 67.930 67.930 69.198 -1.268 25277 3866 1 9 . 1 1 74 74 THR H H 74 9.010 9.010 8.639 0.371 25277 3867 1 9 . 1 1 75 75 VAL N N 75 113.030 113.030 118.592 -5.562 25277 3868 1 9 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.184 0.626 25277 3869 1 9 . 1 1 75 75 VAL C C 75 176.010 176.010 177.102 -1.092 25277 3870 1 9 . 1 1 75 75 VAL CA C 75 59.100 59.100 62.701 -3.601 25277 3871 1 9 . 1 1 75 75 VAL CB C 75 33.220 33.220 32.573 0.647 25277 3872 1 9 . 1 1 75 75 VAL H H 75 6.660 6.660 7.542 -0.882 25277 3873 1 9 . 1 1 76 76 ASP N N 76 119.590 119.590 123.334 -3.744 25277 3874 1 9 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.689 -0.199 25277 3875 1 9 . 1 1 76 76 ASP C C 76 175.060 175.060 176.276 -1.216 25277 3876 1 9 . 1 1 76 76 ASP CA C 76 55.110 55.110 57.035 -1.925 25277 3877 1 9 . 1 1 76 76 ASP CB C 76 41.300 41.300 41.001 0.299 25277 3878 1 9 . 1 1 76 76 ASP H H 76 8.770 8.770 9.091 -0.321 25277 3879 1 9 . 1 1 77 77 HIS N N 77 113.300 113.300 111.991 1.309 25277 3880 1 9 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.717 0.373 25277 3881 1 9 . 1 1 77 77 HIS C C 77 171.370 171.370 173.845 -2.475 25277 3882 1 9 . 1 1 77 77 HIS CA C 77 55.590 55.590 54.566 1.024 25277 3883 1 9 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.576 -2.386 25277 3884 1 9 . 1 1 77 77 HIS H H 77 7.650 7.650 7.682 -0.032 25277 3885 1 9 . 1 1 78 78 GLY N N 78 101.350 101.350 105.648 -4.298 25277 3886 1 9 . 1 1 78 78 GLY C C 78 172.110 172.110 172.143 -0.033 25277 3887 1 9 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.820 -0.010 25277 3888 1 9 . 1 1 78 78 GLY H H 78 8.450 8.450 8.749 -0.299 25277 3889 1 9 . 1 1 79 79 THR N N 79 120.230 120.230 117.456 2.774 25277 3890 1 9 . 1 1 79 79 THR HA H 79 5.110 5.110 4.877 0.233 25277 3891 1 9 . 1 1 79 79 THR C C 79 172.920 172.920 173.884 -0.964 25277 3892 1 9 . 1 1 79 79 THR CA C 79 61.480 61.480 61.798 -0.318 25277 3893 1 9 . 1 1 79 79 THR CB C 79 72.130 72.130 70.831 1.299 25277 3894 1 9 . 1 1 79 79 THR H H 79 8.080 8.080 8.522 -0.442 25277 3895 1 9 . 1 1 80 80 ILE N N 80 119.620 119.620 121.350 -1.730 25277 3896 1 9 . 1 1 80 80 ILE HA H 80 5.140 5.140 4.915 0.225 25277 3897 1 9 . 1 1 80 80 ILE C C 80 174.340 174.340 174.175 0.165 25277 3898 1 9 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.587 -0.237 25277 3899 1 9 . 1 1 80 80 ILE CB C 80 39.550 39.550 39.730 -0.180 25277 3900 1 9 . 1 1 80 80 ILE H H 80 8.970 8.970 8.676 0.294 25277 3901 1 9 . 1 1 81 81 GLU N N 81 119.960 119.960 124.347 -4.387 25277 3902 1 9 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.098 -0.098 25277 3903 1 9 . 1 1 81 81 GLU C C 81 176.130 176.130 174.961 1.169 25277 3904 1 9 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.877 -0.317 25277 3905 1 9 . 1 1 81 81 GLU CB C 81 33.390 33.390 34.862 -1.472 25277 3906 1 9 . 1 1 81 81 GLU H H 81 8.350 8.350 8.248 0.102 25277 3907 1 9 . 1 1 82 82 CYS N N 82 123.110 123.110 121.800 1.310 25277 3908 1 9 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.050 -0.120 25277 3909 1 9 . 1 1 82 82 CYS C C 82 174.430 174.430 174.676 -0.246 25277 3910 1 9 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.380 -5.140 25277 3911 1 9 . 1 1 82 82 CYS CB C 82 43.720 43.720 26.820 16.900 25277 3912 1 9 . 1 1 82 82 CYS H H 82 8.220 8.220 8.485 -0.265 25277 3913 1 9 . 1 1 83 83 LEU N N 83 131.660 131.660 127.201 4.459 25277 3914 1 9 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.649 -0.119 25277 3915 1 9 . 1 1 83 83 LEU CA C 83 53.900 53.900 53.252 0.648 25277 3916 1 9 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.476 -2.276 25277 3917 1 9 . 1 1 83 83 LEU H H 83 8.910 8.910 8.074 0.836 25277 3918 1 9 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.247 0.123 25277 3919 1 9 . 1 1 84 84 PRO CA C 84 63.190 63.190 64.836 -1.646 25277 3920 1 9 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.662 0.268 25277 3921 1 9 . 1 1 85 85 SER N N 85 117.620 117.620 113.591 4.029 25277 3922 1 9 . 1 1 85 85 SER HA H 85 3.870 3.870 4.434 -0.564 25277 3923 1 9 . 1 1 85 85 SER C C 85 174.350 174.350 173.704 0.646 25277 3924 1 9 . 1 1 85 85 SER CA C 85 58.970 58.970 58.855 0.115 25277 3925 1 9 . 1 1 85 85 SER CB C 85 63.820 63.820 63.119 0.701 25277 3926 1 9 . 1 1 85 85 SER H H 85 7.660 7.660 8.065 -0.405 25277 3927 1 9 . 1 1 86 86 ASP N N 86 117.590 117.590 118.477 -0.887 25277 3928 1 9 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.330 -0.190 25277 3929 1 9 . 1 1 86 86 ASP C C 86 174.480 174.480 173.846 0.634 25277 3930 1 9 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.566 -0.586 25277 3931 1 9 . 1 1 86 86 ASP CB C 86 37.850 37.850 38.340 -0.490 25277 3932 1 9 . 1 1 86 86 ASP H H 86 8.490 8.490 8.293 0.198 25277 3933 1 9 . 1 1 87 87 ASN N N 87 117.160 117.160 116.270 0.890 25277 3934 1 9 . 1 1 87 87 ASN HA H 87 4.530 4.530 4.986 -0.456 25277 3935 1 9 . 1 1 87 87 ASN CA C 87 52.480 52.480 52.306 0.174 25277 3936 1 9 . 1 1 87 87 ASN CB C 87 40.040 40.040 42.669 -2.629 25277 3937 1 9 . 1 1 87 87 ASN H H 87 7.260 7.260 7.759 -0.499 25277 3938 1 9 . 1 1 88 88 ALA HA H 88 4.730 4.730 4.787 -0.057 25277 3939 1 9 . 1 1 88 88 ALA C C 88 174.620 174.620 176.278 -1.658 25277 3940 1 9 . 1 1 88 88 ALA CA C 88 51.230 51.230 50.779 0.451 25277 3941 1 9 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.010 0.530 25277 3942 1 9 . 1 1 89 89 VAL N N 89 116.580 116.580 117.457 -0.877 25277 3943 1 9 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.073 0.027 25277 3944 1 9 . 1 1 89 89 VAL C C 89 172.750 172.750 173.559 -0.809 25277 3945 1 9 . 1 1 89 89 VAL CA C 89 58.980 58.980 59.412 -0.432 25277 3946 1 9 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.514 0.706 25277 3947 1 9 . 1 1 89 89 VAL H H 89 8.740 8.740 8.173 0.567 25277 3948 1 9 . 1 1 90 90 PHE N N 90 120.300 120.300 123.660 -3.360 25277 3949 1 9 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.113 0.037 25277 3950 1 9 . 1 1 90 90 PHE C C 90 172.910 172.910 173.548 -0.638 25277 3951 1 9 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.550 0.250 25277 3952 1 9 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.459 1.191 25277 3953 1 9 . 1 1 90 90 PHE H H 90 8.950 8.950 8.966 -0.016 25277 3954 1 9 . 1 1 91 91 VAL N N 91 129.020 129.020 128.420 0.600 25277 3955 1 9 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.603 -0.143 25277 3956 1 9 . 1 1 91 91 VAL C C 91 175.910 175.910 174.056 1.854 25277 3957 1 9 . 1 1 91 91 VAL CA C 91 60.780 60.780 60.575 0.205 25277 3958 1 9 . 1 1 91 91 VAL CB C 91 32.020 32.020 33.975 -1.955 25277 3959 1 9 . 1 1 91 91 VAL H H 91 9.090 9.090 8.641 0.449 25277 3960 1 9 . 1 1 92 92 ALA N N 92 129.760 129.760 129.167 0.593 25277 3961 1 9 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.748 -0.248 25277 3962 1 9 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.603 2.247 25277 3963 1 9 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.367 -1.317 25277 3964 1 9 . 1 1 92 92 ALA H H 92 8.680 8.680 8.462 0.218 25277 3965 1 9 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.070 0.090 25277 3966 1 9 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.075 0.325 25277 3967 1 9 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.610 0.330 25277 3968 1 9 . 1 1 94 94 ASP N N 94 113.220 113.220 114.927 -1.707 25277 3969 1 9 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.469 -0.049 25277 3970 1 9 . 1 1 94 94 ASP C C 94 176.980 176.980 177.476 -0.496 25277 3971 1 9 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.977 -0.447 25277 3972 1 9 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.859 -0.279 25277 3973 1 9 . 1 1 94 94 ASP H H 94 7.890 7.890 7.800 0.090 25277 3974 1 9 . 1 1 95 95 GLY N N 95 109.120 109.120 108.292 0.828 25277 3975 1 9 . 1 1 95 95 GLY C C 95 174.440 174.440 174.350 0.090 25277 3976 1 9 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.139 -0.579 25277 3977 1 9 . 1 1 95 95 GLY H H 95 8.500 8.500 8.146 0.354 25277 3978 1 9 . 1 1 96 96 THR N N 96 120.350 120.350 118.526 1.824 25277 3979 1 9 . 1 1 96 96 THR HA H 96 3.780 3.780 4.449 -0.669 25277 3980 1 9 . 1 1 96 96 THR C C 96 172.590 172.590 173.290 -0.700 25277 3981 1 9 . 1 1 96 96 THR CA C 96 64.660 64.660 61.923 2.737 25277 3982 1 9 . 1 1 96 96 THR CB C 96 68.330 68.330 70.037 -1.706 25277 3983 1 9 . 1 1 96 96 THR H H 96 8.100 8.100 8.399 -0.299 25277 3984 1 9 . 1 1 97 97 THR N N 97 122.660 122.660 121.351 1.309 25277 3985 1 9 . 1 1 97 97 THR HA H 97 4.590 4.590 4.732 -0.142 25277 3986 1 9 . 1 1 97 97 THR C C 97 173.000 173.000 173.859 -0.859 25277 3987 1 9 . 1 1 97 97 THR CA C 97 62.700 62.700 62.095 0.605 25277 3988 1 9 . 1 1 97 97 THR CB C 97 68.840 68.840 69.715 -0.875 25277 3989 1 9 . 1 1 97 97 THR H H 97 7.850 7.850 8.425 -0.575 25277 3990 1 9 . 1 1 98 98 TYR N N 98 122.890 122.890 125.862 -2.972 25277 3991 1 9 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.233 -0.293 25277 3992 1 9 . 1 1 98 98 TYR C C 98 178.970 178.970 174.758 4.212 25277 3993 1 9 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.124 0.386 25277 3994 1 9 . 1 1 98 98 TYR CB C 98 42.950 42.950 42.145 0.805 25277 3995 1 9 . 1 1 98 98 TYR H H 98 9.460 9.460 9.260 0.200 25277 3996 1 9 . 1 1 99 99 ALA N N 99 121.760 121.760 123.470 -1.710 25277 3997 1 9 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.652 -0.542 25277 3998 1 9 . 1 1 99 99 ALA C C 99 178.010 178.010 176.517 1.493 25277 3999 1 9 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.174 1.096 25277 4000 1 9 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.647 2.403 25277 4001 1 9 . 1 1 99 99 ALA H H 99 9.110 9.110 8.852 0.258 25277 4002 1 9 . 1 1 100 100 LEU N N 100 119.330 119.330 124.457 -5.127 25277 4003 1 9 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.218 0.252 25277 4004 1 9 . 1 1 100 100 LEU C C 100 174.720 174.720 177.211 -2.491 25277 4005 1 9 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.913 -2.773 25277 4006 1 9 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.605 2.025 25277 4007 1 9 . 1 1 100 100 LEU H H 100 8.950 8.950 8.424 0.526 25277 4008 1 9 . 1 1 101 101 ASN N N 101 112.600 112.600 115.727 -3.127 25277 4009 1 9 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.905 0.015 25277 4010 1 9 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.401 -1.471 25277 4011 1 9 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.606 0.994 25277 4012 1 9 . 1 1 101 101 ASN H H 101 7.550 7.550 7.740 -0.190 25277 4013 1 9 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.318 -0.128 25277 4014 1 9 . 1 1 102 102 ASP C C 102 178.770 178.770 178.221 0.549 25277 4015 1 9 . 1 1 102 102 ASP CA C 102 56.880 56.880 57.438 -0.558 25277 4016 1 9 . 1 1 102 102 ASP CB C 102 39.980 39.980 40.385 -0.405 25277 4017 1 9 . 1 1 103 103 ARG N N 103 119.370 119.370 119.906 -0.536 25277 4018 1 9 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.064 -0.234 25277 4019 1 9 . 1 1 103 103 ARG C C 103 178.550 178.550 178.613 -0.063 25277 4020 1 9 . 1 1 103 103 ARG CA C 103 59.380 59.380 58.835 0.545 25277 4021 1 9 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.896 -0.396 25277 4022 1 9 . 1 1 103 103 ARG H H 103 7.970 7.970 8.216 -0.246 25277 4023 1 9 . 1 1 104 104 ALA N N 104 120.110 120.110 121.709 -1.599 25277 4024 1 9 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.102 0.108 25277 4025 1 9 . 1 1 104 104 ALA C C 104 179.510 179.510 179.216 0.294 25277 4026 1 9 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.310 -0.560 25277 4027 1 9 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.324 1.346 25277 4028 1 9 . 1 1 104 104 ALA H H 104 7.610 7.610 8.590 -0.980 25277 4029 1 9 . 1 1 105 105 GLU N N 105 120.460 120.460 119.570 0.890 25277 4030 1 9 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.310 0.400 25277 4031 1 9 . 1 1 105 105 GLU C C 105 181.710 181.710 179.304 2.406 25277 4032 1 9 . 1 1 105 105 GLU CA C 105 58.680 58.680 59.009 -0.329 25277 4033 1 9 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.699 -0.209 25277 4034 1 9 . 1 1 105 105 GLU H H 105 7.750 7.750 7.783 -0.033 25277 4035 1 9 . 1 1 106 106 LYS N N 106 121.980 121.980 120.145 1.835 25277 4036 1 9 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.102 -0.082 25277 4037 1 9 . 1 1 106 106 LYS C C 106 177.890 177.890 178.018 -0.128 25277 4038 1 9 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.670 -0.200 25277 4039 1 9 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.477 -0.747 25277 4040 1 9 . 1 1 106 106 LYS H H 106 8.380 8.380 7.957 0.423 25277 4041 1 9 . 1 1 107 107 ALA N N 107 119.850 119.850 118.968 0.882 25277 4042 1 9 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.329 -0.069 25277 4043 1 9 . 1 1 107 107 ALA C C 107 177.210 177.210 177.407 -0.197 25277 4044 1 9 . 1 1 107 107 ALA CA C 107 52.270 52.270 52.010 0.260 25277 4045 1 9 . 1 1 107 107 ALA CB C 107 18.740 18.740 18.858 -0.118 25277 4046 1 9 . 1 1 107 107 ALA H H 107 7.400 7.400 7.578 -0.178 25277 4047 1 9 . 1 1 108 108 GLY N N 108 104.560 104.560 106.431 -1.871 25277 4048 1 9 . 1 1 108 108 GLY C C 108 174.300 174.300 174.249 0.051 25277 4049 1 9 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.041 -0.431 25277 4050 1 9 . 1 1 108 108 GLY H H 108 7.560 7.560 7.794 -0.234 25277 4051 1 9 . 1 1 109 109 HIS N N 109 122.550 122.550 120.150 2.400 25277 4052 1 9 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.942 -0.172 25277 4053 1 9 . 1 1 109 109 HIS CA C 109 54.580 54.580 54.041 0.539 25277 4054 1 9 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.437 -0.847 25277 4055 1 9 . 1 1 109 109 HIS H H 109 7.590 7.590 7.801 -0.211 25277 4056 1 9 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.725 -0.165 25277 4057 1 9 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.524 0.206 25277 4058 1 9 . 1 1 111 111 PRO CB C 111 32.800 32.800 32.829 -0.029 25277 4059 1 9 . 1 1 112 112 ILE N N 112 119.770 119.770 119.265 0.505 25277 4060 1 9 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.541 0.319 25277 4061 1 9 . 1 1 112 112 ILE C C 112 172.800 172.800 177.626 -4.826 25277 4062 1 9 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.260 -2.070 25277 4063 1 9 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.302 3.138 25277 4064 1 9 . 1 1 112 112 ILE H H 112 7.890 7.890 8.266 -0.376 25277 4065 1 9 . 1 1 113 113 THR N N 113 113.610 113.610 116.209 -2.599 25277 4066 1 9 . 1 1 113 113 THR HA H 113 3.010 3.010 3.982 -0.972 25277 4067 1 9 . 1 1 113 113 THR CA C 113 66.860 66.860 68.438 -1.578 25277 4068 1 9 . 1 1 113 113 THR CB C 113 66.920 66.920 67.658 -0.738 25277 4069 1 9 . 1 1 113 113 THR H H 113 7.070 7.070 8.539 -1.469 25277 4070 1 9 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.346 -0.006 25277 4071 1 9 . 1 1 114 114 PRO CA C 114 66.080 66.080 64.992 1.088 25277 4072 1 9 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.616 0.465 25277 4073 1 9 . 1 1 115 115 ILE N N 115 134.770 134.770 110.034 24.736 25277 4074 1 9 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.365 0.245 25277 4075 1 9 . 1 1 115 115 ILE C C 115 174.800 174.800 174.966 -0.166 25277 4076 1 9 . 1 1 115 115 ILE CA C 115 60.000 60.000 59.928 0.072 25277 4077 1 9 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.589 0.271 25277 4078 1 9 . 1 1 115 115 ILE H H 115 7.510 7.510 7.576 -0.066 25277 4079 1 9 . 1 1 116 116 ARG N N 116 120.890 120.890 121.975 -1.085 25277 4080 1 9 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.093 -0.123 25277 4081 1 9 . 1 1 116 116 ARG C C 116 174.910 174.910 175.857 -0.947 25277 4082 1 9 . 1 1 116 116 ARG CA C 116 57.780 57.780 55.854 1.926 25277 4083 1 9 . 1 1 116 116 ARG CB C 116 31.870 31.870 31.334 0.536 25277 4084 1 9 . 1 1 116 116 ARG H H 116 7.280 7.280 7.471 -0.191 25277 4085 1 9 . 1 1 117 117 ALA N N 117 125.400 125.400 128.841 -3.441 25277 4086 1 9 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.340 -0.110 25277 4087 1 9 . 1 1 117 117 ALA C C 117 176.290 176.290 176.416 -0.126 25277 4088 1 9 . 1 1 117 117 ALA CA C 117 50.780 50.780 51.520 -0.740 25277 4089 1 9 . 1 1 117 117 ALA CB C 117 20.290 20.290 20.481 -0.191 25277 4090 1 9 . 1 1 117 117 ALA H H 117 8.150 8.150 8.403 -0.253 25277 4091 1 9 . 1 1 118 118 LYS N N 118 119.890 119.890 121.477 -1.587 25277 4092 1 9 . 1 1 118 118 LYS HA H 118 4.590 4.590 4.073 0.517 25277 4093 1 9 . 1 1 118 118 LYS C C 118 177.400 177.400 176.656 0.744 25277 4094 1 9 . 1 1 118 118 LYS CA C 118 55.670 55.670 55.877 -0.207 25277 4095 1 9 . 1 1 118 118 LYS CB C 118 34.510 34.510 33.592 0.918 25277 4096 1 9 . 1 1 118 118 LYS H H 118 8.360 8.360 8.272 0.088 25277 4097 1 9 . 1 1 119 119 GLY N N 119 108.630 108.630 108.990 -0.360 25277 4098 1 9 . 1 1 119 119 GLY CA C 119 43.610 43.610 44.193 -0.583 25277 4099 1 9 . 1 1 119 119 GLY H H 119 8.320 8.320 8.323 -0.003 25277 4100 1 9 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.773 0.127 25277 4101 1 9 . 1 1 124 124 TYR C C 124 177.430 177.430 175.994 1.436 25277 4102 1 9 . 1 1 124 124 TYR CA C 124 57.970 57.970 56.379 1.591 25277 4103 1 9 . 1 1 124 124 TYR CB C 124 38.650 38.650 41.240 -2.590 25277 4104 1 9 . 1 1 125 125 ILE N N 125 123.670 123.670 124.585 -0.915 25277 4105 1 9 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.083 -0.243 25277 4106 1 9 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.781 -0.051 25277 4107 1 9 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.403 0.107 25277 4108 1 9 . 1 1 125 125 ILE H H 125 8.340 8.340 8.042 0.298 25277 4109 1 9 . 1 1 126 126 SER HA H 126 4.070 4.070 4.371 -0.301 25277 4110 1 9 . 1 1 126 126 SER C C 126 176.290 176.290 174.955 1.335 25277 4111 1 9 . 1 1 126 126 SER CA C 126 59.190 59.190 59.298 -0.108 25277 4112 1 9 . 1 1 126 126 SER CB C 126 63.200 63.200 63.797 -0.597 25277 4113 1 9 . 1 1 127 127 LEU N N 127 127.030 127.030 124.434 2.596 25277 4114 1 9 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.390 -0.450 25277 4115 1 9 . 1 1 127 127 LEU C C 127 176.660 176.660 178.156 -1.496 25277 4116 1 9 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.579 0.531 25277 4117 1 9 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.625 1.305 25277 4118 1 9 . 1 1 127 127 LEU H H 127 8.790 8.790 8.367 0.423 25277 4119 1 9 . 1 1 128 128 GLY N N 128 106.600 106.600 108.989 -2.389 25277 4120 1 9 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.640 0.890 25277 4121 1 9 . 1 1 128 128 GLY H H 128 8.450 8.450 8.297 0.153 25277 4122 1 9 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.065 0.165 25277 4123 1 9 . 1 1 129 129 ALA C C 129 180.410 180.410 179.410 1.000 25277 4124 1 9 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.524 0.396 25277 4125 1 9 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.317 0.813 25277 4126 1 9 . 1 1 130 130 LEU N N 130 122.550 122.550 120.508 2.042 25277 4127 1 9 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.037 -0.117 25277 4128 1 9 . 1 1 130 130 LEU C C 130 179.020 179.020 178.488 0.532 25277 4129 1 9 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.421 0.209 25277 4130 1 9 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.625 0.515 25277 4131 1 9 . 1 1 130 130 LEU H H 130 8.040 8.040 7.455 0.585 25277 4132 1 9 . 1 1 131 131 LEU N N 131 121.910 121.910 119.429 2.481 25277 4133 1 9 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.909 0.011 25277 4134 1 9 . 1 1 131 131 LEU C C 131 177.910 177.910 178.413 -0.503 25277 4135 1 9 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.195 0.375 25277 4136 1 9 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.443 -0.723 25277 4137 1 9 . 1 1 131 131 LEU H H 131 9.060 9.060 7.933 1.127 25277 4138 1 9 . 1 1 132 132 SER N N 132 115.530 115.530 114.207 1.323 25277 4139 1 9 . 1 1 132 132 SER HA H 132 3.970 3.970 4.112 -0.142 25277 4140 1 9 . 1 1 132 132 SER C C 132 177.140 177.140 176.955 0.185 25277 4141 1 9 . 1 1 132 132 SER CA C 132 62.340 62.340 62.261 0.078 25277 4142 1 9 . 1 1 132 132 SER CB C 132 62.370 62.370 62.526 -0.156 25277 4143 1 9 . 1 1 132 132 SER H H 132 8.730 8.730 8.310 0.420 25277 4144 1 9 . 1 1 133 133 THR N N 133 116.960 116.960 119.271 -2.311 25277 4145 1 9 . 1 1 133 133 THR HA H 133 3.860 3.860 4.067 -0.207 25277 4146 1 9 . 1 1 133 133 THR C C 133 175.670 175.670 176.772 -1.102 25277 4147 1 9 . 1 1 133 133 THR CA C 133 66.930 66.930 67.403 -0.473 25277 4148 1 9 . 1 1 133 133 THR CB C 133 68.880 68.880 68.416 0.464 25277 4149 1 9 . 1 1 133 133 THR H H 133 7.750 7.750 7.837 -0.087 25277 4150 1 9 . 1 1 134 134 THR N N 134 118.830 118.830 118.936 -0.106 25277 4151 1 9 . 1 1 134 134 THR HA H 134 3.780 3.780 4.068 -0.288 25277 4152 1 9 . 1 1 134 134 THR C C 134 176.750 176.750 176.200 0.550 25277 4153 1 9 . 1 1 134 134 THR CA C 134 67.650 67.650 66.768 0.882 25277 4154 1 9 . 1 1 134 134 THR CB C 134 67.560 67.560 68.409 -0.849 25277 4155 1 9 . 1 1 134 134 THR H H 134 7.570 7.570 7.715 -0.145 25277 4156 1 9 . 1 1 135 135 LEU N N 135 121.420 121.420 121.766 -0.346 25277 4157 1 9 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.917 0.573 25277 4158 1 9 . 1 1 135 135 LEU C C 135 180.050 180.050 178.939 1.111 25277 4159 1 9 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.288 -1.278 25277 4160 1 9 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.373 -0.763 25277 4161 1 9 . 1 1 135 135 LEU H H 135 8.650 8.650 8.249 0.401 25277 4162 1 9 . 1 1 136 136 ASN N N 136 117.010 117.010 117.365 -0.355 25277 4163 1 9 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.445 0.095 25277 4164 1 9 . 1 1 136 136 ASN C C 136 175.980 175.980 177.657 -1.677 25277 4165 1 9 . 1 1 136 136 ASN CA C 136 54.770 54.770 55.873 -1.103 25277 4166 1 9 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.553 -0.113 25277 4167 1 9 . 1 1 136 136 ASN H H 136 7.360 7.360 7.788 -0.428 25277 4168 1 9 . 1 1 137 137 LEU N N 137 116.940 116.940 119.735 -2.795 25277 4169 1 9 . 1 1 137 137 LEU HA H 137 4.160 4.160 3.982 0.178 25277 4170 1 9 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.772 -2.342 25277 4171 1 9 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.622 -0.052 25277 4172 1 9 . 1 1 137 137 LEU H H 137 7.810 7.810 7.561 0.249 25277 4173 1 9 . 1 1 138 138 CYS N N 138 115.430 115.430 114.704 0.726 25277 4174 1 9 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.236 0.174 25277 4175 1 9 . 1 1 138 138 CYS CA C 138 55.480 55.480 60.992 -5.512 25277 4176 1 9 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.471 14.729 25277 4177 1 9 . 1 1 138 138 CYS H H 138 7.450 7.450 7.899 -0.449 25277 4178 1 9 . 1 1 139 139 GLY C C 139 178.800 178.800 174.021 4.779 25277 4179 1 9 . 1 1 139 139 GLY CA C 139 45.500 45.500 45.225 0.275 25277 4180 1 9 . 1 1 140 140 LYS N N 140 119.830 119.830 121.902 -2.072 25277 4181 1 9 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.413 -0.093 25277 4182 1 9 . 1 1 140 140 LYS C C 140 175.820 175.820 177.022 -1.202 25277 4183 1 9 . 1 1 140 140 LYS CA C 140 55.680 55.680 56.183 -0.503 25277 4184 1 9 . 1 1 140 140 LYS CB C 140 32.800 32.800 33.329 -0.529 25277 4185 1 9 . 1 1 140 140 LYS H H 140 7.760 7.760 7.437 0.323 25277 4186 1 10 . 1 1 27 27 PRO CA C 27 63.230 63.230 63.111 0.118 25277 4187 1 10 . 1 1 27 27 PRO CB C 27 32.050 32.050 31.776 0.274 25277 4188 1 10 . 1 1 28 28 ASP N N 28 120.030 120.030 123.501 -3.471 25277 4189 1 10 . 1 1 28 28 ASP C C 28 176.130 176.130 176.125 0.005 25277 4190 1 10 . 1 1 28 28 ASP CA C 28 54.170 54.170 54.188 -0.018 25277 4191 1 10 . 1 1 28 28 ASP CB C 28 40.860 40.860 41.385 -0.525 25277 4192 1 10 . 1 1 28 28 ASP H H 28 8.260 8.260 8.269 -0.009 25277 4193 1 10 . 1 1 29 29 LEU N N 29 123.030 123.030 121.741 1.289 25277 4194 1 10 . 1 1 29 29 LEU C C 29 177.870 177.870 178.068 -0.198 25277 4195 1 10 . 1 1 29 29 LEU CA C 29 55.160 55.160 54.779 0.381 25277 4196 1 10 . 1 1 29 29 LEU CB C 29 42.270 42.270 42.642 -0.372 25277 4197 1 10 . 1 1 29 29 LEU H H 29 8.120 8.120 8.206 -0.085 25277 4198 1 10 . 1 1 30 30 GLY N N 30 109.350 109.350 109.748 -0.398 25277 4199 1 10 . 1 1 30 30 GLY CA C 30 45.340 45.340 44.816 0.524 25277 4200 1 10 . 1 1 30 30 GLY H H 30 8.410 8.410 8.367 0.043 25277 4201 1 10 . 1 1 44 44 PRO CA C 44 63.590 63.590 62.169 1.421 25277 4202 1 10 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.447 -0.457 25277 4203 1 10 . 1 1 45 45 ALA N N 45 122.140 122.140 120.969 1.171 25277 4204 1 10 . 1 1 45 45 ALA CA C 45 52.670 52.670 51.826 0.844 25277 4205 1 10 . 1 1 45 45 ALA H H 45 8.350 8.350 7.937 0.413 25277 4206 1 10 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.257 0.043 25277 4207 1 10 . 1 1 49 49 PRO CA C 49 62.950 62.950 63.253 -0.303 25277 4208 1 10 . 1 1 49 49 PRO CB C 49 31.990 31.990 32.127 -0.137 25277 4209 1 10 . 1 1 50 50 VAL N N 50 124.190 124.190 124.643 -0.453 25277 4210 1 10 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.312 0.008 25277 4211 1 10 . 1 1 50 50 VAL CA C 50 59.850 59.850 59.741 0.109 25277 4212 1 10 . 1 1 50 50 VAL CB C 50 32.480 32.480 32.039 0.441 25277 4213 1 10 . 1 1 50 50 VAL H H 50 8.070 8.070 8.129 -0.059 25277 4214 1 10 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.298 0.052 25277 4215 1 10 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.031 -0.101 25277 4216 1 10 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.178 -0.198 25277 4217 1 10 . 1 1 52 52 LEU N N 52 124.500 124.500 121.672 2.828 25277 4218 1 10 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.263 0.227 25277 4219 1 10 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.864 -0.974 25277 4220 1 10 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.604 0.586 25277 4221 1 10 . 1 1 52 52 LEU H H 52 8.360 8.360 8.194 0.166 25277 4222 1 10 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.498 -0.088 25277 4223 1 10 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.622 -0.292 25277 4224 1 10 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.157 -0.167 25277 4225 1 10 . 1 1 54 54 SER N N 54 117.380 117.380 117.559 -0.179 25277 4226 1 10 . 1 1 54 54 SER HA H 54 4.600 4.600 4.371 0.229 25277 4227 1 10 . 1 1 54 54 SER CA C 54 56.710 56.710 57.513 -0.803 25277 4228 1 10 . 1 1 54 54 SER CB C 54 62.500 62.500 63.251 -0.751 25277 4229 1 10 . 1 1 54 54 SER H H 54 8.400 8.400 8.256 0.144 25277 4230 1 10 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.631 -0.081 25277 4231 1 10 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.457 0.083 25277 4232 1 10 . 1 1 55 55 PRO CB C 55 32.620 32.620 32.254 0.366 25277 4233 1 10 . 1 1 57 57 SER HA H 57 4.420 4.420 4.251 0.169 25277 4234 1 10 . 1 1 57 57 SER CA C 57 57.580 57.580 60.115 -2.535 25277 4235 1 10 . 1 1 57 57 SER CB C 57 63.780 63.780 63.163 0.616 25277 4236 1 10 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.508 0.482 25277 4237 1 10 . 1 1 58 58 ASN C C 58 172.230 172.230 173.946 -1.716 25277 4238 1 10 . 1 1 58 58 ASN CA C 58 53.670 53.670 54.783 -1.113 25277 4239 1 10 . 1 1 58 58 ASN CB C 58 37.850 37.850 37.880 -0.030 25277 4240 1 10 . 1 1 59 59 LYS N N 59 117.660 117.660 116.534 1.126 25277 4241 1 10 . 1 1 59 59 LYS HA H 59 5.360 5.360 5.100 0.260 25277 4242 1 10 . 1 1 59 59 LYS C C 59 175.120 175.120 174.300 0.820 25277 4243 1 10 . 1 1 59 59 LYS CA C 59 54.860 54.860 55.579 -0.719 25277 4244 1 10 . 1 1 59 59 LYS CB C 59 36.450 36.450 37.378 -0.928 25277 4245 1 10 . 1 1 59 59 LYS H H 59 7.640 7.640 7.784 -0.144 25277 4246 1 10 . 1 1 60 60 GLN N N 60 120.680 120.680 119.064 1.616 25277 4247 1 10 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.644 -0.154 25277 4248 1 10 . 1 1 60 60 GLN C C 60 173.640 173.640 173.261 0.379 25277 4249 1 10 . 1 1 60 60 GLN CA C 60 55.480 55.480 54.883 0.597 25277 4250 1 10 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.199 -0.208 25277 4251 1 10 . 1 1 60 60 GLN H H 60 8.930 8.930 8.538 0.392 25277 4252 1 10 . 1 1 61 61 ASP N N 61 126.170 126.170 121.624 4.546 25277 4253 1 10 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.851 0.199 25277 4254 1 10 . 1 1 61 61 ASP C C 61 175.000 175.000 175.231 -0.231 25277 4255 1 10 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.357 0.523 25277 4256 1 10 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.542 -0.772 25277 4257 1 10 . 1 1 61 61 ASP H H 61 8.540 8.540 8.592 -0.052 25277 4258 1 10 . 1 1 62 62 ILE N N 62 121.100 121.100 125.242 -4.142 25277 4259 1 10 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.580 0.200 25277 4260 1 10 . 1 1 62 62 ILE C C 62 171.480 171.480 173.594 -2.114 25277 4261 1 10 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.578 0.512 25277 4262 1 10 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.531 0.609 25277 4263 1 10 . 1 1 62 62 ILE H H 62 8.970 8.970 8.397 0.573 25277 4264 1 10 . 1 1 63 63 SER N N 63 119.430 119.430 121.187 -1.757 25277 4265 1 10 . 1 1 63 63 SER HA H 63 4.680 4.680 4.531 0.149 25277 4266 1 10 . 1 1 63 63 SER C C 63 174.030 174.030 174.369 -0.339 25277 4267 1 10 . 1 1 63 63 SER CA C 63 56.550 56.550 56.509 0.041 25277 4268 1 10 . 1 1 63 63 SER CB C 63 67.320 67.320 66.044 1.276 25277 4269 1 10 . 1 1 63 63 SER H H 63 8.520 8.520 7.975 0.545 25277 4270 1 10 . 1 1 64 64 GLU N N 64 121.250 121.250 120.047 1.203 25277 4271 1 10 . 1 1 64 64 GLU HA H 64 2.770 2.770 2.964 -0.194 25277 4272 1 10 . 1 1 64 64 GLU C C 64 177.190 177.190 177.860 -0.670 25277 4273 1 10 . 1 1 64 64 GLU CA C 64 58.590 58.590 58.843 -0.253 25277 4274 1 10 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.645 -0.505 25277 4275 1 10 . 1 1 64 64 GLU H H 64 7.400 7.400 7.643 -0.243 25277 4276 1 10 . 1 1 65 65 ALA N N 65 119.250 119.250 121.514 -2.264 25277 4277 1 10 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.831 0.029 25277 4278 1 10 . 1 1 65 65 ALA C C 65 179.630 179.630 179.528 0.102 25277 4279 1 10 . 1 1 65 65 ALA CA C 65 53.810 53.810 55.065 -1.255 25277 4280 1 10 . 1 1 65 65 ALA CB C 65 18.400 18.400 18.277 0.123 25277 4281 1 10 . 1 1 65 65 ALA H H 65 7.700 7.700 8.305 -0.605 25277 4282 1 10 . 1 1 66 66 ASN N N 66 112.360 112.360 116.359 -3.999 25277 4283 1 10 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.499 0.531 25277 4284 1 10 . 1 1 66 66 ASN C C 66 174.580 174.580 177.382 -2.802 25277 4285 1 10 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.686 -0.136 25277 4286 1 10 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.493 1.437 25277 4287 1 10 . 1 1 66 66 ASN H H 66 7.960 7.960 7.496 0.464 25277 4288 1 10 . 1 1 67 67 LEU N N 67 115.390 115.390 118.752 -3.362 25277 4289 1 10 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.226 0.424 25277 4290 1 10 . 1 1 67 67 LEU C C 67 176.500 176.500 176.927 -0.427 25277 4291 1 10 . 1 1 67 67 LEU CA C 67 54.350 54.350 56.162 -1.812 25277 4292 1 10 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.039 2.631 25277 4293 1 10 . 1 1 67 67 LEU H H 67 7.050 7.050 7.602 -0.552 25277 4294 1 10 . 1 1 68 68 ALA N N 68 125.680 125.680 120.558 5.122 25277 4295 1 10 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.898 -0.008 25277 4296 1 10 . 1 1 68 68 ALA C C 68 177.480 177.480 178.044 -0.564 25277 4297 1 10 . 1 1 68 68 ALA CA C 68 53.550 53.550 53.479 0.071 25277 4298 1 10 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.316 -0.166 25277 4299 1 10 . 1 1 68 68 ALA H H 68 8.880 8.880 8.014 0.866 25277 4300 1 10 . 1 1 69 69 TYR N N 69 119.780 119.780 121.637 -1.857 25277 4301 1 10 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.279 0.211 25277 4302 1 10 . 1 1 69 69 TYR C C 69 175.340 175.340 176.765 -1.425 25277 4303 1 10 . 1 1 69 69 TYR CA C 69 58.640 58.640 60.752 -2.112 25277 4304 1 10 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.305 -1.025 25277 4305 1 10 . 1 1 69 69 TYR H H 69 7.420 7.420 8.724 -1.304 25277 4306 1 10 . 1 1 70 70 LEU N N 70 118.820 118.820 118.315 0.505 25277 4307 1 10 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.104 0.186 25277 4308 1 10 . 1 1 70 70 LEU C C 70 176.770 176.770 177.135 -0.365 25277 4309 1 10 . 1 1 70 70 LEU CA C 70 53.880 53.880 56.226 -2.346 25277 4310 1 10 . 1 1 70 70 LEU CB C 70 41.300 41.300 42.006 -0.706 25277 4311 1 10 . 1 1 70 70 LEU H H 70 7.690 7.690 7.584 0.106 25277 4312 1 10 . 1 1 71 71 TRP N N 71 124.110 124.110 121.554 2.556 25277 4313 1 10 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.500 0.090 25277 4314 1 10 . 1 1 71 71 TRP CA C 71 54.150 54.150 56.133 -1.983 25277 4315 1 10 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.055 0.155 25277 4316 1 10 . 1 1 71 71 TRP H H 71 8.130 8.130 7.634 0.496 25277 4317 1 10 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.282 0.298 25277 4318 1 10 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.089 0.501 25277 4319 1 10 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.730 -1.671 25277 4320 1 10 . 1 1 73 73 LEU N N 73 118.760 118.760 117.921 0.839 25277 4321 1 10 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.544 0.856 25277 4322 1 10 . 1 1 73 73 LEU C C 73 176.620 176.620 178.174 -1.554 25277 4323 1 10 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.742 -0.692 25277 4324 1 10 . 1 1 73 73 LEU CB C 73 44.260 44.260 43.075 1.185 25277 4325 1 10 . 1 1 73 73 LEU H H 73 5.190 5.190 6.517 -1.327 25277 4326 1 10 . 1 1 74 74 THR N N 74 110.120 110.120 115.078 -4.958 25277 4327 1 10 . 1 1 74 74 THR HA H 74 4.250 4.250 4.195 0.055 25277 4328 1 10 . 1 1 74 74 THR C C 74 176.080 176.080 175.651 0.429 25277 4329 1 10 . 1 1 74 74 THR CA C 74 62.690 62.690 64.174 -1.484 25277 4330 1 10 . 1 1 74 74 THR CB C 74 67.930 67.930 69.189 -1.260 25277 4331 1 10 . 1 1 74 74 THR H H 74 9.010 9.010 8.635 0.375 25277 4332 1 10 . 1 1 75 75 VAL N N 75 113.030 113.030 118.256 -5.226 25277 4333 1 10 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.150 0.660 25277 4334 1 10 . 1 1 75 75 VAL C C 75 176.010 176.010 177.314 -1.304 25277 4335 1 10 . 1 1 75 75 VAL CA C 75 59.100 59.100 62.639 -3.539 25277 4336 1 10 . 1 1 75 75 VAL CB C 75 33.220 33.220 32.413 0.807 25277 4337 1 10 . 1 1 75 75 VAL H H 75 6.660 6.660 7.593 -0.933 25277 4338 1 10 . 1 1 76 76 ASP N N 76 119.590 119.590 124.478 -4.888 25277 4339 1 10 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.685 -0.195 25277 4340 1 10 . 1 1 76 76 ASP C C 76 175.060 175.060 176.128 -1.068 25277 4341 1 10 . 1 1 76 76 ASP CA C 76 55.110 55.110 57.197 -2.087 25277 4342 1 10 . 1 1 76 76 ASP CB C 76 41.300 41.300 41.186 0.114 25277 4343 1 10 . 1 1 76 76 ASP H H 76 8.770 8.770 9.028 -0.258 25277 4344 1 10 . 1 1 77 77 HIS N N 77 113.300 113.300 112.004 1.296 25277 4345 1 10 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.712 0.378 25277 4346 1 10 . 1 1 77 77 HIS C C 77 171.370 171.370 173.857 -2.487 25277 4347 1 10 . 1 1 77 77 HIS CA C 77 55.590 55.590 54.547 1.042 25277 4348 1 10 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.599 -2.409 25277 4349 1 10 . 1 1 77 77 HIS H H 77 7.650 7.650 7.680 -0.030 25277 4350 1 10 . 1 1 78 78 GLY N N 78 101.350 101.350 105.831 -4.481 25277 4351 1 10 . 1 1 78 78 GLY C C 78 172.110 172.110 172.233 -0.123 25277 4352 1 10 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.858 -0.048 25277 4353 1 10 . 1 1 78 78 GLY H H 78 8.450 8.450 8.772 -0.322 25277 4354 1 10 . 1 1 79 79 THR N N 79 120.230 120.230 117.127 3.103 25277 4355 1 10 . 1 1 79 79 THR HA H 79 5.110 5.110 4.889 0.221 25277 4356 1 10 . 1 1 79 79 THR C C 79 172.920 172.920 173.979 -1.059 25277 4357 1 10 . 1 1 79 79 THR CA C 79 61.480 61.480 61.708 -0.228 25277 4358 1 10 . 1 1 79 79 THR CB C 79 72.130 72.130 70.481 1.649 25277 4359 1 10 . 1 1 79 79 THR H H 79 8.080 8.080 8.471 -0.391 25277 4360 1 10 . 1 1 80 80 ILE N N 80 119.620 119.620 121.085 -1.465 25277 4361 1 10 . 1 1 80 80 ILE HA H 80 5.140 5.140 4.916 0.224 25277 4362 1 10 . 1 1 80 80 ILE C C 80 174.340 174.340 174.396 -0.056 25277 4363 1 10 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.726 -0.376 25277 4364 1 10 . 1 1 80 80 ILE CB C 80 39.550 39.550 39.748 -0.198 25277 4365 1 10 . 1 1 80 80 ILE H H 80 8.970 8.970 8.670 0.300 25277 4366 1 10 . 1 1 81 81 GLU N N 81 119.960 119.960 124.478 -4.518 25277 4367 1 10 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.125 -0.125 25277 4368 1 10 . 1 1 81 81 GLU C C 81 176.130 176.130 175.098 1.032 25277 4369 1 10 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.800 -0.240 25277 4370 1 10 . 1 1 81 81 GLU CB C 81 33.390 33.390 34.968 -1.578 25277 4371 1 10 . 1 1 81 81 GLU H H 81 8.350 8.350 8.268 0.082 25277 4372 1 10 . 1 1 82 82 CYS N N 82 123.110 123.110 121.955 1.155 25277 4373 1 10 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.020 -0.090 25277 4374 1 10 . 1 1 82 82 CYS C C 82 174.430 174.430 174.462 -0.032 25277 4375 1 10 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.092 -4.852 25277 4376 1 10 . 1 1 82 82 CYS CB C 82 43.720 43.720 26.601 17.119 25277 4377 1 10 . 1 1 82 82 CYS H H 82 8.220 8.220 8.400 -0.180 25277 4378 1 10 . 1 1 83 83 LEU N N 83 131.660 131.660 126.006 5.654 25277 4379 1 10 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.769 -0.239 25277 4380 1 10 . 1 1 83 83 LEU CA C 83 53.900 53.900 52.555 1.345 25277 4381 1 10 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.526 -2.326 25277 4382 1 10 . 1 1 83 83 LEU H H 83 8.910 8.910 7.912 0.998 25277 4383 1 10 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.287 0.083 25277 4384 1 10 . 1 1 84 84 PRO CA C 84 63.190 63.190 64.975 -1.785 25277 4385 1 10 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.797 0.133 25277 4386 1 10 . 1 1 85 85 SER N N 85 117.620 117.620 113.735 3.885 25277 4387 1 10 . 1 1 85 85 SER HA H 85 3.870 3.870 4.461 -0.591 25277 4388 1 10 . 1 1 85 85 SER C C 85 174.350 174.350 174.014 0.336 25277 4389 1 10 . 1 1 85 85 SER CA C 85 58.970 58.970 58.859 0.111 25277 4390 1 10 . 1 1 85 85 SER CB C 85 63.820 63.820 63.129 0.691 25277 4391 1 10 . 1 1 85 85 SER H H 85 7.660 7.660 8.217 -0.557 25277 4392 1 10 . 1 1 86 86 ASP N N 86 117.590 117.590 118.077 -0.487 25277 4393 1 10 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.329 -0.189 25277 4394 1 10 . 1 1 86 86 ASP C C 86 174.480 174.480 174.013 0.467 25277 4395 1 10 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.723 -0.743 25277 4396 1 10 . 1 1 86 86 ASP CB C 86 37.850 37.850 38.736 -0.886 25277 4397 1 10 . 1 1 86 86 ASP H H 86 8.490 8.490 8.383 0.107 25277 4398 1 10 . 1 1 87 87 ASN N N 87 117.160 117.160 113.594 3.566 25277 4399 1 10 . 1 1 87 87 ASN HA H 87 4.530 4.530 5.110 -0.580 25277 4400 1 10 . 1 1 87 87 ASN CA C 87 52.480 52.480 51.687 0.793 25277 4401 1 10 . 1 1 87 87 ASN CB C 87 40.040 40.040 41.455 -1.415 25277 4402 1 10 . 1 1 87 87 ASN H H 87 7.260 7.260 7.616 -0.356 25277 4403 1 10 . 1 1 88 88 ALA HA H 88 4.730 4.730 4.681 0.049 25277 4404 1 10 . 1 1 88 88 ALA C C 88 174.620 174.620 176.230 -1.610 25277 4405 1 10 . 1 1 88 88 ALA CA C 88 51.230 51.230 50.830 0.400 25277 4406 1 10 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.346 0.195 25277 4407 1 10 . 1 1 89 89 VAL N N 89 116.580 116.580 118.587 -2.007 25277 4408 1 10 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.066 0.034 25277 4409 1 10 . 1 1 89 89 VAL C C 89 172.750 172.750 173.490 -0.740 25277 4410 1 10 . 1 1 89 89 VAL CA C 89 58.980 58.980 58.995 -0.015 25277 4411 1 10 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.284 0.936 25277 4412 1 10 . 1 1 89 89 VAL H H 89 8.740 8.740 8.298 0.442 25277 4413 1 10 . 1 1 90 90 PHE N N 90 120.300 120.300 123.396 -3.096 25277 4414 1 10 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.039 0.111 25277 4415 1 10 . 1 1 90 90 PHE C C 90 172.910 172.910 173.618 -0.708 25277 4416 1 10 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.510 0.290 25277 4417 1 10 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.322 1.328 25277 4418 1 10 . 1 1 90 90 PHE H H 90 8.950 8.950 9.028 -0.078 25277 4419 1 10 . 1 1 91 91 VAL N N 91 129.020 129.020 127.954 1.066 25277 4420 1 10 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.650 -0.190 25277 4421 1 10 . 1 1 91 91 VAL C C 91 175.910 175.910 174.133 1.777 25277 4422 1 10 . 1 1 91 91 VAL CA C 91 60.780 60.780 59.485 1.295 25277 4423 1 10 . 1 1 91 91 VAL CB C 91 32.020 32.020 33.338 -1.318 25277 4424 1 10 . 1 1 91 91 VAL H H 91 9.090 9.090 8.618 0.472 25277 4425 1 10 . 1 1 92 92 ALA N N 92 129.760 129.760 129.976 -0.216 25277 4426 1 10 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.724 -0.224 25277 4427 1 10 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.682 2.168 25277 4428 1 10 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.578 -1.528 25277 4429 1 10 . 1 1 92 92 ALA H H 92 8.680 8.680 8.426 0.254 25277 4430 1 10 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.067 0.093 25277 4431 1 10 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.074 0.326 25277 4432 1 10 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.607 0.333 25277 4433 1 10 . 1 1 94 94 ASP N N 94 113.220 113.220 114.955 -1.735 25277 4434 1 10 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.465 -0.045 25277 4435 1 10 . 1 1 94 94 ASP C C 94 176.980 176.980 177.476 -0.496 25277 4436 1 10 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.980 -0.451 25277 4437 1 10 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.853 -0.273 25277 4438 1 10 . 1 1 94 94 ASP H H 94 7.890 7.890 7.801 0.089 25277 4439 1 10 . 1 1 95 95 GLY N N 95 109.120 109.120 108.586 0.534 25277 4440 1 10 . 1 1 95 95 GLY C C 95 174.440 174.440 174.362 0.078 25277 4441 1 10 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.065 -0.505 25277 4442 1 10 . 1 1 95 95 GLY H H 95 8.500 8.500 8.151 0.349 25277 4443 1 10 . 1 1 96 96 THR N N 96 120.350 120.350 117.966 2.384 25277 4444 1 10 . 1 1 96 96 THR HA H 96 3.780 3.780 4.392 -0.612 25277 4445 1 10 . 1 1 96 96 THR C C 96 172.590 172.590 173.457 -0.867 25277 4446 1 10 . 1 1 96 96 THR CA C 96 64.660 64.660 62.494 2.166 25277 4447 1 10 . 1 1 96 96 THR CB C 96 68.330 68.330 70.146 -1.816 25277 4448 1 10 . 1 1 96 96 THR H H 96 8.100 8.100 8.465 -0.365 25277 4449 1 10 . 1 1 97 97 THR N N 97 122.660 122.660 121.582 1.078 25277 4450 1 10 . 1 1 97 97 THR HA H 97 4.590 4.590 4.717 -0.127 25277 4451 1 10 . 1 1 97 97 THR C C 97 173.000 173.000 173.414 -0.414 25277 4452 1 10 . 1 1 97 97 THR CA C 97 62.700 62.700 61.832 0.868 25277 4453 1 10 . 1 1 97 97 THR CB C 97 68.840 68.840 69.874 -1.034 25277 4454 1 10 . 1 1 97 97 THR H H 97 7.850 7.850 8.432 -0.582 25277 4455 1 10 . 1 1 98 98 TYR N N 98 122.890 122.890 125.475 -2.585 25277 4456 1 10 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.241 -0.301 25277 4457 1 10 . 1 1 98 98 TYR C C 98 178.970 178.970 174.781 4.189 25277 4458 1 10 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.183 0.327 25277 4459 1 10 . 1 1 98 98 TYR CB C 98 42.950 42.950 41.963 0.987 25277 4460 1 10 . 1 1 98 98 TYR H H 98 9.460 9.460 9.181 0.279 25277 4461 1 10 . 1 1 99 99 ALA N N 99 121.760 121.760 123.728 -1.968 25277 4462 1 10 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.633 -0.523 25277 4463 1 10 . 1 1 99 99 ALA C C 99 178.010 178.010 176.356 1.654 25277 4464 1 10 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.187 1.083 25277 4465 1 10 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.661 2.389 25277 4466 1 10 . 1 1 99 99 ALA H H 99 9.110 9.110 8.880 0.230 25277 4467 1 10 . 1 1 100 100 LEU N N 100 119.330 119.330 124.381 -5.051 25277 4468 1 10 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.257 0.213 25277 4469 1 10 . 1 1 100 100 LEU C C 100 174.720 174.720 177.204 -2.484 25277 4470 1 10 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.840 -2.700 25277 4471 1 10 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.659 1.971 25277 4472 1 10 . 1 1 100 100 LEU H H 100 8.950 8.950 8.419 0.531 25277 4473 1 10 . 1 1 101 101 ASN N N 101 112.600 112.600 115.752 -3.152 25277 4474 1 10 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.909 0.011 25277 4475 1 10 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.461 -1.531 25277 4476 1 10 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.641 0.959 25277 4477 1 10 . 1 1 101 101 ASN H H 101 7.550 7.550 7.745 -0.195 25277 4478 1 10 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.343 -0.152 25277 4479 1 10 . 1 1 102 102 ASP C C 102 178.770 178.770 178.501 0.269 25277 4480 1 10 . 1 1 102 102 ASP CA C 102 56.880 56.880 58.074 -1.194 25277 4481 1 10 . 1 1 102 102 ASP CB C 102 39.980 39.980 40.520 -0.540 25277 4482 1 10 . 1 1 103 103 ARG N N 103 119.370 119.370 119.702 -0.332 25277 4483 1 10 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.049 -0.219 25277 4484 1 10 . 1 1 103 103 ARG C C 103 178.550 178.550 178.422 0.128 25277 4485 1 10 . 1 1 103 103 ARG CA C 103 59.380 59.380 58.867 0.513 25277 4486 1 10 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.965 -0.465 25277 4487 1 10 . 1 1 103 103 ARG H H 103 7.970 7.970 8.250 -0.280 25277 4488 1 10 . 1 1 104 104 ALA N N 104 120.110 120.110 121.701 -1.591 25277 4489 1 10 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.086 0.124 25277 4490 1 10 . 1 1 104 104 ALA C C 104 179.510 179.510 179.576 -0.066 25277 4491 1 10 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.319 -0.569 25277 4492 1 10 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.296 1.374 25277 4493 1 10 . 1 1 104 104 ALA H H 104 7.610 7.610 8.544 -0.934 25277 4494 1 10 . 1 1 105 105 GLU N N 105 120.460 120.460 118.456 2.004 25277 4495 1 10 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.157 0.553 25277 4496 1 10 . 1 1 105 105 GLU C C 105 181.710 181.710 179.952 1.758 25277 4497 1 10 . 1 1 105 105 GLU CA C 105 58.680 58.680 58.806 -0.126 25277 4498 1 10 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.257 0.233 25277 4499 1 10 . 1 1 105 105 GLU H H 105 7.750 7.750 7.812 -0.062 25277 4500 1 10 . 1 1 106 106 LYS N N 106 121.980 121.980 120.149 1.831 25277 4501 1 10 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.093 -0.073 25277 4502 1 10 . 1 1 106 106 LYS C C 106 177.890 177.890 178.552 -0.662 25277 4503 1 10 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.742 -0.272 25277 4504 1 10 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.089 -0.359 25277 4505 1 10 . 1 1 106 106 LYS H H 106 8.380 8.380 8.055 0.325 25277 4506 1 10 . 1 1 107 107 ALA N N 107 119.850 119.850 119.423 0.427 25277 4507 1 10 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.286 -0.026 25277 4508 1 10 . 1 1 107 107 ALA C C 107 177.210 177.210 177.789 -0.579 25277 4509 1 10 . 1 1 107 107 ALA CA C 107 52.270 52.270 52.185 0.085 25277 4510 1 10 . 1 1 107 107 ALA CB C 107 18.740 18.740 18.821 -0.081 25277 4511 1 10 . 1 1 107 107 ALA H H 107 7.400 7.400 7.645 -0.245 25277 4512 1 10 . 1 1 108 108 GLY N N 108 104.560 104.560 105.783 -1.223 25277 4513 1 10 . 1 1 108 108 GLY C C 108 174.300 174.300 174.455 -0.155 25277 4514 1 10 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.012 -0.402 25277 4515 1 10 . 1 1 108 108 GLY H H 108 7.560 7.560 7.803 -0.243 25277 4516 1 10 . 1 1 109 109 HIS N N 109 122.550 122.550 120.656 1.894 25277 4517 1 10 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.937 -0.167 25277 4518 1 10 . 1 1 109 109 HIS CA C 109 54.580 54.580 54.578 0.002 25277 4519 1 10 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.910 -1.320 25277 4520 1 10 . 1 1 109 109 HIS H H 109 7.590 7.590 7.705 -0.115 25277 4521 1 10 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.908 -0.348 25277 4522 1 10 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.269 0.461 25277 4523 1 10 . 1 1 111 111 PRO CB C 111 32.800 32.800 33.184 -0.384 25277 4524 1 10 . 1 1 112 112 ILE N N 112 119.770 119.770 119.480 0.290 25277 4525 1 10 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.489 0.371 25277 4526 1 10 . 1 1 112 112 ILE C C 112 172.800 172.800 177.578 -4.778 25277 4527 1 10 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.358 -2.168 25277 4528 1 10 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.323 3.117 25277 4529 1 10 . 1 1 112 112 ILE H H 112 7.890 7.890 8.333 -0.443 25277 4530 1 10 . 1 1 113 113 THR N N 113 113.610 113.610 116.165 -2.555 25277 4531 1 10 . 1 1 113 113 THR HA H 113 3.010 3.010 3.933 -0.923 25277 4532 1 10 . 1 1 113 113 THR CA C 113 66.860 66.860 68.442 -1.582 25277 4533 1 10 . 1 1 113 113 THR CB C 113 66.920 66.920 67.616 -0.696 25277 4534 1 10 . 1 1 113 113 THR H H 113 7.070 7.070 8.523 -1.453 25277 4535 1 10 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.343 -0.003 25277 4536 1 10 . 1 1 114 114 PRO CA C 114 66.080 66.080 64.942 1.138 25277 4537 1 10 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.598 0.483 25277 4538 1 10 . 1 1 115 115 ILE N N 115 134.770 134.770 110.048 24.722 25277 4539 1 10 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.378 0.232 25277 4540 1 10 . 1 1 115 115 ILE C C 115 174.800 174.800 174.906 -0.106 25277 4541 1 10 . 1 1 115 115 ILE CA C 115 60.000 60.000 59.889 0.111 25277 4542 1 10 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.564 0.296 25277 4543 1 10 . 1 1 115 115 ILE H H 115 7.510 7.510 7.594 -0.084 25277 4544 1 10 . 1 1 116 116 ARG N N 116 120.890 120.890 122.285 -1.395 25277 4545 1 10 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.119 -0.149 25277 4546 1 10 . 1 1 116 116 ARG C C 116 174.910 174.910 175.772 -0.862 25277 4547 1 10 . 1 1 116 116 ARG CA C 116 57.780 57.780 55.940 1.840 25277 4548 1 10 . 1 1 116 116 ARG CB C 116 31.870 31.870 31.310 0.560 25277 4549 1 10 . 1 1 116 116 ARG H H 116 7.280 7.280 7.505 -0.225 25277 4550 1 10 . 1 1 117 117 ALA N N 117 125.400 125.400 128.347 -2.947 25277 4551 1 10 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.352 -0.122 25277 4552 1 10 . 1 1 117 117 ALA C C 117 176.290 176.290 175.658 0.632 25277 4553 1 10 . 1 1 117 117 ALA CA C 117 50.780 50.780 51.302 -0.522 25277 4554 1 10 . 1 1 117 117 ALA CB C 117 20.290 20.290 20.672 -0.382 25277 4555 1 10 . 1 1 117 117 ALA H H 117 8.150 8.150 8.353 -0.203 25277 4556 1 10 . 1 1 118 118 LYS N N 118 119.890 119.890 122.575 -2.685 25277 4557 1 10 . 1 1 118 118 LYS HA H 118 4.590 4.590 3.927 0.663 25277 4558 1 10 . 1 1 118 118 LYS C C 118 177.400 177.400 176.269 1.131 25277 4559 1 10 . 1 1 118 118 LYS CA C 118 55.670 55.670 55.001 0.669 25277 4560 1 10 . 1 1 118 118 LYS CB C 118 34.510 34.510 33.946 0.564 25277 4561 1 10 . 1 1 118 118 LYS H H 118 8.360 8.360 8.222 0.138 25277 4562 1 10 . 1 1 119 119 GLY N N 119 108.630 108.630 111.629 -2.999 25277 4563 1 10 . 1 1 119 119 GLY CA C 119 43.610 43.610 44.237 -0.627 25277 4564 1 10 . 1 1 119 119 GLY H H 119 8.320 8.320 8.144 0.176 25277 4565 1 10 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.750 0.150 25277 4566 1 10 . 1 1 124 124 TYR C C 124 177.430 177.430 175.993 1.437 25277 4567 1 10 . 1 1 124 124 TYR CA C 124 57.970 57.970 57.053 0.917 25277 4568 1 10 . 1 1 124 124 TYR CB C 124 38.650 38.650 40.669 -2.019 25277 4569 1 10 . 1 1 125 125 ILE N N 125 123.670 123.670 123.806 -0.136 25277 4570 1 10 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.106 -0.266 25277 4571 1 10 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.514 0.216 25277 4572 1 10 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.350 0.160 25277 4573 1 10 . 1 1 125 125 ILE H H 125 8.340 8.340 8.089 0.251 25277 4574 1 10 . 1 1 126 126 SER HA H 126 4.070 4.070 4.324 -0.254 25277 4575 1 10 . 1 1 126 126 SER C C 126 176.290 176.290 174.989 1.301 25277 4576 1 10 . 1 1 126 126 SER CA C 126 59.190 59.190 59.328 -0.138 25277 4577 1 10 . 1 1 126 126 SER CB C 126 63.200 63.200 63.737 -0.537 25277 4578 1 10 . 1 1 127 127 LEU N N 127 127.030 127.030 124.255 2.775 25277 4579 1 10 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.332 -0.392 25277 4580 1 10 . 1 1 127 127 LEU C C 127 176.660 176.660 178.171 -1.511 25277 4581 1 10 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.648 0.462 25277 4582 1 10 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.540 1.390 25277 4583 1 10 . 1 1 127 127 LEU H H 127 8.790 8.790 8.367 0.423 25277 4584 1 10 . 1 1 128 128 GLY N N 128 106.600 106.600 108.879 -2.279 25277 4585 1 10 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.589 0.941 25277 4586 1 10 . 1 1 128 128 GLY H H 128 8.450 8.450 8.305 0.145 25277 4587 1 10 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.021 0.209 25277 4588 1 10 . 1 1 129 129 ALA C C 129 180.410 180.410 179.204 1.206 25277 4589 1 10 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.612 0.308 25277 4590 1 10 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.278 0.852 25277 4591 1 10 . 1 1 130 130 LEU N N 130 122.550 122.550 120.523 2.027 25277 4592 1 10 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.024 -0.104 25277 4593 1 10 . 1 1 130 130 LEU C C 130 179.020 179.020 178.471 0.549 25277 4594 1 10 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.416 0.214 25277 4595 1 10 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.612 0.528 25277 4596 1 10 . 1 1 130 130 LEU H H 130 8.040 8.040 7.438 0.602 25277 4597 1 10 . 1 1 131 131 LEU N N 131 121.910 121.910 119.424 2.486 25277 4598 1 10 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.864 0.056 25277 4599 1 10 . 1 1 131 131 LEU C C 131 177.910 177.910 178.447 -0.537 25277 4600 1 10 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.142 0.428 25277 4601 1 10 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.531 -0.811 25277 4602 1 10 . 1 1 131 131 LEU H H 131 9.060 9.060 7.864 1.196 25277 4603 1 10 . 1 1 132 132 SER N N 132 115.530 115.530 115.001 0.529 25277 4604 1 10 . 1 1 132 132 SER HA H 132 3.970 3.970 4.076 -0.106 25277 4605 1 10 . 1 1 132 132 SER C C 132 177.140 177.140 176.813 0.327 25277 4606 1 10 . 1 1 132 132 SER CA C 132 62.340 62.340 62.285 0.055 25277 4607 1 10 . 1 1 132 132 SER CB C 132 62.370 62.370 62.878 -0.508 25277 4608 1 10 . 1 1 132 132 SER H H 132 8.730 8.730 8.104 0.626 25277 4609 1 10 . 1 1 133 133 THR N N 133 116.960 116.960 119.085 -2.125 25277 4610 1 10 . 1 1 133 133 THR HA H 133 3.860 3.860 3.997 -0.137 25277 4611 1 10 . 1 1 133 133 THR C C 133 175.670 175.670 176.777 -1.107 25277 4612 1 10 . 1 1 133 133 THR CA C 133 66.930 66.930 67.091 -0.161 25277 4613 1 10 . 1 1 133 133 THR CB C 133 68.880 68.880 68.790 0.090 25277 4614 1 10 . 1 1 133 133 THR H H 133 7.750 7.750 7.764 -0.014 25277 4615 1 10 . 1 1 134 134 THR N N 134 118.830 118.830 119.205 -0.375 25277 4616 1 10 . 1 1 134 134 THR HA H 134 3.780 3.780 3.991 -0.211 25277 4617 1 10 . 1 1 134 134 THR C C 134 176.750 176.750 176.308 0.442 25277 4618 1 10 . 1 1 134 134 THR CA C 134 67.650 67.650 67.456 0.194 25277 4619 1 10 . 1 1 134 134 THR CB C 134 67.560 67.560 68.761 -1.201 25277 4620 1 10 . 1 1 134 134 THR H H 134 7.570 7.570 7.734 -0.164 25277 4621 1 10 . 1 1 135 135 LEU N N 135 121.420 121.420 121.805 -0.385 25277 4622 1 10 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.929 0.561 25277 4623 1 10 . 1 1 135 135 LEU C C 135 180.050 180.050 178.629 1.421 25277 4624 1 10 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.233 -1.222 25277 4625 1 10 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.524 -0.914 25277 4626 1 10 . 1 1 135 135 LEU H H 135 8.650 8.650 8.123 0.527 25277 4627 1 10 . 1 1 136 136 ASN N N 136 117.010 117.010 117.481 -0.471 25277 4628 1 10 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.463 0.077 25277 4629 1 10 . 1 1 136 136 ASN C C 136 175.980 175.980 177.877 -1.897 25277 4630 1 10 . 1 1 136 136 ASN CA C 136 54.770 54.770 55.726 -0.956 25277 4631 1 10 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.272 0.168 25277 4632 1 10 . 1 1 136 136 ASN H H 136 7.360 7.360 7.790 -0.430 25277 4633 1 10 . 1 1 137 137 LEU N N 137 116.940 116.940 120.703 -3.763 25277 4634 1 10 . 1 1 137 137 LEU HA H 137 4.160 4.160 3.995 0.165 25277 4635 1 10 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.795 -2.365 25277 4636 1 10 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.602 -0.033 25277 4637 1 10 . 1 1 137 137 LEU H H 137 7.810 7.810 7.586 0.224 25277 4638 1 10 . 1 1 138 138 CYS N N 138 115.430 115.430 114.509 0.921 25277 4639 1 10 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.212 0.198 25277 4640 1 10 . 1 1 138 138 CYS CA C 138 55.480 55.480 60.589 -5.109 25277 4641 1 10 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.394 14.806 25277 4642 1 10 . 1 1 138 138 CYS H H 138 7.450 7.450 7.808 -0.358 25277 4643 1 10 . 1 1 139 139 GLY C C 139 178.800 178.800 174.253 4.547 25277 4644 1 10 . 1 1 139 139 GLY CA C 139 45.500 45.500 45.142 0.358 25277 4645 1 10 . 1 1 140 140 LYS N N 140 119.830 119.830 121.425 -1.595 25277 4646 1 10 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.580 -0.260 25277 4647 1 10 . 1 1 140 140 LYS C C 140 175.820 175.820 176.557 -0.737 25277 4648 1 10 . 1 1 140 140 LYS CA C 140 55.680 55.680 55.560 0.120 25277 4649 1 10 . 1 1 140 140 LYS CB C 140 32.800 32.800 33.486 -0.687 25277 4650 1 10 . 1 1 140 140 LYS H H 140 7.760 7.760 7.494 0.266 25277 4651 1 11 . 1 1 27 27 PRO CA C 27 63.230 63.230 62.242 0.988 25277 4652 1 11 . 1 1 27 27 PRO CB C 27 32.050 32.050 32.337 -0.286 25277 4653 1 11 . 1 1 28 28 ASP N N 28 120.030 120.030 119.619 0.411 25277 4654 1 11 . 1 1 28 28 ASP C C 28 176.130 176.130 176.284 -0.154 25277 4655 1 11 . 1 1 28 28 ASP CA C 28 54.170 54.170 53.904 0.266 25277 4656 1 11 . 1 1 28 28 ASP CB C 28 40.860 40.860 41.062 -0.202 25277 4657 1 11 . 1 1 28 28 ASP H H 28 8.260 8.260 8.337 -0.077 25277 4658 1 11 . 1 1 29 29 LEU N N 29 123.030 123.030 124.569 -1.539 25277 4659 1 11 . 1 1 29 29 LEU C C 29 177.870 177.870 177.417 0.453 25277 4660 1 11 . 1 1 29 29 LEU CA C 29 55.160 55.160 55.086 0.074 25277 4661 1 11 . 1 1 29 29 LEU CB C 29 42.270 42.270 42.243 0.027 25277 4662 1 11 . 1 1 29 29 LEU H H 29 8.120 8.120 8.511 -0.391 25277 4663 1 11 . 1 1 30 30 GLY N N 30 109.350 109.350 109.405 -0.055 25277 4664 1 11 . 1 1 30 30 GLY CA C 30 45.340 45.340 44.939 0.401 25277 4665 1 11 . 1 1 30 30 GLY H H 30 8.410 8.410 8.260 0.150 25277 4666 1 11 . 1 1 44 44 PRO CA C 44 63.590 63.590 62.167 1.423 25277 4667 1 11 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.101 -0.111 25277 4668 1 11 . 1 1 45 45 ALA N N 45 122.140 122.140 122.514 -0.374 25277 4669 1 11 . 1 1 45 45 ALA CA C 45 52.670 52.670 52.817 -0.147 25277 4670 1 11 . 1 1 45 45 ALA H H 45 8.350 8.350 7.970 0.380 25277 4671 1 11 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.282 0.018 25277 4672 1 11 . 1 1 49 49 PRO CA C 49 62.950 62.950 62.845 0.105 25277 4673 1 11 . 1 1 49 49 PRO CB C 49 31.990 31.990 32.270 -0.280 25277 4674 1 11 . 1 1 50 50 VAL N N 50 124.190 124.190 121.687 2.503 25277 4675 1 11 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.365 -0.045 25277 4676 1 11 . 1 1 50 50 VAL CA C 50 59.850 59.850 59.887 -0.037 25277 4677 1 11 . 1 1 50 50 VAL CB C 50 32.480 32.480 32.258 0.222 25277 4678 1 11 . 1 1 50 50 VAL H H 50 8.070 8.070 8.285 -0.215 25277 4679 1 11 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.253 0.097 25277 4680 1 11 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.260 -0.329 25277 4681 1 11 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.064 -0.084 25277 4682 1 11 . 1 1 52 52 LEU N N 52 124.500 124.500 122.135 2.365 25277 4683 1 11 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.285 0.205 25277 4684 1 11 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.749 -0.859 25277 4685 1 11 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.819 0.370 25277 4686 1 11 . 1 1 52 52 LEU H H 52 8.360 8.360 8.219 0.141 25277 4687 1 11 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.544 -0.134 25277 4688 1 11 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.373 -0.043 25277 4689 1 11 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.254 -0.264 25277 4690 1 11 . 1 1 54 54 SER N N 54 117.380 117.380 117.128 0.252 25277 4691 1 11 . 1 1 54 54 SER HA H 54 4.600 4.600 4.425 0.175 25277 4692 1 11 . 1 1 54 54 SER CA C 54 56.710 56.710 58.084 -1.374 25277 4693 1 11 . 1 1 54 54 SER CB C 54 62.500 62.500 63.260 -0.760 25277 4694 1 11 . 1 1 54 54 SER H H 54 8.400 8.400 8.353 0.047 25277 4695 1 11 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.529 0.021 25277 4696 1 11 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.481 0.059 25277 4697 1 11 . 1 1 55 55 PRO CB C 55 32.620 32.620 31.921 0.699 25277 4698 1 11 . 1 1 57 57 SER HA H 57 4.420 4.420 4.341 0.079 25277 4699 1 11 . 1 1 57 57 SER CA C 57 57.580 57.580 59.954 -2.374 25277 4700 1 11 . 1 1 57 57 SER CB C 57 63.780 63.780 63.260 0.520 25277 4701 1 11 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.203 0.787 25277 4702 1 11 . 1 1 58 58 ASN C C 58 172.230 172.230 173.777 -1.547 25277 4703 1 11 . 1 1 58 58 ASN CA C 58 53.670 53.670 54.748 -1.078 25277 4704 1 11 . 1 1 58 58 ASN CB C 58 37.850 37.850 37.154 0.696 25277 4705 1 11 . 1 1 59 59 LYS N N 59 117.660 117.660 118.604 -0.944 25277 4706 1 11 . 1 1 59 59 LYS HA H 59 5.360 5.360 5.015 0.345 25277 4707 1 11 . 1 1 59 59 LYS C C 59 175.120 175.120 173.917 1.203 25277 4708 1 11 . 1 1 59 59 LYS CA C 59 54.860 54.860 56.001 -1.141 25277 4709 1 11 . 1 1 59 59 LYS CB C 59 36.450 36.450 36.210 0.240 25277 4710 1 11 . 1 1 59 59 LYS H H 59 7.640 7.640 7.701 -0.061 25277 4711 1 11 . 1 1 60 60 GLN N N 60 120.680 120.680 121.421 -0.741 25277 4712 1 11 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.674 -0.184 25277 4713 1 11 . 1 1 60 60 GLN C C 60 173.640 173.640 173.398 0.242 25277 4714 1 11 . 1 1 60 60 GLN CA C 60 55.480 55.480 54.555 0.925 25277 4715 1 11 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.131 -0.141 25277 4716 1 11 . 1 1 60 60 GLN H H 60 8.930 8.930 8.371 0.559 25277 4717 1 11 . 1 1 61 61 ASP N N 61 126.170 126.170 121.438 4.732 25277 4718 1 11 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.836 0.214 25277 4719 1 11 . 1 1 61 61 ASP C C 61 175.000 175.000 175.209 -0.209 25277 4720 1 11 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.368 0.512 25277 4721 1 11 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.521 -0.751 25277 4722 1 11 . 1 1 61 61 ASP H H 61 8.540 8.540 8.595 -0.055 25277 4723 1 11 . 1 1 62 62 ILE N N 62 121.100 121.100 125.258 -4.158 25277 4724 1 11 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.576 0.204 25277 4725 1 11 . 1 1 62 62 ILE C C 62 171.480 171.480 173.608 -2.128 25277 4726 1 11 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.515 0.575 25277 4727 1 11 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.371 0.769 25277 4728 1 11 . 1 1 62 62 ILE H H 62 8.970 8.970 8.432 0.538 25277 4729 1 11 . 1 1 63 63 SER N N 63 119.430 119.430 121.473 -2.043 25277 4730 1 11 . 1 1 63 63 SER HA H 63 4.680 4.680 4.536 0.144 25277 4731 1 11 . 1 1 63 63 SER C C 63 174.030 174.030 174.405 -0.375 25277 4732 1 11 . 1 1 63 63 SER CA C 63 56.550 56.550 56.282 0.267 25277 4733 1 11 . 1 1 63 63 SER CB C 63 67.320 67.320 65.961 1.359 25277 4734 1 11 . 1 1 63 63 SER H H 63 8.520 8.520 7.927 0.593 25277 4735 1 11 . 1 1 64 64 GLU N N 64 121.250 121.250 119.945 1.305 25277 4736 1 11 . 1 1 64 64 GLU HA H 64 2.770 2.770 2.987 -0.217 25277 4737 1 11 . 1 1 64 64 GLU C C 64 177.190 177.190 177.878 -0.688 25277 4738 1 11 . 1 1 64 64 GLU CA C 64 58.590 58.590 58.833 -0.243 25277 4739 1 11 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.639 -0.499 25277 4740 1 11 . 1 1 64 64 GLU H H 64 7.400 7.400 7.567 -0.167 25277 4741 1 11 . 1 1 65 65 ALA N N 65 119.250 119.250 122.080 -2.830 25277 4742 1 11 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.919 -0.059 25277 4743 1 11 . 1 1 65 65 ALA C C 65 179.630 179.630 179.246 0.384 25277 4744 1 11 . 1 1 65 65 ALA CA C 65 53.810 53.810 54.760 -0.950 25277 4745 1 11 . 1 1 65 65 ALA CB C 65 18.400 18.400 18.037 0.363 25277 4746 1 11 . 1 1 65 65 ALA H H 65 7.700 7.700 8.284 -0.584 25277 4747 1 11 . 1 1 66 66 ASN N N 66 112.360 112.360 115.962 -3.602 25277 4748 1 11 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.486 0.544 25277 4749 1 11 . 1 1 66 66 ASN C C 66 174.580 174.580 177.471 -2.891 25277 4750 1 11 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.560 -0.010 25277 4751 1 11 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.517 1.413 25277 4752 1 11 . 1 1 66 66 ASN H H 66 7.960 7.960 7.431 0.529 25277 4753 1 11 . 1 1 67 67 LEU N N 67 115.390 115.390 118.787 -3.397 25277 4754 1 11 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.204 0.446 25277 4755 1 11 . 1 1 67 67 LEU C C 67 176.500 176.500 176.989 -0.489 25277 4756 1 11 . 1 1 67 67 LEU CA C 67 54.350 54.350 56.291 -1.940 25277 4757 1 11 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.037 2.633 25277 4758 1 11 . 1 1 67 67 LEU H H 67 7.050 7.050 7.627 -0.577 25277 4759 1 11 . 1 1 68 68 ALA N N 68 125.680 125.680 120.619 5.061 25277 4760 1 11 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.894 -0.004 25277 4761 1 11 . 1 1 68 68 ALA C C 68 177.480 177.480 178.128 -0.648 25277 4762 1 11 . 1 1 68 68 ALA CA C 68 53.550 53.550 53.605 -0.055 25277 4763 1 11 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.233 -0.083 25277 4764 1 11 . 1 1 68 68 ALA H H 68 8.880 8.880 8.018 0.862 25277 4765 1 11 . 1 1 69 69 TYR N N 69 119.780 119.780 122.053 -2.273 25277 4766 1 11 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.263 0.227 25277 4767 1 11 . 1 1 69 69 TYR C C 69 175.340 175.340 176.647 -1.307 25277 4768 1 11 . 1 1 69 69 TYR CA C 69 58.640 58.640 60.850 -2.210 25277 4769 1 11 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.337 -1.057 25277 4770 1 11 . 1 1 69 69 TYR H H 69 7.420 7.420 8.723 -1.303 25277 4771 1 11 . 1 1 70 70 LEU N N 70 118.820 118.820 117.438 1.382 25277 4772 1 11 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.090 0.200 25277 4773 1 11 . 1 1 70 70 LEU C C 70 176.770 176.770 177.304 -0.534 25277 4774 1 11 . 1 1 70 70 LEU CA C 70 53.880 53.880 56.571 -2.691 25277 4775 1 11 . 1 1 70 70 LEU CB C 70 41.300 41.300 41.875 -0.575 25277 4776 1 11 . 1 1 70 70 LEU H H 70 7.690 7.690 7.518 0.172 25277 4777 1 11 . 1 1 71 71 TRP N N 71 124.110 124.110 121.889 2.221 25277 4778 1 11 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.485 0.105 25277 4779 1 11 . 1 1 71 71 TRP CA C 71 54.150 54.150 56.098 -1.948 25277 4780 1 11 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.353 -0.143 25277 4781 1 11 . 1 1 71 71 TRP H H 71 8.130 8.130 7.624 0.506 25277 4782 1 11 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.261 0.319 25277 4783 1 11 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.138 0.452 25277 4784 1 11 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.689 -1.629 25277 4785 1 11 . 1 1 73 73 LEU N N 73 118.760 118.760 117.694 1.066 25277 4786 1 11 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.541 0.859 25277 4787 1 11 . 1 1 73 73 LEU C C 73 176.620 176.620 178.291 -1.671 25277 4788 1 11 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.726 -0.676 25277 4789 1 11 . 1 1 73 73 LEU CB C 73 44.260 44.260 43.035 1.226 25277 4790 1 11 . 1 1 73 73 LEU H H 73 5.190 5.190 6.578 -1.388 25277 4791 1 11 . 1 1 74 74 THR N N 74 110.120 110.120 115.225 -5.105 25277 4792 1 11 . 1 1 74 74 THR HA H 74 4.250 4.250 4.178 0.072 25277 4793 1 11 . 1 1 74 74 THR C C 74 176.080 176.080 175.478 0.602 25277 4794 1 11 . 1 1 74 74 THR CA C 74 62.690 62.690 64.038 -1.348 25277 4795 1 11 . 1 1 74 74 THR CB C 74 67.930 67.930 69.138 -1.208 25277 4796 1 11 . 1 1 74 74 THR H H 74 9.010 9.010 8.593 0.417 25277 4797 1 11 . 1 1 75 75 VAL N N 75 113.030 113.030 119.055 -6.025 25277 4798 1 11 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.260 0.550 25277 4799 1 11 . 1 1 75 75 VAL C C 75 176.010 176.010 177.143 -1.133 25277 4800 1 11 . 1 1 75 75 VAL CA C 75 59.100 59.100 62.713 -3.613 25277 4801 1 11 . 1 1 75 75 VAL CB C 75 33.220 33.220 32.731 0.489 25277 4802 1 11 . 1 1 75 75 VAL H H 75 6.660 6.660 7.561 -0.901 25277 4803 1 11 . 1 1 76 76 ASP N N 76 119.590 119.590 123.764 -4.174 25277 4804 1 11 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.659 -0.169 25277 4805 1 11 . 1 1 76 76 ASP C C 76 175.060 175.060 176.204 -1.144 25277 4806 1 11 . 1 1 76 76 ASP CA C 76 55.110 55.110 57.084 -1.974 25277 4807 1 11 . 1 1 76 76 ASP CB C 76 41.300 41.300 41.102 0.198 25277 4808 1 11 . 1 1 76 76 ASP H H 76 8.770 8.770 9.038 -0.268 25277 4809 1 11 . 1 1 77 77 HIS N N 77 113.300 113.300 112.071 1.229 25277 4810 1 11 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.719 0.371 25277 4811 1 11 . 1 1 77 77 HIS C C 77 171.370 171.370 173.866 -2.496 25277 4812 1 11 . 1 1 77 77 HIS CA C 77 55.590 55.590 54.543 1.047 25277 4813 1 11 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.614 -2.424 25277 4814 1 11 . 1 1 77 77 HIS H H 77 7.650 7.650 7.679 -0.029 25277 4815 1 11 . 1 1 78 78 GLY N N 78 101.350 101.350 105.328 -3.978 25277 4816 1 11 . 1 1 78 78 GLY C C 78 172.110 172.110 172.405 -0.295 25277 4817 1 11 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.812 -0.002 25277 4818 1 11 . 1 1 78 78 GLY H H 78 8.450 8.450 8.730 -0.280 25277 4819 1 11 . 1 1 79 79 THR N N 79 120.230 120.230 116.951 3.279 25277 4820 1 11 . 1 1 79 79 THR HA H 79 5.110 5.110 4.907 0.203 25277 4821 1 11 . 1 1 79 79 THR C C 79 172.920 172.920 173.766 -0.846 25277 4822 1 11 . 1 1 79 79 THR CA C 79 61.480 61.480 62.032 -0.552 25277 4823 1 11 . 1 1 79 79 THR CB C 79 72.130 72.130 70.830 1.300 25277 4824 1 11 . 1 1 79 79 THR H H 79 8.080 8.080 8.485 -0.405 25277 4825 1 11 . 1 1 80 80 ILE N N 80 119.620 119.620 120.109 -0.489 25277 4826 1 11 . 1 1 80 80 ILE HA H 80 5.140 5.140 4.954 0.186 25277 4827 1 11 . 1 1 80 80 ILE C C 80 174.340 174.340 173.992 0.348 25277 4828 1 11 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.362 -0.012 25277 4829 1 11 . 1 1 80 80 ILE CB C 80 39.550 39.550 40.466 -0.916 25277 4830 1 11 . 1 1 80 80 ILE H H 80 8.970 8.970 8.745 0.225 25277 4831 1 11 . 1 1 81 81 GLU N N 81 119.960 119.960 125.512 -5.552 25277 4832 1 11 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.109 -0.109 25277 4833 1 11 . 1 1 81 81 GLU C C 81 176.130 176.130 174.460 1.670 25277 4834 1 11 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.732 -0.172 25277 4835 1 11 . 1 1 81 81 GLU CB C 81 33.390 33.390 34.520 -1.130 25277 4836 1 11 . 1 1 81 81 GLU H H 81 8.350 8.350 8.323 0.027 25277 4837 1 11 . 1 1 82 82 CYS N N 82 123.110 123.110 124.546 -1.436 25277 4838 1 11 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.137 -0.207 25277 4839 1 11 . 1 1 82 82 CYS C C 82 174.430 174.430 174.983 -0.553 25277 4840 1 11 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.142 -4.902 25277 4841 1 11 . 1 1 82 82 CYS CB C 82 43.720 43.720 26.963 16.757 25277 4842 1 11 . 1 1 82 82 CYS H H 82 8.220 8.220 8.390 -0.170 25277 4843 1 11 . 1 1 83 83 LEU N N 83 131.660 131.660 127.565 4.095 25277 4844 1 11 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.690 -0.160 25277 4845 1 11 . 1 1 83 83 LEU CA C 83 53.900 53.900 53.147 0.753 25277 4846 1 11 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.702 -2.502 25277 4847 1 11 . 1 1 83 83 LEU H H 83 8.910 8.910 8.299 0.611 25277 4848 1 11 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.278 0.092 25277 4849 1 11 . 1 1 84 84 PRO CA C 84 63.190 63.190 65.107 -1.917 25277 4850 1 11 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.749 0.181 25277 4851 1 11 . 1 1 85 85 SER N N 85 117.620 117.620 113.581 4.039 25277 4852 1 11 . 1 1 85 85 SER HA H 85 3.870 3.870 4.451 -0.581 25277 4853 1 11 . 1 1 85 85 SER C C 85 174.350 174.350 173.872 0.478 25277 4854 1 11 . 1 1 85 85 SER CA C 85 58.970 58.970 58.674 0.296 25277 4855 1 11 . 1 1 85 85 SER CB C 85 63.820 63.820 63.111 0.709 25277 4856 1 11 . 1 1 85 85 SER H H 85 7.660 7.660 7.978 -0.318 25277 4857 1 11 . 1 1 86 86 ASP N N 86 117.590 117.590 117.531 0.059 25277 4858 1 11 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.317 -0.177 25277 4859 1 11 . 1 1 86 86 ASP C C 86 174.480 174.480 174.214 0.266 25277 4860 1 11 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.660 -0.680 25277 4861 1 11 . 1 1 86 86 ASP CB C 86 37.850 37.850 38.674 -0.824 25277 4862 1 11 . 1 1 86 86 ASP H H 86 8.490 8.490 8.269 0.221 25277 4863 1 11 . 1 1 87 87 ASN N N 87 117.160 117.160 117.265 -0.105 25277 4864 1 11 . 1 1 87 87 ASN HA H 87 4.530 4.530 5.059 -0.529 25277 4865 1 11 . 1 1 87 87 ASN CA C 87 52.480 52.480 52.105 0.375 25277 4866 1 11 . 1 1 87 87 ASN CB C 87 40.040 40.040 40.970 -0.930 25277 4867 1 11 . 1 1 87 87 ASN H H 87 7.260 7.260 7.677 -0.417 25277 4868 1 11 . 1 1 88 88 ALA HA H 88 4.730 4.730 4.737 -0.007 25277 4869 1 11 . 1 1 88 88 ALA C C 88 174.620 174.620 176.265 -1.645 25277 4870 1 11 . 1 1 88 88 ALA CA C 88 51.230 51.230 50.954 0.276 25277 4871 1 11 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.253 0.287 25277 4872 1 11 . 1 1 89 89 VAL N N 89 116.580 116.580 117.801 -1.221 25277 4873 1 11 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.119 -0.019 25277 4874 1 11 . 1 1 89 89 VAL C C 89 172.750 172.750 173.526 -0.776 25277 4875 1 11 . 1 1 89 89 VAL CA C 89 58.980 58.980 59.467 -0.487 25277 4876 1 11 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.334 0.886 25277 4877 1 11 . 1 1 89 89 VAL H H 89 8.740 8.740 8.333 0.407 25277 4878 1 11 . 1 1 90 90 PHE N N 90 120.300 120.300 124.103 -3.803 25277 4879 1 11 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.061 0.089 25277 4880 1 11 . 1 1 90 90 PHE C C 90 172.910 172.910 173.579 -0.669 25277 4881 1 11 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.597 0.203 25277 4882 1 11 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.179 1.471 25277 4883 1 11 . 1 1 90 90 PHE H H 90 8.950 8.950 9.041 -0.091 25277 4884 1 11 . 1 1 91 91 VAL N N 91 129.020 129.020 127.893 1.127 25277 4885 1 11 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.658 -0.198 25277 4886 1 11 . 1 1 91 91 VAL C C 91 175.910 175.910 174.098 1.812 25277 4887 1 11 . 1 1 91 91 VAL CA C 91 60.780 60.780 59.601 1.179 25277 4888 1 11 . 1 1 91 91 VAL CB C 91 32.020 32.020 33.490 -1.470 25277 4889 1 11 . 1 1 91 91 VAL H H 91 9.090 9.090 8.628 0.462 25277 4890 1 11 . 1 1 92 92 ALA N N 92 129.760 129.760 129.967 -0.207 25277 4891 1 11 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.729 -0.229 25277 4892 1 11 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.690 2.160 25277 4893 1 11 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.595 -1.545 25277 4894 1 11 . 1 1 92 92 ALA H H 92 8.680 8.680 8.422 0.258 25277 4895 1 11 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.057 0.103 25277 4896 1 11 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.202 0.198 25277 4897 1 11 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.281 0.659 25277 4898 1 11 . 1 1 94 94 ASP N N 94 113.220 113.220 115.335 -2.115 25277 4899 1 11 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.459 -0.039 25277 4900 1 11 . 1 1 94 94 ASP C C 94 176.980 176.980 177.761 -0.781 25277 4901 1 11 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.704 -0.174 25277 4902 1 11 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.398 0.182 25277 4903 1 11 . 1 1 94 94 ASP H H 94 7.890 7.890 8.066 -0.176 25277 4904 1 11 . 1 1 95 95 GLY N N 95 109.120 109.120 109.199 -0.079 25277 4905 1 11 . 1 1 95 95 GLY C C 95 174.440 174.440 174.575 -0.135 25277 4906 1 11 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.188 -0.628 25277 4907 1 11 . 1 1 95 95 GLY H H 95 8.500 8.500 8.093 0.407 25277 4908 1 11 . 1 1 96 96 THR N N 96 120.350 120.350 118.022 2.328 25277 4909 1 11 . 1 1 96 96 THR HA H 96 3.780 3.780 4.386 -0.606 25277 4910 1 11 . 1 1 96 96 THR C C 96 172.590 172.590 173.402 -0.812 25277 4911 1 11 . 1 1 96 96 THR CA C 96 64.660 64.660 62.486 2.174 25277 4912 1 11 . 1 1 96 96 THR CB C 96 68.330 68.330 70.149 -1.819 25277 4913 1 11 . 1 1 96 96 THR H H 96 8.100 8.100 8.493 -0.393 25277 4914 1 11 . 1 1 97 97 THR N N 97 122.660 122.660 121.431 1.229 25277 4915 1 11 . 1 1 97 97 THR HA H 97 4.590 4.590 4.696 -0.106 25277 4916 1 11 . 1 1 97 97 THR C C 97 173.000 173.000 173.293 -0.293 25277 4917 1 11 . 1 1 97 97 THR CA C 97 62.700 62.700 61.657 1.043 25277 4918 1 11 . 1 1 97 97 THR CB C 97 68.840 68.840 69.829 -0.989 25277 4919 1 11 . 1 1 97 97 THR H H 97 7.850 7.850 8.387 -0.537 25277 4920 1 11 . 1 1 98 98 TYR N N 98 122.890 122.890 125.179 -2.289 25277 4921 1 11 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.172 -0.232 25277 4922 1 11 . 1 1 98 98 TYR C C 98 178.970 178.970 174.676 4.294 25277 4923 1 11 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.164 0.346 25277 4924 1 11 . 1 1 98 98 TYR CB C 98 42.950 42.950 42.078 0.872 25277 4925 1 11 . 1 1 98 98 TYR H H 98 9.460 9.460 9.163 0.297 25277 4926 1 11 . 1 1 99 99 ALA N N 99 121.760 121.760 123.868 -2.108 25277 4927 1 11 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.677 -0.567 25277 4928 1 11 . 1 1 99 99 ALA C C 99 178.010 178.010 176.777 1.233 25277 4929 1 11 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.165 1.105 25277 4930 1 11 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.590 2.460 25277 4931 1 11 . 1 1 99 99 ALA H H 99 9.110 9.110 8.788 0.322 25277 4932 1 11 . 1 1 100 100 LEU N N 100 119.330 119.330 124.866 -5.536 25277 4933 1 11 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.240 0.230 25277 4934 1 11 . 1 1 100 100 LEU C C 100 174.720 174.720 177.291 -2.571 25277 4935 1 11 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.876 -2.736 25277 4936 1 11 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.572 2.058 25277 4937 1 11 . 1 1 100 100 LEU H H 100 8.950 8.950 8.500 0.450 25277 4938 1 11 . 1 1 101 101 ASN N N 101 112.600 112.600 116.036 -3.436 25277 4939 1 11 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.908 0.012 25277 4940 1 11 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.550 -1.620 25277 4941 1 11 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.690 0.910 25277 4942 1 11 . 1 1 101 101 ASN H H 101 7.550 7.550 7.760 -0.210 25277 4943 1 11 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.394 -0.204 25277 4944 1 11 . 1 1 102 102 ASP C C 102 178.770 178.770 178.409 0.361 25277 4945 1 11 . 1 1 102 102 ASP CA C 102 56.880 56.880 57.795 -0.915 25277 4946 1 11 . 1 1 102 102 ASP CB C 102 39.980 39.980 40.623 -0.643 25277 4947 1 11 . 1 1 103 103 ARG N N 103 119.370 119.370 120.022 -0.652 25277 4948 1 11 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.126 -0.296 25277 4949 1 11 . 1 1 103 103 ARG C C 103 178.550 178.550 178.373 0.177 25277 4950 1 11 . 1 1 103 103 ARG CA C 103 59.380 59.380 59.047 0.333 25277 4951 1 11 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.878 -0.378 25277 4952 1 11 . 1 1 103 103 ARG H H 103 7.970 7.970 8.045 -0.075 25277 4953 1 11 . 1 1 104 104 ALA N N 104 120.110 120.110 122.088 -1.978 25277 4954 1 11 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.060 0.150 25277 4955 1 11 . 1 1 104 104 ALA C C 104 179.510 179.510 179.154 0.356 25277 4956 1 11 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.398 -0.648 25277 4957 1 11 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.301 1.369 25277 4958 1 11 . 1 1 104 104 ALA H H 104 7.610 7.610 8.529 -0.919 25277 4959 1 11 . 1 1 105 105 GLU N N 105 120.460 120.460 119.434 1.026 25277 4960 1 11 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.322 0.388 25277 4961 1 11 . 1 1 105 105 GLU C C 105 181.710 181.710 179.294 2.416 25277 4962 1 11 . 1 1 105 105 GLU CA C 105 58.680 58.680 58.967 -0.287 25277 4963 1 11 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.699 -0.209 25277 4964 1 11 . 1 1 105 105 GLU H H 105 7.750 7.750 7.762 -0.012 25277 4965 1 11 . 1 1 106 106 LYS N N 106 121.980 121.980 120.010 1.970 25277 4966 1 11 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.098 -0.078 25277 4967 1 11 . 1 1 106 106 LYS C C 106 177.890 177.890 178.008 -0.118 25277 4968 1 11 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.628 -0.158 25277 4969 1 11 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.476 -0.746 25277 4970 1 11 . 1 1 106 106 LYS H H 106 8.380 8.380 7.881 0.499 25277 4971 1 11 . 1 1 107 107 ALA N N 107 119.850 119.850 118.898 0.952 25277 4972 1 11 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.301 -0.041 25277 4973 1 11 . 1 1 107 107 ALA C C 107 177.210 177.210 177.366 -0.156 25277 4974 1 11 . 1 1 107 107 ALA CA C 107 52.270 52.270 51.968 0.302 25277 4975 1 11 . 1 1 107 107 ALA CB C 107 18.740 18.740 18.773 -0.033 25277 4976 1 11 . 1 1 107 107 ALA H H 107 7.400 7.400 7.581 -0.181 25277 4977 1 11 . 1 1 108 108 GLY N N 108 104.560 104.560 106.499 -1.939 25277 4978 1 11 . 1 1 108 108 GLY C C 108 174.300 174.300 174.289 0.011 25277 4979 1 11 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.082 -0.472 25277 4980 1 11 . 1 1 108 108 GLY H H 108 7.560 7.560 7.783 -0.223 25277 4981 1 11 . 1 1 109 109 HIS N N 109 122.550 122.550 120.865 1.685 25277 4982 1 11 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.995 -0.225 25277 4983 1 11 . 1 1 109 109 HIS CA C 109 54.580 54.580 53.396 1.184 25277 4984 1 11 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.222 -0.632 25277 4985 1 11 . 1 1 109 109 HIS H H 109 7.590 7.590 7.758 -0.168 25277 4986 1 11 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.749 -0.189 25277 4987 1 11 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.438 0.291 25277 4988 1 11 . 1 1 111 111 PRO CB C 111 32.800 32.800 32.834 -0.034 25277 4989 1 11 . 1 1 112 112 ILE N N 112 119.770 119.770 118.971 0.799 25277 4990 1 11 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.432 0.428 25277 4991 1 11 . 1 1 112 112 ILE C C 112 172.800 172.800 177.509 -4.709 25277 4992 1 11 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.240 -2.050 25277 4993 1 11 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.398 3.042 25277 4994 1 11 . 1 1 112 112 ILE H H 112 7.890 7.890 8.498 -0.608 25277 4995 1 11 . 1 1 113 113 THR N N 113 113.610 113.610 115.924 -2.314 25277 4996 1 11 . 1 1 113 113 THR HA H 113 3.010 3.010 3.992 -0.982 25277 4997 1 11 . 1 1 113 113 THR CA C 113 66.860 66.860 67.890 -1.030 25277 4998 1 11 . 1 1 113 113 THR CB C 113 66.920 66.920 67.281 -0.361 25277 4999 1 11 . 1 1 113 113 THR H H 113 7.070 7.070 8.495 -1.425 25277 5000 1 11 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.335 0.005 25277 5001 1 11 . 1 1 114 114 PRO CA C 114 66.080 66.080 65.130 0.950 25277 5002 1 11 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.490 0.590 25277 5003 1 11 . 1 1 115 115 ILE N N 115 134.770 134.770 109.900 24.870 25277 5004 1 11 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.414 0.196 25277 5005 1 11 . 1 1 115 115 ILE C C 115 174.800 174.800 174.823 -0.023 25277 5006 1 11 . 1 1 115 115 ILE CA C 115 60.000 60.000 59.861 0.140 25277 5007 1 11 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.578 0.282 25277 5008 1 11 . 1 1 115 115 ILE H H 115 7.510 7.510 7.525 -0.015 25277 5009 1 11 . 1 1 116 116 ARG N N 116 120.890 120.890 122.196 -1.306 25277 5010 1 11 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.132 -0.162 25277 5011 1 11 . 1 1 116 116 ARG C C 116 174.910 174.910 175.729 -0.819 25277 5012 1 11 . 1 1 116 116 ARG CA C 116 57.780 57.780 55.904 1.876 25277 5013 1 11 . 1 1 116 116 ARG CB C 116 31.870 31.870 31.461 0.409 25277 5014 1 11 . 1 1 116 116 ARG H H 116 7.280 7.280 7.530 -0.250 25277 5015 1 11 . 1 1 117 117 ALA N N 117 125.400 125.400 127.866 -2.466 25277 5016 1 11 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.340 -0.110 25277 5017 1 11 . 1 1 117 117 ALA C C 117 176.290 176.290 175.578 0.712 25277 5018 1 11 . 1 1 117 117 ALA CA C 117 50.780 50.780 51.163 -0.383 25277 5019 1 11 . 1 1 117 117 ALA CB C 117 20.290 20.290 20.735 -0.445 25277 5020 1 11 . 1 1 117 117 ALA H H 117 8.150 8.150 8.358 -0.208 25277 5021 1 11 . 1 1 118 118 LYS N N 118 119.890 119.890 122.554 -2.664 25277 5022 1 11 . 1 1 118 118 LYS HA H 118 4.590 4.590 3.759 0.831 25277 5023 1 11 . 1 1 118 118 LYS C C 118 177.400 177.400 176.322 1.078 25277 5024 1 11 . 1 1 118 118 LYS CA C 118 55.670 55.670 54.909 0.761 25277 5025 1 11 . 1 1 118 118 LYS CB C 118 34.510 34.510 33.522 0.988 25277 5026 1 11 . 1 1 118 118 LYS H H 118 8.360 8.360 8.236 0.124 25277 5027 1 11 . 1 1 119 119 GLY N N 119 108.630 108.630 112.410 -3.780 25277 5028 1 11 . 1 1 119 119 GLY CA C 119 43.610 43.610 43.400 0.210 25277 5029 1 11 . 1 1 119 119 GLY H H 119 8.320 8.320 7.907 0.413 25277 5030 1 11 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.735 0.165 25277 5031 1 11 . 1 1 124 124 TYR C C 124 177.430 177.430 176.489 0.941 25277 5032 1 11 . 1 1 124 124 TYR CA C 124 57.970 57.970 57.387 0.583 25277 5033 1 11 . 1 1 124 124 TYR CB C 124 38.650 38.650 40.533 -1.883 25277 5034 1 11 . 1 1 125 125 ILE N N 125 123.670 123.670 122.550 1.120 25277 5035 1 11 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.164 -0.324 25277 5036 1 11 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.404 0.326 25277 5037 1 11 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.347 0.163 25277 5038 1 11 . 1 1 125 125 ILE H H 125 8.340 8.340 8.013 0.327 25277 5039 1 11 . 1 1 126 126 SER HA H 126 4.070 4.070 4.402 -0.332 25277 5040 1 11 . 1 1 126 126 SER C C 126 176.290 176.290 174.970 1.320 25277 5041 1 11 . 1 1 126 126 SER CA C 126 59.190 59.190 58.478 0.712 25277 5042 1 11 . 1 1 126 126 SER CB C 126 63.200 63.200 63.781 -0.581 25277 5043 1 11 . 1 1 127 127 LEU N N 127 127.030 127.030 124.037 2.993 25277 5044 1 11 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.335 -0.395 25277 5045 1 11 . 1 1 127 127 LEU C C 127 176.660 176.660 178.246 -1.586 25277 5046 1 11 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.612 0.498 25277 5047 1 11 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.687 1.243 25277 5048 1 11 . 1 1 127 127 LEU H H 127 8.790 8.790 8.383 0.407 25277 5049 1 11 . 1 1 128 128 GLY N N 128 106.600 106.600 108.933 -2.333 25277 5050 1 11 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.634 0.896 25277 5051 1 11 . 1 1 128 128 GLY H H 128 8.450 8.450 8.279 0.171 25277 5052 1 11 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.032 0.198 25277 5053 1 11 . 1 1 129 129 ALA C C 129 180.410 180.410 179.242 1.168 25277 5054 1 11 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.533 0.387 25277 5055 1 11 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.287 0.843 25277 5056 1 11 . 1 1 130 130 LEU N N 130 122.550 122.550 120.596 1.954 25277 5057 1 11 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.033 -0.113 25277 5058 1 11 . 1 1 130 130 LEU C C 130 179.020 179.020 178.483 0.537 25277 5059 1 11 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.343 0.287 25277 5060 1 11 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.598 0.542 25277 5061 1 11 . 1 1 130 130 LEU H H 130 8.040 8.040 7.417 0.623 25277 5062 1 11 . 1 1 131 131 LEU N N 131 121.910 121.910 119.419 2.491 25277 5063 1 11 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.865 0.055 25277 5064 1 11 . 1 1 131 131 LEU C C 131 177.910 177.910 178.413 -0.503 25277 5065 1 11 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.089 0.481 25277 5066 1 11 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.525 -0.805 25277 5067 1 11 . 1 1 131 131 LEU H H 131 9.060 9.060 7.870 1.190 25277 5068 1 11 . 1 1 132 132 SER N N 132 115.530 115.530 114.969 0.561 25277 5069 1 11 . 1 1 132 132 SER HA H 132 3.970 3.970 4.063 -0.093 25277 5070 1 11 . 1 1 132 132 SER C C 132 177.140 177.140 176.743 0.397 25277 5071 1 11 . 1 1 132 132 SER CA C 132 62.340 62.340 62.077 0.263 25277 5072 1 11 . 1 1 132 132 SER CB C 132 62.370 62.370 62.878 -0.508 25277 5073 1 11 . 1 1 132 132 SER H H 132 8.730 8.730 8.070 0.660 25277 5074 1 11 . 1 1 133 133 THR N N 133 116.960 116.960 118.940 -1.980 25277 5075 1 11 . 1 1 133 133 THR HA H 133 3.860 3.860 4.022 -0.162 25277 5076 1 11 . 1 1 133 133 THR C C 133 175.670 175.670 176.477 -0.807 25277 5077 1 11 . 1 1 133 133 THR CA C 133 66.930 66.930 67.237 -0.307 25277 5078 1 11 . 1 1 133 133 THR CB C 133 68.880 68.880 68.619 0.261 25277 5079 1 11 . 1 1 133 133 THR H H 133 7.750 7.750 7.778 -0.028 25277 5080 1 11 . 1 1 134 134 THR N N 134 118.830 118.830 119.504 -0.674 25277 5081 1 11 . 1 1 134 134 THR HA H 134 3.780 3.780 3.951 -0.171 25277 5082 1 11 . 1 1 134 134 THR C C 134 176.750 176.750 176.214 0.536 25277 5083 1 11 . 1 1 134 134 THR CA C 134 67.650 67.650 67.287 0.363 25277 5084 1 11 . 1 1 134 134 THR CB C 134 67.560 67.560 68.649 -1.089 25277 5085 1 11 . 1 1 134 134 THR H H 134 7.570 7.570 7.634 -0.064 25277 5086 1 11 . 1 1 135 135 LEU N N 135 121.420 121.420 121.792 -0.372 25277 5087 1 11 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.914 0.576 25277 5088 1 11 . 1 1 135 135 LEU C C 135 180.050 180.050 178.440 1.610 25277 5089 1 11 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.227 -1.217 25277 5090 1 11 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.421 -0.811 25277 5091 1 11 . 1 1 135 135 LEU H H 135 8.650 8.650 8.156 0.494 25277 5092 1 11 . 1 1 136 136 ASN N N 136 117.010 117.010 117.749 -0.739 25277 5093 1 11 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.436 0.104 25277 5094 1 11 . 1 1 136 136 ASN C C 136 175.980 175.980 178.259 -2.279 25277 5095 1 11 . 1 1 136 136 ASN CA C 136 54.770 54.770 56.338 -1.568 25277 5096 1 11 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.850 -0.410 25277 5097 1 11 . 1 1 136 136 ASN H H 136 7.360 7.360 7.785 -0.425 25277 5098 1 11 . 1 1 137 137 LEU N N 137 116.940 116.940 121.007 -4.067 25277 5099 1 11 . 1 1 137 137 LEU HA H 137 4.160 4.160 4.016 0.144 25277 5100 1 11 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.564 -2.134 25277 5101 1 11 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.705 -0.135 25277 5102 1 11 . 1 1 137 137 LEU H H 137 7.810 7.810 7.639 0.171 25277 5103 1 11 . 1 1 138 138 CYS N N 138 115.430 115.430 114.915 0.515 25277 5104 1 11 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.228 0.182 25277 5105 1 11 . 1 1 138 138 CYS CA C 138 55.480 55.480 61.191 -5.711 25277 5106 1 11 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.484 14.716 25277 5107 1 11 . 1 1 138 138 CYS H H 138 7.450 7.450 7.835 -0.385 25277 5108 1 11 . 1 1 139 139 GLY C C 139 178.800 178.800 174.286 4.514 25277 5109 1 11 . 1 1 139 139 GLY CA C 139 45.500 45.500 45.296 0.204 25277 5110 1 11 . 1 1 140 140 LYS N N 140 119.830 119.830 121.663 -1.833 25277 5111 1 11 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.220 0.100 25277 5112 1 11 . 1 1 140 140 LYS C C 140 175.820 175.820 177.323 -1.503 25277 5113 1 11 . 1 1 140 140 LYS CA C 140 55.680 55.680 56.849 -1.169 25277 5114 1 11 . 1 1 140 140 LYS CB C 140 32.800 32.800 32.600 0.200 25277 5115 1 11 . 1 1 140 140 LYS H H 140 7.760 7.760 7.488 0.272 25277 5116 1 12 . 1 1 27 27 PRO CA C 27 63.230 63.230 62.624 0.606 25277 5117 1 12 . 1 1 27 27 PRO CB C 27 32.050 32.050 32.180 -0.130 25277 5118 1 12 . 1 1 28 28 ASP N N 28 120.030 120.030 120.733 -0.703 25277 5119 1 12 . 1 1 28 28 ASP C C 28 176.130 176.130 176.273 -0.143 25277 5120 1 12 . 1 1 28 28 ASP CA C 28 54.170 54.170 54.484 -0.314 25277 5121 1 12 . 1 1 28 28 ASP CB C 28 40.860 40.860 41.497 -0.637 25277 5122 1 12 . 1 1 28 28 ASP H H 28 8.260 8.260 8.395 -0.135 25277 5123 1 12 . 1 1 29 29 LEU N N 29 123.030 123.030 121.488 1.542 25277 5124 1 12 . 1 1 29 29 LEU C C 29 177.870 177.870 178.064 -0.194 25277 5125 1 12 . 1 1 29 29 LEU CA C 29 55.160 55.160 54.632 0.528 25277 5126 1 12 . 1 1 29 29 LEU CB C 29 42.270 42.270 42.806 -0.536 25277 5127 1 12 . 1 1 29 29 LEU H H 29 8.120 8.120 8.171 -0.051 25277 5128 1 12 . 1 1 30 30 GLY N N 30 109.350 109.350 109.754 -0.404 25277 5129 1 12 . 1 1 30 30 GLY CA C 30 45.340 45.340 45.520 -0.180 25277 5130 1 12 . 1 1 30 30 GLY H H 30 8.410 8.410 8.370 0.040 25277 5131 1 12 . 1 1 44 44 PRO CA C 44 63.590 63.590 62.377 1.213 25277 5132 1 12 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.157 -0.167 25277 5133 1 12 . 1 1 45 45 ALA N N 45 122.140 122.140 123.879 -1.739 25277 5134 1 12 . 1 1 45 45 ALA CA C 45 52.670 52.670 52.802 -0.132 25277 5135 1 12 . 1 1 45 45 ALA H H 45 8.350 8.350 7.968 0.382 25277 5136 1 12 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.252 0.048 25277 5137 1 12 . 1 1 49 49 PRO CA C 49 62.950 62.950 62.827 0.123 25277 5138 1 12 . 1 1 49 49 PRO CB C 49 31.990 31.990 32.269 -0.279 25277 5139 1 12 . 1 1 50 50 VAL N N 50 124.190 124.190 121.283 2.907 25277 5140 1 12 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.292 0.028 25277 5141 1 12 . 1 1 50 50 VAL CA C 50 59.850 59.850 59.298 0.552 25277 5142 1 12 . 1 1 50 50 VAL CB C 50 32.480 32.480 31.639 0.841 25277 5143 1 12 . 1 1 50 50 VAL H H 50 8.070 8.070 8.290 -0.220 25277 5144 1 12 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.325 0.025 25277 5145 1 12 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.165 -0.235 25277 5146 1 12 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.093 -0.113 25277 5147 1 12 . 1 1 52 52 LEU N N 52 124.500 124.500 122.083 2.417 25277 5148 1 12 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.256 0.234 25277 5149 1 12 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.847 -0.957 25277 5150 1 12 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.608 0.582 25277 5151 1 12 . 1 1 52 52 LEU H H 52 8.360 8.360 8.185 0.175 25277 5152 1 12 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.456 -0.046 25277 5153 1 12 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.862 -0.532 25277 5154 1 12 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.161 -0.171 25277 5155 1 12 . 1 1 54 54 SER N N 54 117.380 117.380 117.476 -0.096 25277 5156 1 12 . 1 1 54 54 SER HA H 54 4.600 4.600 4.371 0.229 25277 5157 1 12 . 1 1 54 54 SER CA C 54 56.710 56.710 57.188 -0.478 25277 5158 1 12 . 1 1 54 54 SER CB C 54 62.500 62.500 63.214 -0.714 25277 5159 1 12 . 1 1 54 54 SER H H 54 8.400 8.400 8.228 0.172 25277 5160 1 12 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.607 -0.057 25277 5161 1 12 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.476 0.064 25277 5162 1 12 . 1 1 55 55 PRO CB C 55 32.620 32.620 32.195 0.425 25277 5163 1 12 . 1 1 57 57 SER HA H 57 4.420 4.420 4.268 0.152 25277 5164 1 12 . 1 1 57 57 SER CA C 57 57.580 57.580 60.028 -2.448 25277 5165 1 12 . 1 1 57 57 SER CB C 57 63.780 63.780 63.073 0.707 25277 5166 1 12 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.262 0.728 25277 5167 1 12 . 1 1 58 58 ASN C C 58 172.230 172.230 173.632 -1.402 25277 5168 1 12 . 1 1 58 58 ASN CA C 58 53.670 53.670 55.182 -1.512 25277 5169 1 12 . 1 1 58 58 ASN CB C 58 37.850 37.850 37.908 -0.058 25277 5170 1 12 . 1 1 59 59 LYS N N 59 117.660 117.660 116.747 0.913 25277 5171 1 12 . 1 1 59 59 LYS HA H 59 5.360 5.360 5.128 0.232 25277 5172 1 12 . 1 1 59 59 LYS C C 59 175.120 175.120 174.376 0.744 25277 5173 1 12 . 1 1 59 59 LYS CA C 59 54.860 54.860 55.564 -0.704 25277 5174 1 12 . 1 1 59 59 LYS CB C 59 36.450 36.450 37.334 -0.884 25277 5175 1 12 . 1 1 59 59 LYS H H 59 7.640 7.640 7.784 -0.144 25277 5176 1 12 . 1 1 60 60 GLN N N 60 120.680 120.680 119.325 1.355 25277 5177 1 12 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.643 -0.153 25277 5178 1 12 . 1 1 60 60 GLN C C 60 173.640 173.640 173.202 0.438 25277 5179 1 12 . 1 1 60 60 GLN CA C 60 55.480 55.480 54.940 0.540 25277 5180 1 12 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.221 -0.231 25277 5181 1 12 . 1 1 60 60 GLN H H 60 8.930 8.930 8.433 0.497 25277 5182 1 12 . 1 1 61 61 ASP N N 61 126.170 126.170 121.402 4.768 25277 5183 1 12 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.864 0.186 25277 5184 1 12 . 1 1 61 61 ASP C C 61 175.000 175.000 175.216 -0.216 25277 5185 1 12 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.234 0.646 25277 5186 1 12 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.671 -0.901 25277 5187 1 12 . 1 1 61 61 ASP H H 61 8.540 8.540 8.575 -0.035 25277 5188 1 12 . 1 1 62 62 ILE N N 62 121.100 121.100 125.333 -4.233 25277 5189 1 12 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.527 0.254 25277 5190 1 12 . 1 1 62 62 ILE C C 62 171.480 171.480 173.685 -2.205 25277 5191 1 12 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.386 0.704 25277 5192 1 12 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.336 0.804 25277 5193 1 12 . 1 1 62 62 ILE H H 62 8.970 8.970 8.530 0.440 25277 5194 1 12 . 1 1 63 63 SER N N 63 119.430 119.430 121.767 -2.337 25277 5195 1 12 . 1 1 63 63 SER HA H 63 4.680 4.680 4.477 0.203 25277 5196 1 12 . 1 1 63 63 SER C C 63 174.030 174.030 174.538 -0.508 25277 5197 1 12 . 1 1 63 63 SER CA C 63 56.550 56.550 56.489 0.061 25277 5198 1 12 . 1 1 63 63 SER CB C 63 67.320 67.320 66.142 1.178 25277 5199 1 12 . 1 1 63 63 SER H H 63 8.520 8.520 8.079 0.441 25277 5200 1 12 . 1 1 64 64 GLU N N 64 121.250 121.250 120.281 0.969 25277 5201 1 12 . 1 1 64 64 GLU HA H 64 2.770 2.770 2.971 -0.201 25277 5202 1 12 . 1 1 64 64 GLU C C 64 177.190 177.190 177.929 -0.739 25277 5203 1 12 . 1 1 64 64 GLU CA C 64 58.590 58.590 59.036 -0.446 25277 5204 1 12 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.599 -0.459 25277 5205 1 12 . 1 1 64 64 GLU H H 64 7.400 7.400 7.623 -0.223 25277 5206 1 12 . 1 1 65 65 ALA N N 65 119.250 119.250 122.252 -3.002 25277 5207 1 12 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.887 -0.027 25277 5208 1 12 . 1 1 65 65 ALA C C 65 179.630 179.630 179.779 -0.149 25277 5209 1 12 . 1 1 65 65 ALA CA C 65 53.810 53.810 54.825 -1.016 25277 5210 1 12 . 1 1 65 65 ALA CB C 65 18.400 18.400 17.890 0.510 25277 5211 1 12 . 1 1 65 65 ALA H H 65 7.700 7.700 8.305 -0.605 25277 5212 1 12 . 1 1 66 66 ASN N N 66 112.360 112.360 116.915 -4.555 25277 5213 1 12 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.481 0.549 25277 5214 1 12 . 1 1 66 66 ASN C C 66 174.580 174.580 177.362 -2.782 25277 5215 1 12 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.819 -0.269 25277 5216 1 12 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.422 1.508 25277 5217 1 12 . 1 1 66 66 ASN H H 66 7.960 7.960 7.543 0.417 25277 5218 1 12 . 1 1 67 67 LEU N N 67 115.390 115.390 118.601 -3.211 25277 5219 1 12 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.220 0.430 25277 5220 1 12 . 1 1 67 67 LEU C C 67 176.500 176.500 176.906 -0.406 25277 5221 1 12 . 1 1 67 67 LEU CA C 67 54.350 54.350 56.128 -1.778 25277 5222 1 12 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.029 2.641 25277 5223 1 12 . 1 1 67 67 LEU H H 67 7.050 7.050 7.589 -0.539 25277 5224 1 12 . 1 1 68 68 ALA N N 68 125.680 125.680 120.374 5.306 25277 5225 1 12 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.764 0.126 25277 5226 1 12 . 1 1 68 68 ALA C C 68 177.480 177.480 178.278 -0.798 25277 5227 1 12 . 1 1 68 68 ALA CA C 68 53.550 53.550 53.354 0.196 25277 5228 1 12 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.203 -0.053 25277 5229 1 12 . 1 1 68 68 ALA H H 68 8.880 8.880 8.003 0.877 25277 5230 1 12 . 1 1 69 69 TYR N N 69 119.780 119.780 120.125 -0.345 25277 5231 1 12 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.321 0.169 25277 5232 1 12 . 1 1 69 69 TYR C C 69 175.340 175.340 177.306 -1.966 25277 5233 1 12 . 1 1 69 69 TYR CA C 69 58.640 58.640 60.703 -2.063 25277 5234 1 12 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.045 -0.765 25277 5235 1 12 . 1 1 69 69 TYR H H 69 7.420 7.420 8.501 -1.081 25277 5236 1 12 . 1 1 70 70 LEU N N 70 118.820 118.820 116.894 1.926 25277 5237 1 12 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.154 0.136 25277 5238 1 12 . 1 1 70 70 LEU C C 70 176.770 176.770 177.441 -0.671 25277 5239 1 12 . 1 1 70 70 LEU CA C 70 53.880 53.880 55.557 -1.677 25277 5240 1 12 . 1 1 70 70 LEU CB C 70 41.300 41.300 41.769 -0.469 25277 5241 1 12 . 1 1 70 70 LEU H H 70 7.690 7.690 7.456 0.234 25277 5242 1 12 . 1 1 71 71 TRP N N 71 124.110 124.110 122.669 1.441 25277 5243 1 12 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.540 0.050 25277 5244 1 12 . 1 1 71 71 TRP CA C 71 54.150 54.150 56.019 -1.869 25277 5245 1 12 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.462 -0.252 25277 5246 1 12 . 1 1 71 71 TRP H H 71 8.130 8.130 7.693 0.437 25277 5247 1 12 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.384 0.196 25277 5248 1 12 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.212 0.378 25277 5249 1 12 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.756 -1.696 25277 5250 1 12 . 1 1 73 73 LEU N N 73 118.760 118.760 117.419 1.341 25277 5251 1 12 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.531 0.869 25277 5252 1 12 . 1 1 73 73 LEU C C 73 176.620 176.620 178.185 -1.565 25277 5253 1 12 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.506 -0.456 25277 5254 1 12 . 1 1 73 73 LEU CB C 73 44.260 44.260 43.141 1.119 25277 5255 1 12 . 1 1 73 73 LEU H H 73 5.190 5.190 6.593 -1.403 25277 5256 1 12 . 1 1 74 74 THR N N 74 110.120 110.120 114.845 -4.725 25277 5257 1 12 . 1 1 74 74 THR HA H 74 4.250 4.250 4.217 0.033 25277 5258 1 12 . 1 1 74 74 THR C C 74 176.080 176.080 175.669 0.411 25277 5259 1 12 . 1 1 74 74 THR CA C 74 62.690 62.690 64.259 -1.569 25277 5260 1 12 . 1 1 74 74 THR CB C 74 67.930 67.930 69.325 -1.395 25277 5261 1 12 . 1 1 74 74 THR H H 74 9.010 9.010 8.605 0.405 25277 5262 1 12 . 1 1 75 75 VAL N N 75 113.030 113.030 118.753 -5.723 25277 5263 1 12 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.178 0.632 25277 5264 1 12 . 1 1 75 75 VAL C C 75 176.010 176.010 176.911 -0.901 25277 5265 1 12 . 1 1 75 75 VAL CA C 75 59.100 59.100 62.210 -3.110 25277 5266 1 12 . 1 1 75 75 VAL CB C 75 33.220 33.220 32.519 0.701 25277 5267 1 12 . 1 1 75 75 VAL H H 75 6.660 6.660 7.695 -1.035 25277 5268 1 12 . 1 1 76 76 ASP N N 76 119.590 119.590 123.644 -4.054 25277 5269 1 12 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.688 -0.198 25277 5270 1 12 . 1 1 76 76 ASP C C 76 175.060 175.060 176.280 -1.220 25277 5271 1 12 . 1 1 76 76 ASP CA C 76 55.110 55.110 57.067 -1.957 25277 5272 1 12 . 1 1 76 76 ASP CB C 76 41.300 41.300 41.034 0.266 25277 5273 1 12 . 1 1 76 76 ASP H H 76 8.770 8.770 9.086 -0.316 25277 5274 1 12 . 1 1 77 77 HIS N N 77 113.300 113.300 111.981 1.319 25277 5275 1 12 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.715 0.375 25277 5276 1 12 . 1 1 77 77 HIS C C 77 171.370 171.370 173.835 -2.465 25277 5277 1 12 . 1 1 77 77 HIS CA C 77 55.590 55.590 54.572 1.018 25277 5278 1 12 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.566 -2.376 25277 5279 1 12 . 1 1 77 77 HIS H H 77 7.650 7.650 7.676 -0.026 25277 5280 1 12 . 1 1 78 78 GLY N N 78 101.350 101.350 105.629 -4.279 25277 5281 1 12 . 1 1 78 78 GLY C C 78 172.110 172.110 172.112 -0.002 25277 5282 1 12 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.798 0.012 25277 5283 1 12 . 1 1 78 78 GLY H H 78 8.450 8.450 8.768 -0.318 25277 5284 1 12 . 1 1 79 79 THR N N 79 120.230 120.230 117.352 2.878 25277 5285 1 12 . 1 1 79 79 THR HA H 79 5.110 5.110 4.882 0.228 25277 5286 1 12 . 1 1 79 79 THR C C 79 172.920 172.920 173.826 -0.906 25277 5287 1 12 . 1 1 79 79 THR CA C 79 61.480 61.480 61.760 -0.280 25277 5288 1 12 . 1 1 79 79 THR CB C 79 72.130 72.130 70.910 1.220 25277 5289 1 12 . 1 1 79 79 THR H H 79 8.080 8.080 8.516 -0.436 25277 5290 1 12 . 1 1 80 80 ILE N N 80 119.620 119.620 121.004 -1.384 25277 5291 1 12 . 1 1 80 80 ILE HA H 80 5.140 5.140 4.951 0.189 25277 5292 1 12 . 1 1 80 80 ILE C C 80 174.340 174.340 174.143 0.197 25277 5293 1 12 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.430 -0.080 25277 5294 1 12 . 1 1 80 80 ILE CB C 80 39.550 39.550 40.039 -0.489 25277 5295 1 12 . 1 1 80 80 ILE H H 80 8.970 8.970 8.715 0.255 25277 5296 1 12 . 1 1 81 81 GLU N N 81 119.960 119.960 124.133 -4.173 25277 5297 1 12 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.137 -0.137 25277 5298 1 12 . 1 1 81 81 GLU C C 81 176.130 176.130 174.907 1.223 25277 5299 1 12 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.871 -0.311 25277 5300 1 12 . 1 1 81 81 GLU CB C 81 33.390 33.390 34.745 -1.355 25277 5301 1 12 . 1 1 81 81 GLU H H 81 8.350 8.350 8.277 0.073 25277 5302 1 12 . 1 1 82 82 CYS N N 82 123.110 123.110 121.897 1.213 25277 5303 1 12 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.166 -0.236 25277 5304 1 12 . 1 1 82 82 CYS C C 82 174.430 174.430 175.056 -0.626 25277 5305 1 12 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.072 -4.832 25277 5306 1 12 . 1 1 82 82 CYS CB C 82 43.720 43.720 27.249 16.471 25277 5307 1 12 . 1 1 82 82 CYS H H 82 8.220 8.220 8.483 -0.263 25277 5308 1 12 . 1 1 83 83 LEU N N 83 131.660 131.660 126.452 5.208 25277 5309 1 12 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.664 -0.134 25277 5310 1 12 . 1 1 83 83 LEU CA C 83 53.900 53.900 53.067 0.833 25277 5311 1 12 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.182 -1.982 25277 5312 1 12 . 1 1 83 83 LEU H H 83 8.910 8.910 8.181 0.729 25277 5313 1 12 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.218 0.152 25277 5314 1 12 . 1 1 84 84 PRO CA C 84 63.190 63.190 65.193 -2.003 25277 5315 1 12 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.740 0.190 25277 5316 1 12 . 1 1 85 85 SER N N 85 117.620 117.620 112.530 5.090 25277 5317 1 12 . 1 1 85 85 SER HA H 85 3.870 3.870 4.314 -0.444 25277 5318 1 12 . 1 1 85 85 SER C C 85 174.350 174.350 174.411 -0.061 25277 5319 1 12 . 1 1 85 85 SER CA C 85 58.970 58.970 58.415 0.555 25277 5320 1 12 . 1 1 85 85 SER CB C 85 63.820 63.820 62.905 0.915 25277 5321 1 12 . 1 1 85 85 SER H H 85 7.660 7.660 8.093 -0.433 25277 5322 1 12 . 1 1 86 86 ASP N N 86 117.590 117.590 118.805 -1.215 25277 5323 1 12 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.316 -0.176 25277 5324 1 12 . 1 1 86 86 ASP C C 86 174.480 174.480 174.291 0.189 25277 5325 1 12 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.727 -0.747 25277 5326 1 12 . 1 1 86 86 ASP CB C 86 37.850 37.850 38.688 -0.839 25277 5327 1 12 . 1 1 86 86 ASP H H 86 8.490 8.490 8.375 0.115 25277 5328 1 12 . 1 1 87 87 ASN N N 87 117.160 117.160 116.181 0.979 25277 5329 1 12 . 1 1 87 87 ASN HA H 87 4.530 4.530 4.963 -0.433 25277 5330 1 12 . 1 1 87 87 ASN CA C 87 52.480 52.480 52.115 0.364 25277 5331 1 12 . 1 1 87 87 ASN CB C 87 40.040 40.040 40.636 -0.596 25277 5332 1 12 . 1 1 87 87 ASN H H 87 7.260 7.260 7.866 -0.606 25277 5333 1 12 . 1 1 88 88 ALA HA H 88 4.730 4.730 4.703 0.027 25277 5334 1 12 . 1 1 88 88 ALA C C 88 174.620 174.620 176.535 -1.915 25277 5335 1 12 . 1 1 88 88 ALA CA C 88 51.230 51.230 51.026 0.204 25277 5336 1 12 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.386 0.155 25277 5337 1 12 . 1 1 89 89 VAL N N 89 116.580 116.580 117.966 -1.386 25277 5338 1 12 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.117 -0.017 25277 5339 1 12 . 1 1 89 89 VAL C C 89 172.750 172.750 173.498 -0.748 25277 5340 1 12 . 1 1 89 89 VAL CA C 89 58.980 58.980 59.493 -0.513 25277 5341 1 12 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.355 0.865 25277 5342 1 12 . 1 1 89 89 VAL H H 89 8.740 8.740 8.289 0.451 25277 5343 1 12 . 1 1 90 90 PHE N N 90 120.300 120.300 124.169 -3.869 25277 5344 1 12 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.076 0.074 25277 5345 1 12 . 1 1 90 90 PHE C C 90 172.910 172.910 173.544 -0.634 25277 5346 1 12 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.578 0.222 25277 5347 1 12 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.079 1.571 25277 5348 1 12 . 1 1 90 90 PHE H H 90 8.950 8.950 9.089 -0.139 25277 5349 1 12 . 1 1 91 91 VAL N N 91 129.020 129.020 128.419 0.601 25277 5350 1 12 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.579 -0.119 25277 5351 1 12 . 1 1 91 91 VAL C C 91 175.910 175.910 174.059 1.851 25277 5352 1 12 . 1 1 91 91 VAL CA C 91 60.780 60.780 60.613 0.167 25277 5353 1 12 . 1 1 91 91 VAL CB C 91 32.020 32.020 33.981 -1.961 25277 5354 1 12 . 1 1 91 91 VAL H H 91 9.090 9.090 8.683 0.407 25277 5355 1 12 . 1 1 92 92 ALA N N 92 129.760 129.760 129.164 0.596 25277 5356 1 12 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.762 -0.262 25277 5357 1 12 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.586 2.264 25277 5358 1 12 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.414 -1.364 25277 5359 1 12 . 1 1 92 92 ALA H H 92 8.680 8.680 8.452 0.228 25277 5360 1 12 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.066 0.094 25277 5361 1 12 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.080 0.320 25277 5362 1 12 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.611 0.329 25277 5363 1 12 . 1 1 94 94 ASP N N 94 113.220 113.220 114.962 -1.742 25277 5364 1 12 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.464 -0.044 25277 5365 1 12 . 1 1 94 94 ASP C C 94 176.980 176.980 177.479 -0.499 25277 5366 1 12 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.975 -0.445 25277 5367 1 12 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.850 -0.270 25277 5368 1 12 . 1 1 94 94 ASP H H 94 7.890 7.890 7.802 0.088 25277 5369 1 12 . 1 1 95 95 GLY N N 95 109.120 109.120 108.330 0.790 25277 5370 1 12 . 1 1 95 95 GLY C C 95 174.440 174.440 174.313 0.127 25277 5371 1 12 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.134 -0.574 25277 5372 1 12 . 1 1 95 95 GLY H H 95 8.500 8.500 8.143 0.357 25277 5373 1 12 . 1 1 96 96 THR N N 96 120.350 120.350 118.563 1.787 25277 5374 1 12 . 1 1 96 96 THR HA H 96 3.780 3.780 4.427 -0.647 25277 5375 1 12 . 1 1 96 96 THR C C 96 172.590 172.590 173.282 -0.692 25277 5376 1 12 . 1 1 96 96 THR CA C 96 64.660 64.660 61.979 2.681 25277 5377 1 12 . 1 1 96 96 THR CB C 96 68.330 68.330 70.031 -1.702 25277 5378 1 12 . 1 1 96 96 THR H H 96 8.100 8.100 8.373 -0.273 25277 5379 1 12 . 1 1 97 97 THR N N 97 122.660 122.660 121.714 0.946 25277 5380 1 12 . 1 1 97 97 THR HA H 97 4.590 4.590 4.643 -0.053 25277 5381 1 12 . 1 1 97 97 THR C C 97 173.000 173.000 173.423 -0.423 25277 5382 1 12 . 1 1 97 97 THR CA C 97 62.700 62.700 62.328 0.372 25277 5383 1 12 . 1 1 97 97 THR CB C 97 68.840 68.840 69.610 -0.770 25277 5384 1 12 . 1 1 97 97 THR H H 97 7.850 7.850 8.360 -0.510 25277 5385 1 12 . 1 1 98 98 TYR N N 98 122.890 122.890 125.521 -2.631 25277 5386 1 12 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.192 -0.252 25277 5387 1 12 . 1 1 98 98 TYR C C 98 178.970 178.970 174.832 4.138 25277 5388 1 12 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.120 0.390 25277 5389 1 12 . 1 1 98 98 TYR CB C 98 42.950 42.950 42.026 0.924 25277 5390 1 12 . 1 1 98 98 TYR H H 98 9.460 9.460 9.187 0.273 25277 5391 1 12 . 1 1 99 99 ALA N N 99 121.760 121.760 124.148 -2.388 25277 5392 1 12 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.682 -0.572 25277 5393 1 12 . 1 1 99 99 ALA C C 99 178.010 178.010 176.501 1.509 25277 5394 1 12 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.175 1.095 25277 5395 1 12 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.655 2.395 25277 5396 1 12 . 1 1 99 99 ALA H H 99 9.110 9.110 8.859 0.251 25277 5397 1 12 . 1 1 100 100 LEU N N 100 119.330 119.330 124.687 -5.357 25277 5398 1 12 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.214 0.256 25277 5399 1 12 . 1 1 100 100 LEU C C 100 174.720 174.720 177.043 -2.323 25277 5400 1 12 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.818 -2.678 25277 5401 1 12 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.543 2.087 25277 5402 1 12 . 1 1 100 100 LEU H H 100 8.950 8.950 8.353 0.597 25277 5403 1 12 . 1 1 101 101 ASN N N 101 112.600 112.600 115.278 -2.678 25277 5404 1 12 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.902 0.018 25277 5405 1 12 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.125 -1.195 25277 5406 1 12 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.571 1.029 25277 5407 1 12 . 1 1 101 101 ASN H H 101 7.550 7.550 7.711 -0.161 25277 5408 1 12 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.325 -0.135 25277 5409 1 12 . 1 1 102 102 ASP C C 102 178.770 178.770 177.872 0.898 25277 5410 1 12 . 1 1 102 102 ASP CA C 102 56.880 56.880 57.810 -0.930 25277 5411 1 12 . 1 1 102 102 ASP CB C 102 39.980 39.980 41.235 -1.255 25277 5412 1 12 . 1 1 103 103 ARG N N 103 119.370 119.370 119.436 -0.066 25277 5413 1 12 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.078 -0.248 25277 5414 1 12 . 1 1 103 103 ARG C C 103 178.550 178.550 178.353 0.197 25277 5415 1 12 . 1 1 103 103 ARG CA C 103 59.380 59.380 59.090 0.291 25277 5416 1 12 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.931 -0.431 25277 5417 1 12 . 1 1 103 103 ARG H H 103 7.970 7.970 8.070 -0.100 25277 5418 1 12 . 1 1 104 104 ALA N N 104 120.110 120.110 122.262 -2.152 25277 5419 1 12 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.088 0.122 25277 5420 1 12 . 1 1 104 104 ALA C C 104 179.510 179.510 179.488 0.022 25277 5421 1 12 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.316 -0.566 25277 5422 1 12 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.373 1.296 25277 5423 1 12 . 1 1 104 104 ALA H H 104 7.610 7.610 8.528 -0.918 25277 5424 1 12 . 1 1 105 105 GLU N N 105 120.460 120.460 118.589 1.871 25277 5425 1 12 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.268 0.442 25277 5426 1 12 . 1 1 105 105 GLU C C 105 181.710 181.710 179.643 2.067 25277 5427 1 12 . 1 1 105 105 GLU CA C 105 58.680 58.680 58.844 -0.164 25277 5428 1 12 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.587 -0.097 25277 5429 1 12 . 1 1 105 105 GLU H H 105 7.750 7.750 7.787 -0.037 25277 5430 1 12 . 1 1 106 106 LYS N N 106 121.980 121.980 120.732 1.248 25277 5431 1 12 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.082 -0.062 25277 5432 1 12 . 1 1 106 106 LYS C C 106 177.890 177.890 177.937 -0.047 25277 5433 1 12 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.707 -0.237 25277 5434 1 12 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.441 -0.711 25277 5435 1 12 . 1 1 106 106 LYS H H 106 8.380 8.380 7.922 0.458 25277 5436 1 12 . 1 1 107 107 ALA N N 107 119.850 119.850 118.916 0.934 25277 5437 1 12 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.300 -0.040 25277 5438 1 12 . 1 1 107 107 ALA C C 107 177.210 177.210 177.419 -0.209 25277 5439 1 12 . 1 1 107 107 ALA CA C 107 52.270 52.270 51.995 0.275 25277 5440 1 12 . 1 1 107 107 ALA CB C 107 18.740 18.740 18.807 -0.067 25277 5441 1 12 . 1 1 107 107 ALA H H 107 7.400 7.400 7.597 -0.197 25277 5442 1 12 . 1 1 108 108 GLY N N 108 104.560 104.560 106.418 -1.858 25277 5443 1 12 . 1 1 108 108 GLY C C 108 174.300 174.300 174.311 -0.011 25277 5444 1 12 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.075 -0.466 25277 5445 1 12 . 1 1 108 108 GLY H H 108 7.560 7.560 7.788 -0.228 25277 5446 1 12 . 1 1 109 109 HIS N N 109 122.550 122.550 120.889 1.661 25277 5447 1 12 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.992 -0.222 25277 5448 1 12 . 1 1 109 109 HIS CA C 109 54.580 54.580 53.405 1.175 25277 5449 1 12 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.214 -0.624 25277 5450 1 12 . 1 1 109 109 HIS H H 109 7.590 7.590 7.748 -0.158 25277 5451 1 12 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.801 -0.241 25277 5452 1 12 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.231 0.499 25277 5453 1 12 . 1 1 111 111 PRO CB C 111 32.800 32.800 32.985 -0.185 25277 5454 1 12 . 1 1 112 112 ILE N N 112 119.770 119.770 119.300 0.470 25277 5455 1 12 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.487 0.373 25277 5456 1 12 . 1 1 112 112 ILE C C 112 172.800 172.800 177.587 -4.787 25277 5457 1 12 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.444 -2.254 25277 5458 1 12 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.260 3.180 25277 5459 1 12 . 1 1 112 112 ILE H H 112 7.890 7.890 8.291 -0.401 25277 5460 1 12 . 1 1 113 113 THR N N 113 113.610 113.610 116.433 -2.823 25277 5461 1 12 . 1 1 113 113 THR HA H 113 3.010 3.010 3.965 -0.955 25277 5462 1 12 . 1 1 113 113 THR CA C 113 66.860 66.860 68.021 -1.161 25277 5463 1 12 . 1 1 113 113 THR CB C 113 66.920 66.920 67.291 -0.371 25277 5464 1 12 . 1 1 113 113 THR H H 113 7.070 7.070 8.594 -1.524 25277 5465 1 12 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.316 0.024 25277 5466 1 12 . 1 1 114 114 PRO CA C 114 66.080 66.080 65.180 0.901 25277 5467 1 12 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.499 0.581 25277 5468 1 12 . 1 1 115 115 ILE N N 115 134.770 134.770 110.572 24.198 25277 5469 1 12 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.437 0.173 25277 5470 1 12 . 1 1 115 115 ILE C C 115 174.800 174.800 175.066 -0.266 25277 5471 1 12 . 1 1 115 115 ILE CA C 115 60.000 60.000 60.160 -0.160 25277 5472 1 12 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.348 0.512 25277 5473 1 12 . 1 1 115 115 ILE H H 115 7.510 7.510 7.564 -0.054 25277 5474 1 12 . 1 1 116 116 ARG N N 116 120.890 120.890 121.721 -0.831 25277 5475 1 12 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.204 -0.234 25277 5476 1 12 . 1 1 116 116 ARG C C 116 174.910 174.910 175.614 -0.704 25277 5477 1 12 . 1 1 116 116 ARG CA C 116 57.780 57.780 55.754 2.026 25277 5478 1 12 . 1 1 116 116 ARG CB C 116 31.870 31.870 30.732 1.138 25277 5479 1 12 . 1 1 116 116 ARG H H 116 7.280 7.280 7.606 -0.326 25277 5480 1 12 . 1 1 117 117 ALA N N 117 125.400 125.400 125.227 0.173 25277 5481 1 12 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.494 -0.264 25277 5482 1 12 . 1 1 117 117 ALA C C 117 176.290 176.290 176.129 0.161 25277 5483 1 12 . 1 1 117 117 ALA CA C 117 50.780 50.780 50.813 -0.033 25277 5484 1 12 . 1 1 117 117 ALA CB C 117 20.290 20.290 21.219 -0.929 25277 5485 1 12 . 1 1 117 117 ALA H H 117 8.150 8.150 8.374 -0.224 25277 5486 1 12 . 1 1 118 118 LYS N N 118 119.890 119.890 121.991 -2.101 25277 5487 1 12 . 1 1 118 118 LYS HA H 118 4.590 4.590 3.930 0.660 25277 5488 1 12 . 1 1 118 118 LYS C C 118 177.400 177.400 176.224 1.176 25277 5489 1 12 . 1 1 118 118 LYS CA C 118 55.670 55.670 55.349 0.321 25277 5490 1 12 . 1 1 118 118 LYS CB C 118 34.510 34.510 33.703 0.807 25277 5491 1 12 . 1 1 118 118 LYS H H 118 8.360 8.360 8.330 0.030 25277 5492 1 12 . 1 1 119 119 GLY N N 119 108.630 108.630 110.203 -1.573 25277 5493 1 12 . 1 1 119 119 GLY CA C 119 43.610 43.610 43.953 -0.343 25277 5494 1 12 . 1 1 119 119 GLY H H 119 8.320 8.320 8.014 0.306 25277 5495 1 12 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.753 0.147 25277 5496 1 12 . 1 1 124 124 TYR C C 124 177.430 177.430 176.447 0.983 25277 5497 1 12 . 1 1 124 124 TYR CA C 124 57.970 57.970 57.402 0.568 25277 5498 1 12 . 1 1 124 124 TYR CB C 124 38.650 38.650 40.372 -1.722 25277 5499 1 12 . 1 1 125 125 ILE N N 125 123.670 123.670 122.291 1.379 25277 5500 1 12 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.206 -0.366 25277 5501 1 12 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.285 0.445 25277 5502 1 12 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.446 0.064 25277 5503 1 12 . 1 1 125 125 ILE H H 125 8.340 8.340 7.998 0.342 25277 5504 1 12 . 1 1 126 126 SER HA H 126 4.070 4.070 4.445 -0.375 25277 5505 1 12 . 1 1 126 126 SER C C 126 176.290 176.290 175.284 1.006 25277 5506 1 12 . 1 1 126 126 SER CA C 126 59.190 59.190 58.269 0.921 25277 5507 1 12 . 1 1 126 126 SER CB C 126 63.200 63.200 63.747 -0.547 25277 5508 1 12 . 1 1 127 127 LEU N N 127 127.030 127.030 124.809 2.221 25277 5509 1 12 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.298 -0.358 25277 5510 1 12 . 1 1 127 127 LEU C C 127 176.660 176.660 178.390 -1.730 25277 5511 1 12 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.620 0.490 25277 5512 1 12 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.712 1.218 25277 5513 1 12 . 1 1 127 127 LEU H H 127 8.790 8.790 8.538 0.252 25277 5514 1 12 . 1 1 128 128 GLY N N 128 106.600 106.600 108.826 -2.226 25277 5515 1 12 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.557 0.973 25277 5516 1 12 . 1 1 128 128 GLY H H 128 8.450 8.450 8.317 0.133 25277 5517 1 12 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.039 0.191 25277 5518 1 12 . 1 1 129 129 ALA C C 129 180.410 180.410 179.189 1.221 25277 5519 1 12 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.558 0.362 25277 5520 1 12 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.300 0.830 25277 5521 1 12 . 1 1 130 130 LEU N N 130 122.550 122.550 120.592 1.958 25277 5522 1 12 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.031 -0.111 25277 5523 1 12 . 1 1 130 130 LEU C C 130 179.020 179.020 178.446 0.574 25277 5524 1 12 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.426 0.204 25277 5525 1 12 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.608 0.532 25277 5526 1 12 . 1 1 130 130 LEU H H 130 8.040 8.040 7.418 0.622 25277 5527 1 12 . 1 1 131 131 LEU N N 131 121.910 121.910 119.296 2.614 25277 5528 1 12 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.860 0.060 25277 5529 1 12 . 1 1 131 131 LEU C C 131 177.910 177.910 178.393 -0.483 25277 5530 1 12 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.118 0.452 25277 5531 1 12 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.512 -0.792 25277 5532 1 12 . 1 1 131 131 LEU H H 131 9.060 9.060 7.830 1.230 25277 5533 1 12 . 1 1 132 132 SER N N 132 115.530 115.530 114.942 0.588 25277 5534 1 12 . 1 1 132 132 SER HA H 132 3.970 3.970 4.090 -0.120 25277 5535 1 12 . 1 1 132 132 SER C C 132 177.140 177.140 176.819 0.321 25277 5536 1 12 . 1 1 132 132 SER CA C 132 62.340 62.340 62.358 -0.019 25277 5537 1 12 . 1 1 132 132 SER CB C 132 62.370 62.370 62.835 -0.465 25277 5538 1 12 . 1 1 132 132 SER H H 132 8.730 8.730 8.124 0.606 25277 5539 1 12 . 1 1 133 133 THR N N 133 116.960 116.960 117.984 -1.024 25277 5540 1 12 . 1 1 133 133 THR HA H 133 3.860 3.860 4.041 -0.181 25277 5541 1 12 . 1 1 133 133 THR C C 133 175.670 175.670 176.465 -0.795 25277 5542 1 12 . 1 1 133 133 THR CA C 133 66.930 66.930 66.934 -0.004 25277 5543 1 12 . 1 1 133 133 THR CB C 133 68.880 68.880 68.334 0.546 25277 5544 1 12 . 1 1 133 133 THR H H 133 7.750 7.750 7.790 -0.040 25277 5545 1 12 . 1 1 134 134 THR N N 134 118.830 118.830 118.966 -0.136 25277 5546 1 12 . 1 1 134 134 THR HA H 134 3.780 3.780 4.116 -0.336 25277 5547 1 12 . 1 1 134 134 THR C C 134 176.750 176.750 176.471 0.279 25277 5548 1 12 . 1 1 134 134 THR CA C 134 67.650 67.650 66.606 1.044 25277 5549 1 12 . 1 1 134 134 THR CB C 134 67.560 67.560 68.383 -0.823 25277 5550 1 12 . 1 1 134 134 THR H H 134 7.570 7.570 7.746 -0.176 25277 5551 1 12 . 1 1 135 135 LEU N N 135 121.420 121.420 121.806 -0.386 25277 5552 1 12 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.943 0.547 25277 5553 1 12 . 1 1 135 135 LEU C C 135 180.050 180.050 179.026 1.024 25277 5554 1 12 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.280 -1.270 25277 5555 1 12 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.398 -0.788 25277 5556 1 12 . 1 1 135 135 LEU H H 135 8.650 8.650 8.373 0.277 25277 5557 1 12 . 1 1 136 136 ASN N N 136 117.010 117.010 117.404 -0.394 25277 5558 1 12 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.433 0.107 25277 5559 1 12 . 1 1 136 136 ASN C C 136 175.980 175.980 177.650 -1.670 25277 5560 1 12 . 1 1 136 136 ASN CA C 136 54.770 54.770 56.119 -1.349 25277 5561 1 12 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.668 -0.228 25277 5562 1 12 . 1 1 136 136 ASN H H 136 7.360 7.360 7.769 -0.409 25277 5563 1 12 . 1 1 137 137 LEU N N 137 116.940 116.940 119.531 -2.591 25277 5564 1 12 . 1 1 137 137 LEU HA H 137 4.160 4.160 3.958 0.202 25277 5565 1 12 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.742 -2.312 25277 5566 1 12 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.721 -0.151 25277 5567 1 12 . 1 1 137 137 LEU H H 137 7.810 7.810 7.606 0.204 25277 5568 1 12 . 1 1 138 138 CYS N N 138 115.430 115.430 114.964 0.466 25277 5569 1 12 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.250 0.160 25277 5570 1 12 . 1 1 138 138 CYS CA C 138 55.480 55.480 60.991 -5.511 25277 5571 1 12 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.382 14.818 25277 5572 1 12 . 1 1 138 138 CYS H H 138 7.450 7.450 7.887 -0.437 25277 5573 1 12 . 1 1 139 139 GLY C C 139 178.800 178.800 173.809 4.991 25277 5574 1 12 . 1 1 139 139 GLY CA C 139 45.500 45.500 45.024 0.476 25277 5575 1 12 . 1 1 140 140 LYS N N 140 119.830 119.830 122.152 -2.322 25277 5576 1 12 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.417 -0.097 25277 5577 1 12 . 1 1 140 140 LYS C C 140 175.820 175.820 177.125 -1.305 25277 5578 1 12 . 1 1 140 140 LYS CA C 140 55.680 55.680 56.270 -0.590 25277 5579 1 12 . 1 1 140 140 LYS CB C 140 32.800 32.800 33.180 -0.380 25277 5580 1 12 . 1 1 140 140 LYS H H 140 7.760 7.760 7.415 0.345 25277 5581 1 13 . 1 1 27 27 PRO CA C 27 63.230 63.230 62.316 0.914 25277 5582 1 13 . 1 1 27 27 PRO CB C 27 32.050 32.050 32.159 -0.109 25277 5583 1 13 . 1 1 28 28 ASP N N 28 120.030 120.030 120.106 -0.076 25277 5584 1 13 . 1 1 28 28 ASP C C 28 176.130 176.130 175.717 0.413 25277 5585 1 13 . 1 1 28 28 ASP CA C 28 54.170 54.170 53.779 0.391 25277 5586 1 13 . 1 1 28 28 ASP CB C 28 40.860 40.860 41.025 -0.165 25277 5587 1 13 . 1 1 28 28 ASP H H 28 8.260 8.260 8.348 -0.088 25277 5588 1 13 . 1 1 29 29 LEU N N 29 123.030 123.030 123.084 -0.054 25277 5589 1 13 . 1 1 29 29 LEU C C 29 177.870 177.870 177.063 0.807 25277 5590 1 13 . 1 1 29 29 LEU CA C 29 55.160 55.160 54.764 0.396 25277 5591 1 13 . 1 1 29 29 LEU CB C 29 42.270 42.270 43.497 -1.227 25277 5592 1 13 . 1 1 29 29 LEU H H 29 8.120 8.120 8.326 -0.206 25277 5593 1 13 . 1 1 30 30 GLY N N 30 109.350 109.350 113.055 -3.705 25277 5594 1 13 . 1 1 30 30 GLY CA C 30 45.340 45.340 44.318 1.022 25277 5595 1 13 . 1 1 30 30 GLY H H 30 8.410 8.410 8.323 0.087 25277 5596 1 13 . 1 1 44 44 PRO CA C 44 63.590 63.590 62.924 0.666 25277 5597 1 13 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.117 -0.127 25277 5598 1 13 . 1 1 45 45 ALA N N 45 122.140 122.140 120.546 1.594 25277 5599 1 13 . 1 1 45 45 ALA CA C 45 52.670 52.670 51.501 1.169 25277 5600 1 13 . 1 1 45 45 ALA H H 45 8.350 8.350 8.011 0.339 25277 5601 1 13 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.498 -0.198 25277 5602 1 13 . 1 1 49 49 PRO CA C 49 62.950 62.950 63.233 -0.283 25277 5603 1 13 . 1 1 49 49 PRO CB C 49 31.990 31.990 31.832 0.157 25277 5604 1 13 . 1 1 50 50 VAL N N 50 124.190 124.190 126.856 -2.666 25277 5605 1 13 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.366 -0.046 25277 5606 1 13 . 1 1 50 50 VAL CA C 50 59.850 59.850 59.733 0.117 25277 5607 1 13 . 1 1 50 50 VAL CB C 50 32.480 32.480 32.487 -0.007 25277 5608 1 13 . 1 1 50 50 VAL H H 50 8.070 8.070 8.168 -0.098 25277 5609 1 13 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.323 0.027 25277 5610 1 13 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.221 -0.291 25277 5611 1 13 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.173 -0.193 25277 5612 1 13 . 1 1 52 52 LEU N N 52 124.500 124.500 121.585 2.915 25277 5613 1 13 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.283 0.207 25277 5614 1 13 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.665 -0.775 25277 5615 1 13 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.347 0.843 25277 5616 1 13 . 1 1 52 52 LEU H H 52 8.360 8.360 8.190 0.170 25277 5617 1 13 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.457 -0.047 25277 5618 1 13 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.383 -0.052 25277 5619 1 13 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.270 -0.280 25277 5620 1 13 . 1 1 54 54 SER N N 54 117.380 117.380 116.280 1.100 25277 5621 1 13 . 1 1 54 54 SER HA H 54 4.600 4.600 4.420 0.180 25277 5622 1 13 . 1 1 54 54 SER CA C 54 56.710 56.710 57.923 -1.213 25277 5623 1 13 . 1 1 54 54 SER CB C 54 62.500 62.500 62.785 -0.285 25277 5624 1 13 . 1 1 54 54 SER H H 54 8.400 8.400 8.342 0.058 25277 5625 1 13 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.538 0.012 25277 5626 1 13 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.359 0.181 25277 5627 1 13 . 1 1 55 55 PRO CB C 55 32.620 32.620 32.368 0.252 25277 5628 1 13 . 1 1 57 57 SER HA H 57 4.420 4.420 4.323 0.097 25277 5629 1 13 . 1 1 57 57 SER CA C 57 57.580 57.580 60.623 -3.043 25277 5630 1 13 . 1 1 57 57 SER CB C 57 63.780 63.780 62.936 0.844 25277 5631 1 13 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.223 0.767 25277 5632 1 13 . 1 1 58 58 ASN C C 58 172.230 172.230 173.646 -1.416 25277 5633 1 13 . 1 1 58 58 ASN CA C 58 53.670 53.670 54.812 -1.142 25277 5634 1 13 . 1 1 58 58 ASN CB C 58 37.850 37.850 37.114 0.736 25277 5635 1 13 . 1 1 59 59 LYS N N 59 117.660 117.660 118.864 -1.204 25277 5636 1 13 . 1 1 59 59 LYS HA H 59 5.360 5.360 4.968 0.392 25277 5637 1 13 . 1 1 59 59 LYS C C 59 175.120 175.120 173.937 1.183 25277 5638 1 13 . 1 1 59 59 LYS CA C 59 54.860 54.860 55.952 -1.092 25277 5639 1 13 . 1 1 59 59 LYS CB C 59 36.450 36.450 36.167 0.283 25277 5640 1 13 . 1 1 59 59 LYS H H 59 7.640 7.640 7.697 -0.057 25277 5641 1 13 . 1 1 60 60 GLN N N 60 120.680 120.680 121.656 -0.976 25277 5642 1 13 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.655 -0.165 25277 5643 1 13 . 1 1 60 60 GLN C C 60 173.640 173.640 173.265 0.375 25277 5644 1 13 . 1 1 60 60 GLN CA C 60 55.480 55.480 54.707 0.773 25277 5645 1 13 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.185 -0.195 25277 5646 1 13 . 1 1 60 60 GLN H H 60 8.930 8.930 8.391 0.539 25277 5647 1 13 . 1 1 61 61 ASP N N 61 126.170 126.170 121.290 4.880 25277 5648 1 13 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.849 0.201 25277 5649 1 13 . 1 1 61 61 ASP C C 61 175.000 175.000 175.199 -0.199 25277 5650 1 13 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.283 0.597 25277 5651 1 13 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.651 -0.881 25277 5652 1 13 . 1 1 61 61 ASP H H 61 8.540 8.540 8.567 -0.027 25277 5653 1 13 . 1 1 62 62 ILE N N 62 121.100 121.100 125.585 -4.485 25277 5654 1 13 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.547 0.233 25277 5655 1 13 . 1 1 62 62 ILE C C 62 171.480 171.480 173.641 -2.161 25277 5656 1 13 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.614 0.477 25277 5657 1 13 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.530 0.610 25277 5658 1 13 . 1 1 62 62 ILE H H 62 8.970 8.970 8.419 0.551 25277 5659 1 13 . 1 1 63 63 SER N N 63 119.430 119.430 121.863 -2.433 25277 5660 1 13 . 1 1 63 63 SER HA H 63 4.680 4.680 4.523 0.157 25277 5661 1 13 . 1 1 63 63 SER C C 63 174.030 174.030 174.502 -0.472 25277 5662 1 13 . 1 1 63 63 SER CA C 63 56.550 56.550 56.130 0.420 25277 5663 1 13 . 1 1 63 63 SER CB C 63 67.320 67.320 66.279 1.041 25277 5664 1 13 . 1 1 63 63 SER H H 63 8.520 8.520 8.244 0.276 25277 5665 1 13 . 1 1 64 64 GLU N N 64 121.250 121.250 120.108 1.142 25277 5666 1 13 . 1 1 64 64 GLU HA H 64 2.770 2.770 3.001 -0.231 25277 5667 1 13 . 1 1 64 64 GLU C C 64 177.190 177.190 177.967 -0.777 25277 5668 1 13 . 1 1 64 64 GLU CA C 64 58.590 58.590 58.967 -0.377 25277 5669 1 13 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.606 -0.466 25277 5670 1 13 . 1 1 64 64 GLU H H 64 7.400 7.400 7.575 -0.175 25277 5671 1 13 . 1 1 65 65 ALA N N 65 119.250 119.250 121.816 -2.566 25277 5672 1 13 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.882 -0.022 25277 5673 1 13 . 1 1 65 65 ALA C C 65 179.630 179.630 179.434 0.196 25277 5674 1 13 . 1 1 65 65 ALA CA C 65 53.810 53.810 54.743 -0.933 25277 5675 1 13 . 1 1 65 65 ALA CB C 65 18.400 18.400 17.945 0.455 25277 5676 1 13 . 1 1 65 65 ALA H H 65 7.700 7.700 8.278 -0.578 25277 5677 1 13 . 1 1 66 66 ASN N N 66 112.360 112.360 115.253 -2.893 25277 5678 1 13 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.605 0.425 25277 5679 1 13 . 1 1 66 66 ASN C C 66 174.580 174.580 176.815 -2.235 25277 5680 1 13 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.736 -0.186 25277 5681 1 13 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.735 1.195 25277 5682 1 13 . 1 1 66 66 ASN H H 66 7.960 7.960 7.308 0.652 25277 5683 1 13 . 1 1 67 67 LEU N N 67 115.390 115.390 117.751 -2.361 25277 5684 1 13 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.433 0.217 25277 5685 1 13 . 1 1 67 67 LEU C C 67 176.500 176.500 176.382 0.118 25277 5686 1 13 . 1 1 67 67 LEU CA C 67 54.350 54.350 55.219 -0.869 25277 5687 1 13 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.168 2.502 25277 5688 1 13 . 1 1 67 67 LEU H H 67 7.050 7.050 7.502 -0.452 25277 5689 1 13 . 1 1 68 68 ALA N N 68 125.680 125.680 121.268 4.412 25277 5690 1 13 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.772 0.118 25277 5691 1 13 . 1 1 68 68 ALA C C 68 177.480 177.480 177.587 -0.107 25277 5692 1 13 . 1 1 68 68 ALA CA C 68 53.550 53.550 53.711 -0.161 25277 5693 1 13 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.227 -0.077 25277 5694 1 13 . 1 1 68 68 ALA H H 68 8.880 8.880 7.876 1.004 25277 5695 1 13 . 1 1 69 69 TYR N N 69 119.780 119.780 118.884 0.896 25277 5696 1 13 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.288 0.202 25277 5697 1 13 . 1 1 69 69 TYR C C 69 175.340 175.340 177.249 -1.909 25277 5698 1 13 . 1 1 69 69 TYR CA C 69 58.640 58.640 61.096 -2.456 25277 5699 1 13 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.085 -0.805 25277 5700 1 13 . 1 1 69 69 TYR H H 69 7.420 7.420 8.397 -0.977 25277 5701 1 13 . 1 1 70 70 LEU N N 70 118.820 118.820 117.071 1.749 25277 5702 1 13 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.142 0.148 25277 5703 1 13 . 1 1 70 70 LEU C C 70 176.770 176.770 177.481 -0.711 25277 5704 1 13 . 1 1 70 70 LEU CA C 70 53.880 53.880 55.728 -1.848 25277 5705 1 13 . 1 1 70 70 LEU CB C 70 41.300 41.300 41.750 -0.450 25277 5706 1 13 . 1 1 70 70 LEU H H 70 7.690 7.690 7.478 0.212 25277 5707 1 13 . 1 1 71 71 TRP N N 71 124.110 124.110 122.600 1.510 25277 5708 1 13 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.547 0.043 25277 5709 1 13 . 1 1 71 71 TRP CA C 71 54.150 54.150 56.096 -1.946 25277 5710 1 13 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.325 -0.115 25277 5711 1 13 . 1 1 71 71 TRP H H 71 8.130 8.130 7.711 0.419 25277 5712 1 13 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.377 0.203 25277 5713 1 13 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.214 0.376 25277 5714 1 13 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.738 -1.678 25277 5715 1 13 . 1 1 73 73 LEU N N 73 118.760 118.760 117.951 0.809 25277 5716 1 13 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.509 0.891 25277 5717 1 13 . 1 1 73 73 LEU C C 73 176.620 176.620 178.246 -1.626 25277 5718 1 13 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.876 -0.826 25277 5719 1 13 . 1 1 73 73 LEU CB C 73 44.260 44.260 43.020 1.240 25277 5720 1 13 . 1 1 73 73 LEU H H 73 5.190 5.190 6.596 -1.406 25277 5721 1 13 . 1 1 74 74 THR N N 74 110.120 110.120 115.130 -5.010 25277 5722 1 13 . 1 1 74 74 THR HA H 74 4.250 4.250 4.217 0.033 25277 5723 1 13 . 1 1 74 74 THR C C 74 176.080 176.080 175.599 0.481 25277 5724 1 13 . 1 1 74 74 THR CA C 74 62.690 62.690 64.005 -1.315 25277 5725 1 13 . 1 1 74 74 THR CB C 74 67.930 67.930 69.129 -1.199 25277 5726 1 13 . 1 1 74 74 THR H H 74 9.010 9.010 8.618 0.392 25277 5727 1 13 . 1 1 75 75 VAL N N 75 113.030 113.030 119.386 -6.356 25277 5728 1 13 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.204 0.606 25277 5729 1 13 . 1 1 75 75 VAL C C 75 176.010 176.010 177.044 -1.034 25277 5730 1 13 . 1 1 75 75 VAL CA C 75 59.100 59.100 62.737 -3.637 25277 5731 1 13 . 1 1 75 75 VAL CB C 75 33.220 33.220 32.466 0.754 25277 5732 1 13 . 1 1 75 75 VAL H H 75 6.660 6.660 7.685 -1.025 25277 5733 1 13 . 1 1 76 76 ASP N N 76 119.590 119.590 124.477 -4.887 25277 5734 1 13 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.559 -0.069 25277 5735 1 13 . 1 1 76 76 ASP C C 76 175.060 175.060 176.204 -1.144 25277 5736 1 13 . 1 1 76 76 ASP CA C 76 55.110 55.110 57.104 -1.994 25277 5737 1 13 . 1 1 76 76 ASP CB C 76 41.300 41.300 41.246 0.054 25277 5738 1 13 . 1 1 76 76 ASP H H 76 8.770 8.770 9.056 -0.286 25277 5739 1 13 . 1 1 77 77 HIS N N 77 113.300 113.300 112.098 1.202 25277 5740 1 13 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.706 0.384 25277 5741 1 13 . 1 1 77 77 HIS C C 77 171.370 171.370 173.879 -2.509 25277 5742 1 13 . 1 1 77 77 HIS CA C 77 55.590 55.590 54.533 1.057 25277 5743 1 13 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.616 -2.426 25277 5744 1 13 . 1 1 77 77 HIS H H 77 7.650 7.650 7.669 -0.019 25277 5745 1 13 . 1 1 78 78 GLY N N 78 101.350 101.350 105.368 -4.018 25277 5746 1 13 . 1 1 78 78 GLY C C 78 172.110 172.110 172.399 -0.289 25277 5747 1 13 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.818 -0.008 25277 5748 1 13 . 1 1 78 78 GLY H H 78 8.450 8.450 8.743 -0.293 25277 5749 1 13 . 1 1 79 79 THR N N 79 120.230 120.230 116.945 3.285 25277 5750 1 13 . 1 1 79 79 THR HA H 79 5.110 5.110 4.885 0.225 25277 5751 1 13 . 1 1 79 79 THR C C 79 172.920 172.920 173.742 -0.822 25277 5752 1 13 . 1 1 79 79 THR CA C 79 61.480 61.480 62.042 -0.562 25277 5753 1 13 . 1 1 79 79 THR CB C 79 72.130 72.130 70.794 1.336 25277 5754 1 13 . 1 1 79 79 THR H H 79 8.080 8.080 8.496 -0.416 25277 5755 1 13 . 1 1 80 80 ILE N N 80 119.620 119.620 120.617 -0.997 25277 5756 1 13 . 1 1 80 80 ILE HA H 80 5.140 5.140 5.014 0.126 25277 5757 1 13 . 1 1 80 80 ILE C C 80 174.340 174.340 174.066 0.274 25277 5758 1 13 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.178 0.172 25277 5759 1 13 . 1 1 80 80 ILE CB C 80 39.550 39.550 40.245 -0.695 25277 5760 1 13 . 1 1 80 80 ILE H H 80 8.970 8.970 8.755 0.215 25277 5761 1 13 . 1 1 81 81 GLU N N 81 119.960 119.960 121.997 -2.037 25277 5762 1 13 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.176 -0.176 25277 5763 1 13 . 1 1 81 81 GLU C C 81 176.130 176.130 174.792 1.338 25277 5764 1 13 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.230 0.330 25277 5765 1 13 . 1 1 81 81 GLU CB C 81 33.390 33.390 33.667 -0.278 25277 5766 1 13 . 1 1 81 81 GLU H H 81 8.350 8.350 8.346 0.004 25277 5767 1 13 . 1 1 82 82 CYS N N 82 123.110 123.110 121.731 1.379 25277 5768 1 13 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.256 -0.326 25277 5769 1 13 . 1 1 82 82 CYS C C 82 174.430 174.430 175.249 -0.819 25277 5770 1 13 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.325 -5.085 25277 5771 1 13 . 1 1 82 82 CYS CB C 82 43.720 43.720 27.276 16.445 25277 5772 1 13 . 1 1 82 82 CYS H H 82 8.220 8.220 8.371 -0.151 25277 5773 1 13 . 1 1 83 83 LEU N N 83 131.660 131.660 126.702 4.958 25277 5774 1 13 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.687 -0.157 25277 5775 1 13 . 1 1 83 83 LEU CA C 83 53.900 53.900 53.085 0.815 25277 5776 1 13 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.355 -2.155 25277 5777 1 13 . 1 1 83 83 LEU H H 83 8.910 8.910 8.152 0.758 25277 5778 1 13 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.211 0.159 25277 5779 1 13 . 1 1 84 84 PRO CA C 84 63.190 63.190 65.253 -2.063 25277 5780 1 13 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.751 0.179 25277 5781 1 13 . 1 1 85 85 SER N N 85 117.620 117.620 112.742 4.878 25277 5782 1 13 . 1 1 85 85 SER HA H 85 3.870 3.870 4.423 -0.553 25277 5783 1 13 . 1 1 85 85 SER C C 85 174.350 174.350 173.808 0.542 25277 5784 1 13 . 1 1 85 85 SER CA C 85 58.970 58.970 58.568 0.402 25277 5785 1 13 . 1 1 85 85 SER CB C 85 63.820 63.820 63.000 0.820 25277 5786 1 13 . 1 1 85 85 SER H H 85 7.660 7.660 8.133 -0.473 25277 5787 1 13 . 1 1 86 86 ASP N N 86 117.590 117.590 117.608 -0.018 25277 5788 1 13 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.337 -0.197 25277 5789 1 13 . 1 1 86 86 ASP C C 86 174.480 174.480 174.244 0.236 25277 5790 1 13 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.575 -0.595 25277 5791 1 13 . 1 1 86 86 ASP CB C 86 37.850 37.850 38.789 -0.939 25277 5792 1 13 . 1 1 86 86 ASP H H 86 8.490 8.490 8.307 0.183 25277 5793 1 13 . 1 1 87 87 ASN N N 87 117.160 117.160 117.289 -0.129 25277 5794 1 13 . 1 1 87 87 ASN HA H 87 4.530 4.530 5.032 -0.502 25277 5795 1 13 . 1 1 87 87 ASN CA C 87 52.480 52.480 52.048 0.432 25277 5796 1 13 . 1 1 87 87 ASN CB C 87 40.040 40.040 40.679 -0.639 25277 5797 1 13 . 1 1 87 87 ASN H H 87 7.260 7.260 7.645 -0.385 25277 5798 1 13 . 1 1 88 88 ALA HA H 88 4.730 4.730 4.737 -0.008 25277 5799 1 13 . 1 1 88 88 ALA C C 88 174.620 174.620 176.242 -1.622 25277 5800 1 13 . 1 1 88 88 ALA CA C 88 51.230 51.230 50.847 0.383 25277 5801 1 13 . 1 1 88 88 ALA CB C 88 20.540 20.540 19.970 0.570 25277 5802 1 13 . 1 1 89 89 VAL N N 89 116.580 116.580 117.317 -0.737 25277 5803 1 13 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.076 0.024 25277 5804 1 13 . 1 1 89 89 VAL C C 89 172.750 172.750 173.564 -0.814 25277 5805 1 13 . 1 1 89 89 VAL CA C 89 58.980 58.980 59.417 -0.437 25277 5806 1 13 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.528 0.692 25277 5807 1 13 . 1 1 89 89 VAL H H 89 8.740 8.740 8.269 0.471 25277 5808 1 13 . 1 1 90 90 PHE N N 90 120.300 120.300 123.613 -3.313 25277 5809 1 13 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.143 0.007 25277 5810 1 13 . 1 1 90 90 PHE C C 90 172.910 172.910 173.617 -0.707 25277 5811 1 13 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.595 0.205 25277 5812 1 13 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.558 1.092 25277 5813 1 13 . 1 1 90 90 PHE H H 90 8.950 8.950 9.093 -0.143 25277 5814 1 13 . 1 1 91 91 VAL N N 91 129.020 129.020 128.443 0.577 25277 5815 1 13 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.653 -0.193 25277 5816 1 13 . 1 1 91 91 VAL C C 91 175.910 175.910 174.050 1.860 25277 5817 1 13 . 1 1 91 91 VAL CA C 91 60.780 60.780 60.613 0.167 25277 5818 1 13 . 1 1 91 91 VAL CB C 91 32.020 32.020 34.026 -2.006 25277 5819 1 13 . 1 1 91 91 VAL H H 91 9.090 9.090 8.672 0.418 25277 5820 1 13 . 1 1 92 92 ALA N N 92 129.760 129.760 129.258 0.502 25277 5821 1 13 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.774 -0.274 25277 5822 1 13 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.637 2.213 25277 5823 1 13 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.399 -1.349 25277 5824 1 13 . 1 1 92 92 ALA H H 92 8.680 8.680 8.476 0.204 25277 5825 1 13 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.074 0.086 25277 5826 1 13 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.105 0.296 25277 5827 1 13 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.614 0.326 25277 5828 1 13 . 1 1 94 94 ASP N N 94 113.220 113.220 114.980 -1.760 25277 5829 1 13 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.468 -0.048 25277 5830 1 13 . 1 1 94 94 ASP C C 94 176.980 176.980 177.482 -0.502 25277 5831 1 13 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.997 -0.467 25277 5832 1 13 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.871 -0.291 25277 5833 1 13 . 1 1 94 94 ASP H H 94 7.890 7.890 7.812 0.078 25277 5834 1 13 . 1 1 95 95 GLY N N 95 109.120 109.120 108.322 0.798 25277 5835 1 13 . 1 1 95 95 GLY C C 95 174.440 174.440 174.341 0.099 25277 5836 1 13 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.123 -0.562 25277 5837 1 13 . 1 1 95 95 GLY H H 95 8.500 8.500 8.167 0.333 25277 5838 1 13 . 1 1 96 96 THR N N 96 120.350 120.350 118.551 1.799 25277 5839 1 13 . 1 1 96 96 THR HA H 96 3.780 3.780 4.449 -0.669 25277 5840 1 13 . 1 1 96 96 THR C C 96 172.590 172.590 173.278 -0.688 25277 5841 1 13 . 1 1 96 96 THR CA C 96 64.660 64.660 61.981 2.679 25277 5842 1 13 . 1 1 96 96 THR CB C 96 68.330 68.330 70.072 -1.742 25277 5843 1 13 . 1 1 96 96 THR H H 96 8.100 8.100 8.436 -0.336 25277 5844 1 13 . 1 1 97 97 THR N N 97 122.660 122.660 121.292 1.368 25277 5845 1 13 . 1 1 97 97 THR HA H 97 4.590 4.590 4.818 -0.228 25277 5846 1 13 . 1 1 97 97 THR C C 97 173.000 173.000 173.877 -0.877 25277 5847 1 13 . 1 1 97 97 THR CA C 97 62.700 62.700 62.216 0.484 25277 5848 1 13 . 1 1 97 97 THR CB C 97 68.840 68.840 70.053 -1.213 25277 5849 1 13 . 1 1 97 97 THR H H 97 7.850 7.850 8.417 -0.567 25277 5850 1 13 . 1 1 98 98 TYR N N 98 122.890 122.890 125.854 -2.964 25277 5851 1 13 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.323 -0.383 25277 5852 1 13 . 1 1 98 98 TYR C C 98 178.970 178.970 174.702 4.268 25277 5853 1 13 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.144 0.366 25277 5854 1 13 . 1 1 98 98 TYR CB C 98 42.950 42.950 42.148 0.802 25277 5855 1 13 . 1 1 98 98 TYR H H 98 9.460 9.460 9.319 0.141 25277 5856 1 13 . 1 1 99 99 ALA N N 99 121.760 121.760 123.688 -1.928 25277 5857 1 13 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.612 -0.502 25277 5858 1 13 . 1 1 99 99 ALA C C 99 178.010 178.010 176.206 1.804 25277 5859 1 13 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.226 1.044 25277 5860 1 13 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.723 2.327 25277 5861 1 13 . 1 1 99 99 ALA H H 99 9.110 9.110 8.893 0.217 25277 5862 1 13 . 1 1 100 100 LEU N N 100 119.330 119.330 124.188 -4.858 25277 5863 1 13 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.247 0.223 25277 5864 1 13 . 1 1 100 100 LEU C C 100 174.720 174.720 177.381 -2.661 25277 5865 1 13 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.387 -2.247 25277 5866 1 13 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.725 1.905 25277 5867 1 13 . 1 1 100 100 LEU H H 100 8.950 8.950 8.226 0.724 25277 5868 1 13 . 1 1 101 101 ASN N N 101 112.600 112.600 116.119 -3.519 25277 5869 1 13 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.813 0.107 25277 5870 1 13 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.553 -1.623 25277 5871 1 13 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.922 0.677 25277 5872 1 13 . 1 1 101 101 ASN H H 101 7.550 7.550 7.601 -0.051 25277 5873 1 13 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.287 -0.097 25277 5874 1 13 . 1 1 102 102 ASP C C 102 178.770 178.770 177.698 1.072 25277 5875 1 13 . 1 1 102 102 ASP CA C 102 56.880 56.880 57.737 -0.857 25277 5876 1 13 . 1 1 102 102 ASP CB C 102 39.980 39.980 41.249 -1.269 25277 5877 1 13 . 1 1 103 103 ARG N N 103 119.370 119.370 119.421 -0.051 25277 5878 1 13 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.085 -0.256 25277 5879 1 13 . 1 1 103 103 ARG C C 103 178.550 178.550 178.366 0.184 25277 5880 1 13 . 1 1 103 103 ARG CA C 103 59.380 59.380 59.114 0.267 25277 5881 1 13 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.942 -0.442 25277 5882 1 13 . 1 1 103 103 ARG H H 103 7.970 7.970 8.072 -0.102 25277 5883 1 13 . 1 1 104 104 ALA N N 104 120.110 120.110 122.181 -2.071 25277 5884 1 13 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.053 0.157 25277 5885 1 13 . 1 1 104 104 ALA C C 104 179.510 179.510 179.571 -0.061 25277 5886 1 13 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.327 -0.577 25277 5887 1 13 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.236 1.434 25277 5888 1 13 . 1 1 104 104 ALA H H 104 7.610 7.610 8.447 -0.837 25277 5889 1 13 . 1 1 105 105 GLU N N 105 120.460 120.460 118.351 2.109 25277 5890 1 13 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.140 0.570 25277 5891 1 13 . 1 1 105 105 GLU C C 105 181.710 181.710 179.697 2.013 25277 5892 1 13 . 1 1 105 105 GLU CA C 105 58.680 58.680 58.761 -0.081 25277 5893 1 13 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.317 0.173 25277 5894 1 13 . 1 1 105 105 GLU H H 105 7.750 7.750 7.802 -0.052 25277 5895 1 13 . 1 1 106 106 LYS N N 106 121.980 121.980 120.624 1.356 25277 5896 1 13 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.120 -0.100 25277 5897 1 13 . 1 1 106 106 LYS C C 106 177.890 177.890 178.298 -0.408 25277 5898 1 13 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.708 -0.238 25277 5899 1 13 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.424 -0.694 25277 5900 1 13 . 1 1 106 106 LYS H H 106 8.380 8.380 7.980 0.400 25277 5901 1 13 . 1 1 107 107 ALA N N 107 119.850 119.850 119.068 0.782 25277 5902 1 13 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.320 -0.060 25277 5903 1 13 . 1 1 107 107 ALA C C 107 177.210 177.210 177.706 -0.496 25277 5904 1 13 . 1 1 107 107 ALA CA C 107 52.270 52.270 52.316 -0.046 25277 5905 1 13 . 1 1 107 107 ALA CB C 107 18.740 18.740 19.126 -0.386 25277 5906 1 13 . 1 1 107 107 ALA H H 107 7.400 7.400 7.689 -0.289 25277 5907 1 13 . 1 1 108 108 GLY N N 108 104.560 104.560 105.975 -1.415 25277 5908 1 13 . 1 1 108 108 GLY C C 108 174.300 174.300 174.516 -0.216 25277 5909 1 13 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.021 -0.411 25277 5910 1 13 . 1 1 108 108 GLY H H 108 7.560 7.560 7.845 -0.285 25277 5911 1 13 . 1 1 109 109 HIS N N 109 122.550 122.550 120.792 1.758 25277 5912 1 13 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.835 -0.065 25277 5913 1 13 . 1 1 109 109 HIS CA C 109 54.580 54.580 55.031 -0.451 25277 5914 1 13 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.866 -1.276 25277 5915 1 13 . 1 1 109 109 HIS H H 109 7.590 7.590 7.759 -0.169 25277 5916 1 13 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.813 -0.253 25277 5917 1 13 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.204 0.526 25277 5918 1 13 . 1 1 111 111 PRO CB C 111 32.800 32.800 33.201 -0.401 25277 5919 1 13 . 1 1 112 112 ILE N N 112 119.770 119.770 119.300 0.470 25277 5920 1 13 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.342 0.518 25277 5921 1 13 . 1 1 112 112 ILE C C 112 172.800 172.800 177.467 -4.667 25277 5922 1 13 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.312 -2.122 25277 5923 1 13 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.425 3.015 25277 5924 1 13 . 1 1 112 112 ILE H H 112 7.890 7.890 8.536 -0.646 25277 5925 1 13 . 1 1 113 113 THR N N 113 113.610 113.610 115.975 -2.365 25277 5926 1 13 . 1 1 113 113 THR HA H 113 3.010 3.010 4.031 -1.021 25277 5927 1 13 . 1 1 113 113 THR CA C 113 66.860 66.860 68.007 -1.147 25277 5928 1 13 . 1 1 113 113 THR CB C 113 66.920 66.920 67.391 -0.471 25277 5929 1 13 . 1 1 113 113 THR H H 113 7.070 7.070 8.553 -1.483 25277 5930 1 13 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.320 0.020 25277 5931 1 13 . 1 1 114 114 PRO CA C 114 66.080 66.080 65.296 0.784 25277 5932 1 13 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.484 0.596 25277 5933 1 13 . 1 1 115 115 ILE N N 115 134.770 134.770 110.126 24.644 25277 5934 1 13 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.439 0.171 25277 5935 1 13 . 1 1 115 115 ILE C C 115 174.800 174.800 174.709 0.091 25277 5936 1 13 . 1 1 115 115 ILE CA C 115 60.000 60.000 59.898 0.102 25277 5937 1 13 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.278 0.582 25277 5938 1 13 . 1 1 115 115 ILE H H 115 7.510 7.510 7.555 -0.045 25277 5939 1 13 . 1 1 116 116 ARG N N 116 120.890 120.890 121.794 -0.904 25277 5940 1 13 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.197 -0.227 25277 5941 1 13 . 1 1 116 116 ARG C C 116 174.910 174.910 175.872 -0.962 25277 5942 1 13 . 1 1 116 116 ARG CA C 116 57.780 57.780 54.943 2.837 25277 5943 1 13 . 1 1 116 116 ARG CB C 116 31.870 31.870 30.357 1.513 25277 5944 1 13 . 1 1 116 116 ARG H H 116 7.280 7.280 7.460 -0.180 25277 5945 1 13 . 1 1 117 117 ALA N N 117 125.400 125.400 124.746 0.654 25277 5946 1 13 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.429 -0.199 25277 5947 1 13 . 1 1 117 117 ALA C C 117 176.290 176.290 176.502 -0.212 25277 5948 1 13 . 1 1 117 117 ALA CA C 117 50.780 50.780 50.952 -0.172 25277 5949 1 13 . 1 1 117 117 ALA CB C 117 20.290 20.290 20.457 -0.167 25277 5950 1 13 . 1 1 117 117 ALA H H 117 8.150 8.150 8.285 -0.135 25277 5951 1 13 . 1 1 118 118 LYS N N 118 119.890 119.890 122.821 -2.931 25277 5952 1 13 . 1 1 118 118 LYS HA H 118 4.590 4.590 4.527 0.063 25277 5953 1 13 . 1 1 118 118 LYS C C 118 177.400 177.400 176.014 1.386 25277 5954 1 13 . 1 1 118 118 LYS CA C 118 55.670 55.670 55.318 0.352 25277 5955 1 13 . 1 1 118 118 LYS CB C 118 34.510 34.510 33.060 1.450 25277 5956 1 13 . 1 1 118 118 LYS H H 118 8.360 8.360 8.290 0.070 25277 5957 1 13 . 1 1 119 119 GLY N N 119 108.630 108.630 110.461 -1.831 25277 5958 1 13 . 1 1 119 119 GLY CA C 119 43.610 43.610 43.680 -0.070 25277 5959 1 13 . 1 1 119 119 GLY H H 119 8.320 8.320 8.501 -0.181 25277 5960 1 13 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.816 0.084 25277 5961 1 13 . 1 1 124 124 TYR C C 124 177.430 177.430 176.069 1.361 25277 5962 1 13 . 1 1 124 124 TYR CA C 124 57.970 57.970 57.529 0.441 25277 5963 1 13 . 1 1 124 124 TYR CB C 124 38.650 38.650 40.298 -1.648 25277 5964 1 13 . 1 1 125 125 ILE N N 125 123.670 123.670 124.140 -0.470 25277 5965 1 13 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.200 -0.360 25277 5966 1 13 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.233 0.497 25277 5967 1 13 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.450 0.060 25277 5968 1 13 . 1 1 125 125 ILE H H 125 8.340 8.340 7.926 0.414 25277 5969 1 13 . 1 1 126 126 SER HA H 126 4.070 4.070 4.393 -0.323 25277 5970 1 13 . 1 1 126 126 SER C C 126 176.290 176.290 174.924 1.366 25277 5971 1 13 . 1 1 126 126 SER CA C 126 59.190 59.190 59.201 -0.011 25277 5972 1 13 . 1 1 126 126 SER CB C 126 63.200 63.200 63.724 -0.524 25277 5973 1 13 . 1 1 127 127 LEU N N 127 127.030 127.030 124.533 2.497 25277 5974 1 13 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.371 -0.431 25277 5975 1 13 . 1 1 127 127 LEU C C 127 176.660 176.660 178.280 -1.620 25277 5976 1 13 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.566 0.543 25277 5977 1 13 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.929 1.001 25277 5978 1 13 . 1 1 127 127 LEU H H 127 8.790 8.790 8.291 0.499 25277 5979 1 13 . 1 1 128 128 GLY N N 128 106.600 106.600 108.861 -2.261 25277 5980 1 13 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.637 0.893 25277 5981 1 13 . 1 1 128 128 GLY H H 128 8.450 8.450 8.303 0.147 25277 5982 1 13 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.037 0.193 25277 5983 1 13 . 1 1 129 129 ALA C C 129 180.410 180.410 179.221 1.189 25277 5984 1 13 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.608 0.312 25277 5985 1 13 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.335 0.795 25277 5986 1 13 . 1 1 130 130 LEU N N 130 122.550 122.550 120.547 2.003 25277 5987 1 13 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.048 -0.128 25277 5988 1 13 . 1 1 130 130 LEU C C 130 179.020 179.020 178.492 0.528 25277 5989 1 13 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.424 0.206 25277 5990 1 13 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.628 0.512 25277 5991 1 13 . 1 1 130 130 LEU H H 130 8.040 8.040 7.463 0.577 25277 5992 1 13 . 1 1 131 131 LEU N N 131 121.910 121.910 119.461 2.449 25277 5993 1 13 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.885 0.035 25277 5994 1 13 . 1 1 131 131 LEU C C 131 177.910 177.910 178.465 -0.555 25277 5995 1 13 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.077 0.493 25277 5996 1 13 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.523 -0.803 25277 5997 1 13 . 1 1 131 131 LEU H H 131 9.060 9.060 7.839 1.221 25277 5998 1 13 . 1 1 132 132 SER N N 132 115.530 115.530 114.935 0.595 25277 5999 1 13 . 1 1 132 132 SER HA H 132 3.970 3.970 4.077 -0.107 25277 6000 1 13 . 1 1 132 132 SER C C 132 177.140 177.140 176.935 0.205 25277 6001 1 13 . 1 1 132 132 SER CA C 132 62.340 62.340 62.374 -0.034 25277 6002 1 13 . 1 1 132 132 SER CB C 132 62.370 62.370 62.876 -0.506 25277 6003 1 13 . 1 1 132 132 SER H H 132 8.730 8.730 8.266 0.464 25277 6004 1 13 . 1 1 133 133 THR N N 133 116.960 116.960 119.116 -2.156 25277 6005 1 13 . 1 1 133 133 THR HA H 133 3.860 3.860 4.011 -0.151 25277 6006 1 13 . 1 1 133 133 THR C C 133 175.670 175.670 176.486 -0.816 25277 6007 1 13 . 1 1 133 133 THR CA C 133 66.930 66.930 67.299 -0.369 25277 6008 1 13 . 1 1 133 133 THR CB C 133 68.880 68.880 68.806 0.074 25277 6009 1 13 . 1 1 133 133 THR H H 133 7.750 7.750 7.840 -0.090 25277 6010 1 13 . 1 1 134 134 THR N N 134 118.830 118.830 118.874 -0.044 25277 6011 1 13 . 1 1 134 134 THR HA H 134 3.780 3.780 4.077 -0.297 25277 6012 1 13 . 1 1 134 134 THR C C 134 176.750 176.750 176.287 0.463 25277 6013 1 13 . 1 1 134 134 THR CA C 134 67.650 67.650 67.367 0.283 25277 6014 1 13 . 1 1 134 134 THR CB C 134 67.560 67.560 68.467 -0.907 25277 6015 1 13 . 1 1 134 134 THR H H 134 7.570 7.570 7.739 -0.169 25277 6016 1 13 . 1 1 135 135 LEU N N 135 121.420 121.420 121.661 -0.241 25277 6017 1 13 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.920 0.570 25277 6018 1 13 . 1 1 135 135 LEU C C 135 180.050 180.050 178.827 1.223 25277 6019 1 13 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.229 -1.219 25277 6020 1 13 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.435 -0.825 25277 6021 1 13 . 1 1 135 135 LEU H H 135 8.650 8.650 8.286 0.364 25277 6022 1 13 . 1 1 136 136 ASN N N 136 117.010 117.010 117.367 -0.357 25277 6023 1 13 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.423 0.117 25277 6024 1 13 . 1 1 136 136 ASN C C 136 175.980 175.980 177.675 -1.695 25277 6025 1 13 . 1 1 136 136 ASN CA C 136 54.770 54.770 56.146 -1.376 25277 6026 1 13 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.667 -0.227 25277 6027 1 13 . 1 1 136 136 ASN H H 136 7.360 7.360 7.766 -0.406 25277 6028 1 13 . 1 1 137 137 LEU N N 137 116.940 116.940 119.570 -2.630 25277 6029 1 13 . 1 1 137 137 LEU HA H 137 4.160 4.160 3.955 0.205 25277 6030 1 13 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.718 -2.288 25277 6031 1 13 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.731 -0.161 25277 6032 1 13 . 1 1 137 137 LEU H H 137 7.810 7.810 7.606 0.204 25277 6033 1 13 . 1 1 138 138 CYS N N 138 115.430 115.430 114.978 0.452 25277 6034 1 13 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.237 0.173 25277 6035 1 13 . 1 1 138 138 CYS CA C 138 55.480 55.480 61.017 -5.537 25277 6036 1 13 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.357 14.843 25277 6037 1 13 . 1 1 138 138 CYS H H 138 7.450 7.450 7.886 -0.436 25277 6038 1 13 . 1 1 139 139 GLY C C 139 178.800 178.800 174.102 4.698 25277 6039 1 13 . 1 1 139 139 GLY CA C 139 45.500 45.500 45.096 0.404 25277 6040 1 13 . 1 1 140 140 LYS N N 140 119.830 119.830 122.126 -2.296 25277 6041 1 13 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.327 -0.007 25277 6042 1 13 . 1 1 140 140 LYS C C 140 175.820 175.820 176.520 -0.700 25277 6043 1 13 . 1 1 140 140 LYS CA C 140 55.680 55.680 56.215 -0.535 25277 6044 1 13 . 1 1 140 140 LYS CB C 140 32.800 32.800 32.919 -0.119 25277 6045 1 13 . 1 1 140 140 LYS H H 140 7.760 7.760 7.402 0.358 25277 6046 1 14 . 1 1 27 27 PRO CA C 27 63.230 63.230 62.688 0.542 25277 6047 1 14 . 1 1 27 27 PRO CB C 27 32.050 32.050 32.010 0.040 25277 6048 1 14 . 1 1 28 28 ASP N N 28 120.030 120.030 119.417 0.613 25277 6049 1 14 . 1 1 28 28 ASP C C 28 176.130 176.130 176.082 0.048 25277 6050 1 14 . 1 1 28 28 ASP CA C 28 54.170 54.170 54.318 -0.148 25277 6051 1 14 . 1 1 28 28 ASP CB C 28 40.860 40.860 41.172 -0.312 25277 6052 1 14 . 1 1 28 28 ASP H H 28 8.260 8.260 8.471 -0.211 25277 6053 1 14 . 1 1 29 29 LEU N N 29 123.030 123.030 122.084 0.946 25277 6054 1 14 . 1 1 29 29 LEU C C 29 177.870 177.870 176.850 1.020 25277 6055 1 14 . 1 1 29 29 LEU CA C 29 55.160 55.160 55.223 -0.063 25277 6056 1 14 . 1 1 29 29 LEU CB C 29 42.270 42.270 42.700 -0.430 25277 6057 1 14 . 1 1 29 29 LEU H H 29 8.120 8.120 8.391 -0.271 25277 6058 1 14 . 1 1 30 30 GLY N N 30 109.350 109.350 111.376 -2.026 25277 6059 1 14 . 1 1 30 30 GLY CA C 30 45.340 45.340 44.883 0.457 25277 6060 1 14 . 1 1 30 30 GLY H H 30 8.410 8.410 8.296 0.114 25277 6061 1 14 . 1 1 44 44 PRO CA C 44 63.590 63.590 62.176 1.414 25277 6062 1 14 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.537 -0.547 25277 6063 1 14 . 1 1 45 45 ALA N N 45 122.140 122.140 121.533 0.607 25277 6064 1 14 . 1 1 45 45 ALA CA C 45 52.670 52.670 52.538 0.132 25277 6065 1 14 . 1 1 45 45 ALA H H 45 8.350 8.350 8.038 0.312 25277 6066 1 14 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.356 -0.056 25277 6067 1 14 . 1 1 49 49 PRO CA C 49 62.950 62.950 63.179 -0.229 25277 6068 1 14 . 1 1 49 49 PRO CB C 49 31.990 31.990 31.980 0.010 25277 6069 1 14 . 1 1 50 50 VAL N N 50 124.190 124.190 125.748 -1.558 25277 6070 1 14 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.282 0.038 25277 6071 1 14 . 1 1 50 50 VAL CA C 50 59.850 59.850 59.392 0.458 25277 6072 1 14 . 1 1 50 50 VAL CB C 50 32.480 32.480 32.208 0.272 25277 6073 1 14 . 1 1 50 50 VAL H H 50 8.070 8.070 8.045 0.025 25277 6074 1 14 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.302 0.048 25277 6075 1 14 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.447 -0.517 25277 6076 1 14 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.015 -0.035 25277 6077 1 14 . 1 1 52 52 LEU N N 52 124.500 124.500 123.966 0.534 25277 6078 1 14 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.256 0.234 25277 6079 1 14 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.808 -0.918 25277 6080 1 14 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.832 0.358 25277 6081 1 14 . 1 1 52 52 LEU H H 52 8.360 8.360 8.171 0.189 25277 6082 1 14 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.427 -0.017 25277 6083 1 14 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.967 -0.637 25277 6084 1 14 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.131 -0.141 25277 6085 1 14 . 1 1 54 54 SER N N 54 117.380 117.380 117.785 -0.405 25277 6086 1 14 . 1 1 54 54 SER HA H 54 4.600 4.600 4.367 0.233 25277 6087 1 14 . 1 1 54 54 SER CA C 54 56.710 56.710 57.810 -1.100 25277 6088 1 14 . 1 1 54 54 SER CB C 54 62.500 62.500 63.304 -0.804 25277 6089 1 14 . 1 1 54 54 SER H H 54 8.400 8.400 8.286 0.114 25277 6090 1 14 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.539 0.011 25277 6091 1 14 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.736 -0.196 25277 6092 1 14 . 1 1 55 55 PRO CB C 55 32.620 32.620 32.159 0.461 25277 6093 1 14 . 1 1 57 57 SER HA H 57 4.420 4.420 4.243 0.177 25277 6094 1 14 . 1 1 57 57 SER CA C 57 57.580 57.580 60.416 -2.836 25277 6095 1 14 . 1 1 57 57 SER CB C 57 63.780 63.780 63.144 0.636 25277 6096 1 14 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.270 0.720 25277 6097 1 14 . 1 1 58 58 ASN C C 58 172.230 172.230 173.671 -1.441 25277 6098 1 14 . 1 1 58 58 ASN CA C 58 53.670 53.670 55.141 -1.471 25277 6099 1 14 . 1 1 58 58 ASN CB C 58 37.850 37.850 37.940 -0.090 25277 6100 1 14 . 1 1 59 59 LYS N N 59 117.660 117.660 116.985 0.675 25277 6101 1 14 . 1 1 59 59 LYS HA H 59 5.360 5.360 5.175 0.185 25277 6102 1 14 . 1 1 59 59 LYS C C 59 175.120 175.120 174.348 0.772 25277 6103 1 14 . 1 1 59 59 LYS CA C 59 54.860 54.860 55.541 -0.681 25277 6104 1 14 . 1 1 59 59 LYS CB C 59 36.450 36.450 37.425 -0.975 25277 6105 1 14 . 1 1 59 59 LYS H H 59 7.640 7.640 7.766 -0.126 25277 6106 1 14 . 1 1 60 60 GLN N N 60 120.680 120.680 119.573 1.107 25277 6107 1 14 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.655 -0.165 25277 6108 1 14 . 1 1 60 60 GLN C C 60 173.640 173.640 173.192 0.448 25277 6109 1 14 . 1 1 60 60 GLN CA C 60 55.480 55.480 55.069 0.410 25277 6110 1 14 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.225 -0.235 25277 6111 1 14 . 1 1 60 60 GLN H H 60 8.930 8.930 8.360 0.570 25277 6112 1 14 . 1 1 61 61 ASP N N 61 126.170 126.170 122.615 3.555 25277 6113 1 14 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.842 0.208 25277 6114 1 14 . 1 1 61 61 ASP C C 61 175.000 175.000 174.828 0.172 25277 6115 1 14 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.230 0.650 25277 6116 1 14 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.625 -0.855 25277 6117 1 14 . 1 1 61 61 ASP H H 61 8.540 8.540 8.576 -0.036 25277 6118 1 14 . 1 1 62 62 ILE N N 62 121.100 121.100 123.265 -2.165 25277 6119 1 14 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.601 0.179 25277 6120 1 14 . 1 1 62 62 ILE C C 62 171.480 171.480 173.578 -2.098 25277 6121 1 14 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.717 0.373 25277 6122 1 14 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.151 0.989 25277 6123 1 14 . 1 1 62 62 ILE H H 62 8.970 8.970 8.131 0.839 25277 6124 1 14 . 1 1 63 63 SER N N 63 119.430 119.430 119.883 -0.453 25277 6125 1 14 . 1 1 63 63 SER HA H 63 4.680 4.680 4.527 0.153 25277 6126 1 14 . 1 1 63 63 SER C C 63 174.030 174.030 174.405 -0.375 25277 6127 1 14 . 1 1 63 63 SER CA C 63 56.550 56.550 56.528 0.022 25277 6128 1 14 . 1 1 63 63 SER CB C 63 67.320 67.320 65.975 1.345 25277 6129 1 14 . 1 1 63 63 SER H H 63 8.520 8.520 8.281 0.239 25277 6130 1 14 . 1 1 64 64 GLU N N 64 121.250 121.250 119.370 1.880 25277 6131 1 14 . 1 1 64 64 GLU HA H 64 2.770 2.770 2.939 -0.169 25277 6132 1 14 . 1 1 64 64 GLU C C 64 177.190 177.190 177.845 -0.655 25277 6133 1 14 . 1 1 64 64 GLU CA C 64 58.590 58.590 58.830 -0.240 25277 6134 1 14 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.685 -0.545 25277 6135 1 14 . 1 1 64 64 GLU H H 64 7.400 7.400 7.761 -0.361 25277 6136 1 14 . 1 1 65 65 ALA N N 65 119.250 119.250 121.573 -2.323 25277 6137 1 14 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.794 0.066 25277 6138 1 14 . 1 1 65 65 ALA C C 65 179.630 179.630 179.367 0.263 25277 6139 1 14 . 1 1 65 65 ALA CA C 65 53.810 53.810 55.001 -1.191 25277 6140 1 14 . 1 1 65 65 ALA CB C 65 18.400 18.400 18.143 0.257 25277 6141 1 14 . 1 1 65 65 ALA H H 65 7.700 7.700 8.272 -0.572 25277 6142 1 14 . 1 1 66 66 ASN N N 66 112.360 112.360 115.679 -3.319 25277 6143 1 14 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.418 0.612 25277 6144 1 14 . 1 1 66 66 ASN C C 66 174.580 174.580 176.801 -2.221 25277 6145 1 14 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.633 -0.083 25277 6146 1 14 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.498 1.432 25277 6147 1 14 . 1 1 66 66 ASN H H 66 7.960 7.960 7.355 0.605 25277 6148 1 14 . 1 1 67 67 LEU N N 67 115.390 115.390 118.331 -2.941 25277 6149 1 14 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.371 0.279 25277 6150 1 14 . 1 1 67 67 LEU C C 67 176.500 176.500 176.256 0.244 25277 6151 1 14 . 1 1 67 67 LEU CA C 67 54.350 54.350 54.995 -0.645 25277 6152 1 14 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.176 2.494 25277 6153 1 14 . 1 1 67 67 LEU H H 67 7.050 7.050 7.474 -0.424 25277 6154 1 14 . 1 1 68 68 ALA N N 68 125.680 125.680 120.944 4.736 25277 6155 1 14 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.668 0.222 25277 6156 1 14 . 1 1 68 68 ALA C C 68 177.480 177.480 178.201 -0.721 25277 6157 1 14 . 1 1 68 68 ALA CA C 68 53.550 53.550 53.288 0.262 25277 6158 1 14 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.220 -0.070 25277 6159 1 14 . 1 1 68 68 ALA H H 68 8.880 8.880 7.854 1.026 25277 6160 1 14 . 1 1 69 69 TYR N N 69 119.780 119.780 119.190 0.590 25277 6161 1 14 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.327 0.163 25277 6162 1 14 . 1 1 69 69 TYR C C 69 175.340 175.340 177.554 -2.214 25277 6163 1 14 . 1 1 69 69 TYR CA C 69 58.640 58.640 60.459 -1.819 25277 6164 1 14 . 1 1 69 69 TYR CB C 69 37.280 37.280 37.916 -0.636 25277 6165 1 14 . 1 1 69 69 TYR H H 69 7.420 7.420 8.533 -1.113 25277 6166 1 14 . 1 1 70 70 LEU N N 70 118.820 118.820 116.860 1.960 25277 6167 1 14 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.168 0.122 25277 6168 1 14 . 1 1 70 70 LEU C C 70 176.770 176.770 177.478 -0.708 25277 6169 1 14 . 1 1 70 70 LEU CA C 70 53.880 53.880 55.640 -1.760 25277 6170 1 14 . 1 1 70 70 LEU CB C 70 41.300 41.300 41.719 -0.419 25277 6171 1 14 . 1 1 70 70 LEU H H 70 7.690 7.690 7.503 0.187 25277 6172 1 14 . 1 1 71 71 TRP N N 71 124.110 124.110 122.674 1.436 25277 6173 1 14 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.546 0.044 25277 6174 1 14 . 1 1 71 71 TRP CA C 71 54.150 54.150 55.934 -1.784 25277 6175 1 14 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.460 -0.250 25277 6176 1 14 . 1 1 71 71 TRP H H 71 8.130 8.130 7.689 0.441 25277 6177 1 14 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.389 0.191 25277 6178 1 14 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.172 0.418 25277 6179 1 14 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.734 -1.674 25277 6180 1 14 . 1 1 73 73 LEU N N 73 118.760 118.760 117.767 0.993 25277 6181 1 14 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.578 0.822 25277 6182 1 14 . 1 1 73 73 LEU C C 73 176.620 176.620 178.203 -1.583 25277 6183 1 14 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.547 -0.498 25277 6184 1 14 . 1 1 73 73 LEU CB C 73 44.260 44.260 42.890 1.370 25277 6185 1 14 . 1 1 73 73 LEU H H 73 5.190 5.190 6.538 -1.348 25277 6186 1 14 . 1 1 74 74 THR N N 74 110.120 110.120 115.006 -4.886 25277 6187 1 14 . 1 1 74 74 THR HA H 74 4.250 4.250 4.193 0.057 25277 6188 1 14 . 1 1 74 74 THR C C 74 176.080 176.080 175.705 0.375 25277 6189 1 14 . 1 1 74 74 THR CA C 74 62.690 62.690 64.299 -1.609 25277 6190 1 14 . 1 1 74 74 THR CB C 74 67.930 67.930 69.227 -1.297 25277 6191 1 14 . 1 1 74 74 THR H H 74 9.010 9.010 8.540 0.470 25277 6192 1 14 . 1 1 75 75 VAL N N 75 113.030 113.030 118.703 -5.673 25277 6193 1 14 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.141 0.669 25277 6194 1 14 . 1 1 75 75 VAL C C 75 176.010 176.010 177.093 -1.083 25277 6195 1 14 . 1 1 75 75 VAL CA C 75 59.100 59.100 61.212 -2.112 25277 6196 1 14 . 1 1 75 75 VAL CB C 75 33.220 33.220 32.731 0.489 25277 6197 1 14 . 1 1 75 75 VAL H H 75 6.660 6.660 7.664 -1.004 25277 6198 1 14 . 1 1 76 76 ASP N N 76 119.590 119.590 121.415 -1.825 25277 6199 1 14 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.613 -0.123 25277 6200 1 14 . 1 1 76 76 ASP C C 76 175.060 175.060 176.030 -0.970 25277 6201 1 14 . 1 1 76 76 ASP CA C 76 55.110 55.110 56.664 -1.554 25277 6202 1 14 . 1 1 76 76 ASP CB C 76 41.300 41.300 40.853 0.447 25277 6203 1 14 . 1 1 76 76 ASP H H 76 8.770 8.770 8.945 -0.175 25277 6204 1 14 . 1 1 77 77 HIS N N 77 113.300 113.300 113.142 0.158 25277 6205 1 14 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.756 0.334 25277 6206 1 14 . 1 1 77 77 HIS C C 77 171.370 171.370 173.720 -2.350 25277 6207 1 14 . 1 1 77 77 HIS CA C 77 55.590 55.590 54.997 0.593 25277 6208 1 14 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.646 -2.456 25277 6209 1 14 . 1 1 77 77 HIS H H 77 7.650 7.650 7.486 0.164 25277 6210 1 14 . 1 1 78 78 GLY N N 78 101.350 101.350 105.761 -4.411 25277 6211 1 14 . 1 1 78 78 GLY C C 78 172.110 172.110 172.237 -0.127 25277 6212 1 14 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.917 -0.107 25277 6213 1 14 . 1 1 78 78 GLY H H 78 8.450 8.450 8.781 -0.331 25277 6214 1 14 . 1 1 79 79 THR N N 79 120.230 120.230 116.982 3.248 25277 6215 1 14 . 1 1 79 79 THR HA H 79 5.110 5.110 4.932 0.178 25277 6216 1 14 . 1 1 79 79 THR C C 79 172.920 172.920 173.949 -1.029 25277 6217 1 14 . 1 1 79 79 THR CA C 79 61.480 61.480 61.580 -0.100 25277 6218 1 14 . 1 1 79 79 THR CB C 79 72.130 72.130 70.659 1.471 25277 6219 1 14 . 1 1 79 79 THR H H 79 8.080 8.080 8.494 -0.414 25277 6220 1 14 . 1 1 80 80 ILE N N 80 119.620 119.620 119.950 -0.330 25277 6221 1 14 . 1 1 80 80 ILE HA H 80 5.140 5.140 4.979 0.161 25277 6222 1 14 . 1 1 80 80 ILE C C 80 174.340 174.340 174.126 0.214 25277 6223 1 14 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.418 -0.068 25277 6224 1 14 . 1 1 80 80 ILE CB C 80 39.550 39.550 40.561 -1.011 25277 6225 1 14 . 1 1 80 80 ILE H H 80 8.970 8.970 8.701 0.269 25277 6226 1 14 . 1 1 81 81 GLU N N 81 119.960 119.960 125.413 -5.453 25277 6227 1 14 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.140 -0.140 25277 6228 1 14 . 1 1 81 81 GLU C C 81 176.130 176.130 174.521 1.609 25277 6229 1 14 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.596 -0.036 25277 6230 1 14 . 1 1 81 81 GLU CB C 81 33.390 33.390 34.408 -1.018 25277 6231 1 14 . 1 1 81 81 GLU H H 81 8.350 8.350 8.336 0.014 25277 6232 1 14 . 1 1 82 82 CYS N N 82 123.110 123.110 125.148 -2.038 25277 6233 1 14 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.082 -0.152 25277 6234 1 14 . 1 1 82 82 CYS C C 82 174.430 174.430 174.928 -0.498 25277 6235 1 14 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.103 -4.863 25277 6236 1 14 . 1 1 82 82 CYS CB C 82 43.720 43.720 26.810 16.910 25277 6237 1 14 . 1 1 82 82 CYS H H 82 8.220 8.220 8.429 -0.209 25277 6238 1 14 . 1 1 83 83 LEU N N 83 131.660 131.660 127.610 4.050 25277 6239 1 14 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.745 -0.215 25277 6240 1 14 . 1 1 83 83 LEU CA C 83 53.900 53.900 52.953 0.947 25277 6241 1 14 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.305 -2.105 25277 6242 1 14 . 1 1 83 83 LEU H H 83 8.910 8.910 8.108 0.802 25277 6243 1 14 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.213 0.157 25277 6244 1 14 . 1 1 84 84 PRO CA C 84 63.190 63.190 65.270 -2.080 25277 6245 1 14 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.731 0.199 25277 6246 1 14 . 1 1 85 85 SER N N 85 117.620 117.620 112.859 4.761 25277 6247 1 14 . 1 1 85 85 SER HA H 85 3.870 3.870 4.296 -0.426 25277 6248 1 14 . 1 1 85 85 SER C C 85 174.350 174.350 174.661 -0.311 25277 6249 1 14 . 1 1 85 85 SER CA C 85 58.970 58.970 57.849 1.121 25277 6250 1 14 . 1 1 85 85 SER CB C 85 63.820 63.820 62.812 1.008 25277 6251 1 14 . 1 1 85 85 SER H H 85 7.660 7.660 7.894 -0.234 25277 6252 1 14 . 1 1 86 86 ASP N N 86 117.590 117.590 116.680 0.910 25277 6253 1 14 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.212 -0.072 25277 6254 1 14 . 1 1 86 86 ASP C C 86 174.480 174.480 174.337 0.143 25277 6255 1 14 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.451 -0.471 25277 6256 1 14 . 1 1 86 86 ASP CB C 86 37.850 37.850 37.943 -0.093 25277 6257 1 14 . 1 1 86 86 ASP H H 86 8.490 8.490 8.298 0.192 25277 6258 1 14 . 1 1 87 87 ASN N N 87 117.160 117.160 116.753 0.407 25277 6259 1 14 . 1 1 87 87 ASN HA H 87 4.530 4.530 5.024 -0.494 25277 6260 1 14 . 1 1 87 87 ASN CA C 87 52.480 52.480 52.162 0.318 25277 6261 1 14 . 1 1 87 87 ASN CB C 87 40.040 40.040 41.642 -1.602 25277 6262 1 14 . 1 1 87 87 ASN H H 87 7.260 7.260 7.582 -0.322 25277 6263 1 14 . 1 1 88 88 ALA HA H 88 4.730 4.730 5.032 -0.302 25277 6264 1 14 . 1 1 88 88 ALA C C 88 174.620 174.620 176.285 -1.665 25277 6265 1 14 . 1 1 88 88 ALA CA C 88 51.230 51.230 50.747 0.483 25277 6266 1 14 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.328 0.211 25277 6267 1 14 . 1 1 89 89 VAL N N 89 116.580 116.580 117.780 -1.200 25277 6268 1 14 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.120 -0.020 25277 6269 1 14 . 1 1 89 89 VAL C C 89 172.750 172.750 173.509 -0.759 25277 6270 1 14 . 1 1 89 89 VAL CA C 89 58.980 58.980 59.401 -0.421 25277 6271 1 14 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.431 0.789 25277 6272 1 14 . 1 1 89 89 VAL H H 89 8.740 8.740 8.372 0.368 25277 6273 1 14 . 1 1 90 90 PHE N N 90 120.300 120.300 123.494 -3.194 25277 6274 1 14 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.069 0.081 25277 6275 1 14 . 1 1 90 90 PHE C C 90 172.910 172.910 173.626 -0.716 25277 6276 1 14 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.606 0.194 25277 6277 1 14 . 1 1 90 90 PHE CB C 90 43.650 43.650 41.986 1.664 25277 6278 1 14 . 1 1 90 90 PHE H H 90 8.950 8.950 9.111 -0.161 25277 6279 1 14 . 1 1 91 91 VAL N N 91 129.020 129.020 128.691 0.329 25277 6280 1 14 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.621 -0.161 25277 6281 1 14 . 1 1 91 91 VAL C C 91 175.910 175.910 174.090 1.820 25277 6282 1 14 . 1 1 91 91 VAL CA C 91 60.780 60.780 60.721 0.059 25277 6283 1 14 . 1 1 91 91 VAL CB C 91 32.020 32.020 33.764 -1.744 25277 6284 1 14 . 1 1 91 91 VAL H H 91 9.090 9.090 8.718 0.372 25277 6285 1 14 . 1 1 92 92 ALA N N 92 129.760 129.760 129.401 0.359 25277 6286 1 14 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.785 -0.285 25277 6287 1 14 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.648 2.202 25277 6288 1 14 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.406 -1.356 25277 6289 1 14 . 1 1 92 92 ALA H H 92 8.680 8.680 8.467 0.213 25277 6290 1 14 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.115 0.045 25277 6291 1 14 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.141 0.259 25277 6292 1 14 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.655 0.285 25277 6293 1 14 . 1 1 94 94 ASP N N 94 113.220 113.220 114.794 -1.574 25277 6294 1 14 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.438 -0.018 25277 6295 1 14 . 1 1 94 94 ASP C C 94 176.980 176.980 177.463 -0.483 25277 6296 1 14 . 1 1 94 94 ASP CA C 94 53.530 53.530 54.108 -0.578 25277 6297 1 14 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.992 -0.412 25277 6298 1 14 . 1 1 94 94 ASP H H 94 7.890 7.890 7.833 0.057 25277 6299 1 14 . 1 1 95 95 GLY N N 95 109.120 109.120 108.306 0.814 25277 6300 1 14 . 1 1 95 95 GLY C C 95 174.440 174.440 174.336 0.104 25277 6301 1 14 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.139 -0.579 25277 6302 1 14 . 1 1 95 95 GLY H H 95 8.500 8.500 8.165 0.335 25277 6303 1 14 . 1 1 96 96 THR N N 96 120.350 120.350 118.515 1.835 25277 6304 1 14 . 1 1 96 96 THR HA H 96 3.780 3.780 4.431 -0.651 25277 6305 1 14 . 1 1 96 96 THR C C 96 172.590 172.590 173.436 -0.846 25277 6306 1 14 . 1 1 96 96 THR CA C 96 64.660 64.660 61.884 2.776 25277 6307 1 14 . 1 1 96 96 THR CB C 96 68.330 68.330 69.930 -1.600 25277 6308 1 14 . 1 1 96 96 THR H H 96 8.100 8.100 8.426 -0.326 25277 6309 1 14 . 1 1 97 97 THR N N 97 122.660 122.660 121.315 1.345 25277 6310 1 14 . 1 1 97 97 THR HA H 97 4.590 4.590 4.762 -0.172 25277 6311 1 14 . 1 1 97 97 THR C C 97 173.000 173.000 173.178 -0.178 25277 6312 1 14 . 1 1 97 97 THR CA C 97 62.700 62.700 61.970 0.730 25277 6313 1 14 . 1 1 97 97 THR CB C 97 68.840 68.840 69.728 -0.888 25277 6314 1 14 . 1 1 97 97 THR H H 97 7.850 7.850 8.334 -0.484 25277 6315 1 14 . 1 1 98 98 TYR N N 98 122.890 122.890 124.705 -1.815 25277 6316 1 14 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.100 -0.160 25277 6317 1 14 . 1 1 98 98 TYR C C 98 178.970 178.970 174.786 4.184 25277 6318 1 14 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.170 0.340 25277 6319 1 14 . 1 1 98 98 TYR CB C 98 42.950 42.950 41.848 1.102 25277 6320 1 14 . 1 1 98 98 TYR H H 98 9.460 9.460 9.199 0.261 25277 6321 1 14 . 1 1 99 99 ALA N N 99 121.760 121.760 123.620 -1.860 25277 6322 1 14 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.645 -0.535 25277 6323 1 14 . 1 1 99 99 ALA C C 99 178.010 178.010 176.204 1.806 25277 6324 1 14 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.237 1.033 25277 6325 1 14 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.767 2.283 25277 6326 1 14 . 1 1 99 99 ALA H H 99 9.110 9.110 8.847 0.263 25277 6327 1 14 . 1 1 100 100 LEU N N 100 119.330 119.330 124.129 -4.799 25277 6328 1 14 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.261 0.209 25277 6329 1 14 . 1 1 100 100 LEU C C 100 174.720 174.720 177.379 -2.659 25277 6330 1 14 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.380 -2.240 25277 6331 1 14 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.741 1.889 25277 6332 1 14 . 1 1 100 100 LEU H H 100 8.950 8.950 8.278 0.672 25277 6333 1 14 . 1 1 101 101 ASN N N 101 112.600 112.600 115.954 -3.354 25277 6334 1 14 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.808 0.112 25277 6335 1 14 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.594 -1.664 25277 6336 1 14 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.927 0.673 25277 6337 1 14 . 1 1 101 101 ASN H H 101 7.550 7.550 7.609 -0.059 25277 6338 1 14 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.313 -0.123 25277 6339 1 14 . 1 1 102 102 ASP C C 102 178.770 178.770 177.761 1.009 25277 6340 1 14 . 1 1 102 102 ASP CA C 102 56.880 56.880 57.180 -0.300 25277 6341 1 14 . 1 1 102 102 ASP CB C 102 39.980 39.980 41.094 -1.114 25277 6342 1 14 . 1 1 103 103 ARG N N 103 119.370 119.370 119.635 -0.265 25277 6343 1 14 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.095 -0.265 25277 6344 1 14 . 1 1 103 103 ARG C C 103 178.550 178.550 178.367 0.183 25277 6345 1 14 . 1 1 103 103 ARG CA C 103 59.380 59.380 59.174 0.206 25277 6346 1 14 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.927 -0.427 25277 6347 1 14 . 1 1 103 103 ARG H H 103 7.970 7.970 8.106 -0.136 25277 6348 1 14 . 1 1 104 104 ALA N N 104 120.110 120.110 122.158 -2.048 25277 6349 1 14 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.114 0.096 25277 6350 1 14 . 1 1 104 104 ALA C C 104 179.510 179.510 179.582 -0.072 25277 6351 1 14 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.360 -0.610 25277 6352 1 14 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.313 1.357 25277 6353 1 14 . 1 1 104 104 ALA H H 104 7.610 7.610 8.475 -0.865 25277 6354 1 14 . 1 1 105 105 GLU N N 105 120.460 120.460 118.321 2.139 25277 6355 1 14 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.157 0.553 25277 6356 1 14 . 1 1 105 105 GLU C C 105 181.710 181.710 179.922 1.788 25277 6357 1 14 . 1 1 105 105 GLU CA C 105 58.680 58.680 58.807 -0.127 25277 6358 1 14 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.262 0.228 25277 6359 1 14 . 1 1 105 105 GLU H H 105 7.750 7.750 7.817 -0.067 25277 6360 1 14 . 1 1 106 106 LYS N N 106 121.980 121.980 120.143 1.837 25277 6361 1 14 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.091 -0.071 25277 6362 1 14 . 1 1 106 106 LYS C C 106 177.890 177.890 178.556 -0.666 25277 6363 1 14 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.739 -0.269 25277 6364 1 14 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.101 -0.371 25277 6365 1 14 . 1 1 106 106 LYS H H 106 8.380 8.380 7.988 0.392 25277 6366 1 14 . 1 1 107 107 ALA N N 107 119.850 119.850 119.364 0.486 25277 6367 1 14 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.272 -0.012 25277 6368 1 14 . 1 1 107 107 ALA C C 107 177.210 177.210 177.731 -0.521 25277 6369 1 14 . 1 1 107 107 ALA CA C 107 52.270 52.270 52.104 0.166 25277 6370 1 14 . 1 1 107 107 ALA CB C 107 18.740 18.740 18.720 0.020 25277 6371 1 14 . 1 1 107 107 ALA H H 107 7.400 7.400 7.661 -0.261 25277 6372 1 14 . 1 1 108 108 GLY N N 108 104.560 104.560 105.920 -1.360 25277 6373 1 14 . 1 1 108 108 GLY C C 108 174.300 174.300 174.520 -0.220 25277 6374 1 14 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.008 -0.398 25277 6375 1 14 . 1 1 108 108 GLY H H 108 7.560 7.560 7.790 -0.230 25277 6376 1 14 . 1 1 109 109 HIS N N 109 122.550 122.550 120.880 1.670 25277 6377 1 14 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.909 -0.139 25277 6378 1 14 . 1 1 109 109 HIS CA C 109 54.580 54.580 54.396 0.184 25277 6379 1 14 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.575 -0.985 25277 6380 1 14 . 1 1 109 109 HIS H H 109 7.590 7.590 7.668 -0.078 25277 6381 1 14 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.845 -0.285 25277 6382 1 14 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.147 0.583 25277 6383 1 14 . 1 1 111 111 PRO CB C 111 32.800 32.800 33.179 -0.379 25277 6384 1 14 . 1 1 112 112 ILE N N 112 119.770 119.770 120.321 -0.551 25277 6385 1 14 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.432 0.428 25277 6386 1 14 . 1 1 112 112 ILE C C 112 172.800 172.800 177.531 -4.731 25277 6387 1 14 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.481 -2.291 25277 6388 1 14 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.436 3.004 25277 6389 1 14 . 1 1 112 112 ILE H H 112 7.890 7.890 8.539 -0.649 25277 6390 1 14 . 1 1 113 113 THR N N 113 113.610 113.610 115.955 -2.345 25277 6391 1 14 . 1 1 113 113 THR HA H 113 3.010 3.010 3.949 -0.939 25277 6392 1 14 . 1 1 113 113 THR CA C 113 66.860 66.860 68.367 -1.507 25277 6393 1 14 . 1 1 113 113 THR CB C 113 66.920 66.920 67.630 -0.710 25277 6394 1 14 . 1 1 113 113 THR H H 113 7.070 7.070 8.497 -1.427 25277 6395 1 14 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.329 0.011 25277 6396 1 14 . 1 1 114 114 PRO CA C 114 66.080 66.080 65.110 0.970 25277 6397 1 14 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.502 0.578 25277 6398 1 14 . 1 1 115 115 ILE N N 115 134.770 134.770 110.063 24.707 25277 6399 1 14 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.426 0.184 25277 6400 1 14 . 1 1 115 115 ILE C C 115 174.800 174.800 174.771 0.029 25277 6401 1 14 . 1 1 115 115 ILE CA C 115 60.000 60.000 59.827 0.173 25277 6402 1 14 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.707 0.153 25277 6403 1 14 . 1 1 115 115 ILE H H 115 7.510 7.510 7.659 -0.149 25277 6404 1 14 . 1 1 116 116 ARG N N 116 120.890 120.890 122.188 -1.298 25277 6405 1 14 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.118 -0.148 25277 6406 1 14 . 1 1 116 116 ARG C C 116 174.910 174.910 175.944 -1.034 25277 6407 1 14 . 1 1 116 116 ARG CA C 116 57.780 57.780 55.921 1.859 25277 6408 1 14 . 1 1 116 116 ARG CB C 116 31.870 31.870 31.240 0.630 25277 6409 1 14 . 1 1 116 116 ARG H H 116 7.280 7.280 7.507 -0.227 25277 6410 1 14 . 1 1 117 117 ALA N N 117 125.400 125.400 129.469 -4.069 25277 6411 1 14 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.363 -0.133 25277 6412 1 14 . 1 1 117 117 ALA C C 117 176.290 176.290 176.289 0.001 25277 6413 1 14 . 1 1 117 117 ALA CA C 117 50.780 50.780 51.512 -0.732 25277 6414 1 14 . 1 1 117 117 ALA CB C 117 20.290 20.290 20.569 -0.279 25277 6415 1 14 . 1 1 117 117 ALA H H 117 8.150 8.150 8.527 -0.377 25277 6416 1 14 . 1 1 118 118 LYS N N 118 119.890 119.890 121.577 -1.687 25277 6417 1 14 . 1 1 118 118 LYS HA H 118 4.590 4.590 3.835 0.755 25277 6418 1 14 . 1 1 118 118 LYS C C 118 177.400 177.400 176.340 1.060 25277 6419 1 14 . 1 1 118 118 LYS CA C 118 55.670 55.670 55.563 0.107 25277 6420 1 14 . 1 1 118 118 LYS CB C 118 34.510 34.510 33.538 0.972 25277 6421 1 14 . 1 1 118 118 LYS H H 118 8.360 8.360 8.234 0.126 25277 6422 1 14 . 1 1 119 119 GLY N N 119 108.630 108.630 110.234 -1.604 25277 6423 1 14 . 1 1 119 119 GLY CA C 119 43.610 43.610 43.821 -0.211 25277 6424 1 14 . 1 1 119 119 GLY H H 119 8.320 8.320 7.996 0.324 25277 6425 1 14 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.734 0.166 25277 6426 1 14 . 1 1 124 124 TYR C C 124 177.430 177.430 176.169 1.261 25277 6427 1 14 . 1 1 124 124 TYR CA C 124 57.970 57.970 57.068 0.902 25277 6428 1 14 . 1 1 124 124 TYR CB C 124 38.650 38.650 40.497 -1.847 25277 6429 1 14 . 1 1 125 125 ILE N N 125 123.670 123.670 122.618 1.052 25277 6430 1 14 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.122 -0.282 25277 6431 1 14 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.548 0.182 25277 6432 1 14 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.433 0.077 25277 6433 1 14 . 1 1 125 125 ILE H H 125 8.340 8.340 7.939 0.401 25277 6434 1 14 . 1 1 126 126 SER HA H 126 4.070 4.070 4.370 -0.300 25277 6435 1 14 . 1 1 126 126 SER C C 126 176.290 176.290 174.986 1.304 25277 6436 1 14 . 1 1 126 126 SER CA C 126 59.190 59.190 59.092 0.098 25277 6437 1 14 . 1 1 126 126 SER CB C 126 63.200 63.200 63.782 -0.582 25277 6438 1 14 . 1 1 127 127 LEU N N 127 127.030 127.030 124.367 2.663 25277 6439 1 14 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.324 -0.384 25277 6440 1 14 . 1 1 127 127 LEU C C 127 176.660 176.660 178.205 -1.545 25277 6441 1 14 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.488 0.622 25277 6442 1 14 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.716 1.214 25277 6443 1 14 . 1 1 127 127 LEU H H 127 8.790 8.790 8.279 0.511 25277 6444 1 14 . 1 1 128 128 GLY N N 128 106.600 106.600 108.918 -2.318 25277 6445 1 14 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.609 0.921 25277 6446 1 14 . 1 1 128 128 GLY H H 128 8.450 8.450 8.298 0.152 25277 6447 1 14 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.041 0.189 25277 6448 1 14 . 1 1 129 129 ALA C C 129 180.410 180.410 179.200 1.210 25277 6449 1 14 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.564 0.356 25277 6450 1 14 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.316 0.814 25277 6451 1 14 . 1 1 130 130 LEU N N 130 122.550 122.550 120.648 1.902 25277 6452 1 14 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.054 -0.134 25277 6453 1 14 . 1 1 130 130 LEU C C 130 179.020 179.020 178.488 0.532 25277 6454 1 14 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.399 0.231 25277 6455 1 14 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.642 0.498 25277 6456 1 14 . 1 1 130 130 LEU H H 130 8.040 8.040 7.454 0.586 25277 6457 1 14 . 1 1 131 131 LEU N N 131 121.910 121.910 119.730 2.180 25277 6458 1 14 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.897 0.023 25277 6459 1 14 . 1 1 131 131 LEU C C 131 177.910 177.910 178.227 -0.317 25277 6460 1 14 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.194 0.376 25277 6461 1 14 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.543 -0.823 25277 6462 1 14 . 1 1 131 131 LEU H H 131 9.060 9.060 7.779 1.281 25277 6463 1 14 . 1 1 132 132 SER N N 132 115.530 115.530 114.914 0.616 25277 6464 1 14 . 1 1 132 132 SER HA H 132 3.970 3.970 4.083 -0.113 25277 6465 1 14 . 1 1 132 132 SER C C 132 177.140 177.140 176.767 0.373 25277 6466 1 14 . 1 1 132 132 SER CA C 132 62.340 62.340 62.202 0.139 25277 6467 1 14 . 1 1 132 132 SER CB C 132 62.370 62.370 62.882 -0.512 25277 6468 1 14 . 1 1 132 132 SER H H 132 8.730 8.730 8.167 0.563 25277 6469 1 14 . 1 1 133 133 THR N N 133 116.960 116.960 118.831 -1.871 25277 6470 1 14 . 1 1 133 133 THR HA H 133 3.860 3.860 4.338 -0.478 25277 6471 1 14 . 1 1 133 133 THR C C 133 175.670 175.670 176.747 -1.077 25277 6472 1 14 . 1 1 133 133 THR CA C 133 66.930 66.930 66.713 0.216 25277 6473 1 14 . 1 1 133 133 THR CB C 133 68.880 68.880 68.657 0.223 25277 6474 1 14 . 1 1 133 133 THR H H 133 7.750 7.750 7.808 -0.058 25277 6475 1 14 . 1 1 134 134 THR N N 134 118.830 118.830 119.336 -0.506 25277 6476 1 14 . 1 1 134 134 THR HA H 134 3.780 3.780 4.062 -0.282 25277 6477 1 14 . 1 1 134 134 THR C C 134 176.750 176.750 176.247 0.503 25277 6478 1 14 . 1 1 134 134 THR CA C 134 67.650 67.650 67.442 0.208 25277 6479 1 14 . 1 1 134 134 THR CB C 134 67.560 67.560 68.457 -0.897 25277 6480 1 14 . 1 1 134 134 THR H H 134 7.570 7.570 7.700 -0.130 25277 6481 1 14 . 1 1 135 135 LEU N N 135 121.420 121.420 121.624 -0.204 25277 6482 1 14 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.928 0.562 25277 6483 1 14 . 1 1 135 135 LEU C C 135 180.050 180.050 178.772 1.278 25277 6484 1 14 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.255 -1.245 25277 6485 1 14 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.437 -0.827 25277 6486 1 14 . 1 1 135 135 LEU H H 135 8.650 8.650 8.172 0.478 25277 6487 1 14 . 1 1 136 136 ASN N N 136 117.010 117.010 117.549 -0.539 25277 6488 1 14 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.410 0.130 25277 6489 1 14 . 1 1 136 136 ASN C C 136 175.980 175.980 177.735 -1.755 25277 6490 1 14 . 1 1 136 136 ASN CA C 136 54.770 54.770 56.208 -1.438 25277 6491 1 14 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.621 -0.181 25277 6492 1 14 . 1 1 136 136 ASN H H 136 7.360 7.360 7.781 -0.421 25277 6493 1 14 . 1 1 137 137 LEU N N 137 116.940 116.940 120.386 -3.446 25277 6494 1 14 . 1 1 137 137 LEU HA H 137 4.160 4.160 3.995 0.165 25277 6495 1 14 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.623 -2.193 25277 6496 1 14 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.673 -0.103 25277 6497 1 14 . 1 1 137 137 LEU H H 137 7.810 7.810 7.576 0.234 25277 6498 1 14 . 1 1 138 138 CYS N N 138 115.430 115.430 114.816 0.614 25277 6499 1 14 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.181 0.229 25277 6500 1 14 . 1 1 138 138 CYS CA C 138 55.480 55.480 61.688 -6.208 25277 6501 1 14 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.653 14.547 25277 6502 1 14 . 1 1 138 138 CYS H H 138 7.450 7.450 7.956 -0.506 25277 6503 1 14 . 1 1 139 139 GLY C C 139 178.800 178.800 174.200 4.600 25277 6504 1 14 . 1 1 139 139 GLY CA C 139 45.500 45.500 45.081 0.419 25277 6505 1 14 . 1 1 140 140 LYS N N 140 119.830 119.830 121.512 -1.682 25277 6506 1 14 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.628 -0.308 25277 6507 1 14 . 1 1 140 140 LYS C C 140 175.820 175.820 176.097 -0.277 25277 6508 1 14 . 1 1 140 140 LYS CA C 140 55.680 55.680 55.412 0.268 25277 6509 1 14 . 1 1 140 140 LYS CB C 140 32.800 32.800 33.751 -0.951 25277 6510 1 14 . 1 1 140 140 LYS H H 140 7.760 7.760 7.575 0.185 25277 6511 1 15 . 1 1 27 27 PRO CA C 27 63.230 63.230 62.624 0.606 25277 6512 1 15 . 1 1 27 27 PRO CB C 27 32.050 32.050 32.008 0.042 25277 6513 1 15 . 1 1 28 28 ASP N N 28 120.030 120.030 118.998 1.032 25277 6514 1 15 . 1 1 28 28 ASP C C 28 176.130 176.130 175.276 0.854 25277 6515 1 15 . 1 1 28 28 ASP CA C 28 54.170 54.170 53.692 0.478 25277 6516 1 15 . 1 1 28 28 ASP CB C 28 40.860 40.860 41.166 -0.306 25277 6517 1 15 . 1 1 28 28 ASP H H 28 8.260 8.260 8.237 0.023 25277 6518 1 15 . 1 1 29 29 LEU N N 29 123.030 123.030 120.369 2.661 25277 6519 1 15 . 1 1 29 29 LEU C C 29 177.870 177.870 177.123 0.747 25277 6520 1 15 . 1 1 29 29 LEU CA C 29 55.160 55.160 54.588 0.572 25277 6521 1 15 . 1 1 29 29 LEU CB C 29 42.270 42.270 43.357 -1.087 25277 6522 1 15 . 1 1 29 29 LEU H H 29 8.120 8.120 8.164 -0.044 25277 6523 1 15 . 1 1 30 30 GLY N N 30 109.350 109.350 112.810 -3.460 25277 6524 1 15 . 1 1 30 30 GLY CA C 30 45.340 45.340 44.343 0.998 25277 6525 1 15 . 1 1 30 30 GLY H H 30 8.410 8.410 8.322 0.088 25277 6526 1 15 . 1 1 44 44 PRO CA C 44 63.590 63.590 62.848 0.742 25277 6527 1 15 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.142 -0.152 25277 6528 1 15 . 1 1 45 45 ALA N N 45 122.140 122.140 120.776 1.364 25277 6529 1 15 . 1 1 45 45 ALA CA C 45 52.670 52.670 51.180 1.490 25277 6530 1 15 . 1 1 45 45 ALA H H 45 8.350 8.350 7.897 0.453 25277 6531 1 15 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.382 -0.082 25277 6532 1 15 . 1 1 49 49 PRO CA C 49 62.950 62.950 63.099 -0.148 25277 6533 1 15 . 1 1 49 49 PRO CB C 49 31.990 31.990 31.981 0.009 25277 6534 1 15 . 1 1 50 50 VAL N N 50 124.190 124.190 125.557 -1.367 25277 6535 1 15 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.388 -0.068 25277 6536 1 15 . 1 1 50 50 VAL CA C 50 59.850 59.850 58.859 0.991 25277 6537 1 15 . 1 1 50 50 VAL CB C 50 32.480 32.480 32.273 0.207 25277 6538 1 15 . 1 1 50 50 VAL H H 50 8.070 8.070 8.166 -0.096 25277 6539 1 15 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.308 0.042 25277 6540 1 15 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.237 -0.307 25277 6541 1 15 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.158 -0.178 25277 6542 1 15 . 1 1 52 52 LEU N N 52 124.500 124.500 121.041 3.459 25277 6543 1 15 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.280 0.210 25277 6544 1 15 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.833 -0.943 25277 6545 1 15 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.193 0.997 25277 6546 1 15 . 1 1 52 52 LEU H H 52 8.360 8.360 8.152 0.208 25277 6547 1 15 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.449 -0.039 25277 6548 1 15 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.795 -0.465 25277 6549 1 15 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.199 -0.209 25277 6550 1 15 . 1 1 54 54 SER N N 54 117.380 117.380 118.010 -0.630 25277 6551 1 15 . 1 1 54 54 SER HA H 54 4.600 4.600 4.318 0.282 25277 6552 1 15 . 1 1 54 54 SER CA C 54 56.710 56.710 57.331 -0.621 25277 6553 1 15 . 1 1 54 54 SER CB C 54 62.500 62.500 62.880 -0.380 25277 6554 1 15 . 1 1 54 54 SER H H 54 8.400 8.400 8.182 0.218 25277 6555 1 15 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.314 0.236 25277 6556 1 15 . 1 1 55 55 PRO CA C 55 62.540 62.540 63.551 -1.011 25277 6557 1 15 . 1 1 55 55 PRO CB C 55 32.620 32.620 31.488 1.131 25277 6558 1 15 . 1 1 57 57 SER HA H 57 4.420 4.420 4.255 0.165 25277 6559 1 15 . 1 1 57 57 SER CA C 57 57.580 57.580 60.706 -3.126 25277 6560 1 15 . 1 1 57 57 SER CB C 57 63.780 63.780 63.253 0.527 25277 6561 1 15 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.369 0.621 25277 6562 1 15 . 1 1 58 58 ASN C C 58 172.230 172.230 173.881 -1.651 25277 6563 1 15 . 1 1 58 58 ASN CA C 58 53.670 53.670 54.856 -1.186 25277 6564 1 15 . 1 1 58 58 ASN CB C 58 37.850 37.850 37.249 0.601 25277 6565 1 15 . 1 1 59 59 LYS N N 59 117.660 117.660 119.572 -1.912 25277 6566 1 15 . 1 1 59 59 LYS HA H 59 5.360 5.360 5.002 0.358 25277 6567 1 15 . 1 1 59 59 LYS C C 59 175.120 175.120 174.016 1.104 25277 6568 1 15 . 1 1 59 59 LYS CA C 59 54.860 54.860 55.849 -0.989 25277 6569 1 15 . 1 1 59 59 LYS CB C 59 36.450 36.450 36.120 0.330 25277 6570 1 15 . 1 1 59 59 LYS H H 59 7.640 7.640 7.581 0.059 25277 6571 1 15 . 1 1 60 60 GLN N N 60 120.680 120.680 122.174 -1.494 25277 6572 1 15 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.669 -0.179 25277 6573 1 15 . 1 1 60 60 GLN C C 60 173.640 173.640 173.324 0.316 25277 6574 1 15 . 1 1 60 60 GLN CA C 60 55.480 55.480 55.068 0.412 25277 6575 1 15 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.114 -0.124 25277 6576 1 15 . 1 1 60 60 GLN H H 60 8.930 8.930 8.283 0.647 25277 6577 1 15 . 1 1 61 61 ASP N N 61 126.170 126.170 121.764 4.406 25277 6578 1 15 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.846 0.204 25277 6579 1 15 . 1 1 61 61 ASP C C 61 175.000 175.000 175.115 -0.115 25277 6580 1 15 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.111 0.769 25277 6581 1 15 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.714 -0.944 25277 6582 1 15 . 1 1 61 61 ASP H H 61 8.540 8.540 8.564 -0.024 25277 6583 1 15 . 1 1 62 62 ILE N N 62 121.100 121.100 125.415 -4.315 25277 6584 1 15 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.519 0.261 25277 6585 1 15 . 1 1 62 62 ILE C C 62 171.480 171.480 173.646 -2.166 25277 6586 1 15 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.206 0.884 25277 6587 1 15 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.431 0.709 25277 6588 1 15 . 1 1 62 62 ILE H H 62 8.970 8.970 8.377 0.593 25277 6589 1 15 . 1 1 63 63 SER N N 63 119.430 119.430 121.955 -2.525 25277 6590 1 15 . 1 1 63 63 SER HA H 63 4.680 4.680 4.527 0.153 25277 6591 1 15 . 1 1 63 63 SER C C 63 174.030 174.030 174.632 -0.602 25277 6592 1 15 . 1 1 63 63 SER CA C 63 56.550 56.550 56.627 -0.077 25277 6593 1 15 . 1 1 63 63 SER CB C 63 67.320 67.320 66.161 1.159 25277 6594 1 15 . 1 1 63 63 SER H H 63 8.520 8.520 8.200 0.320 25277 6595 1 15 . 1 1 64 64 GLU N N 64 121.250 121.250 119.733 1.517 25277 6596 1 15 . 1 1 64 64 GLU HA H 64 2.770 2.770 3.009 -0.239 25277 6597 1 15 . 1 1 64 64 GLU C C 64 177.190 177.190 177.991 -0.801 25277 6598 1 15 . 1 1 64 64 GLU CA C 64 58.590 58.590 58.964 -0.374 25277 6599 1 15 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.583 -0.443 25277 6600 1 15 . 1 1 64 64 GLU H H 64 7.400 7.400 7.648 -0.248 25277 6601 1 15 . 1 1 65 65 ALA N N 65 119.250 119.250 121.300 -2.050 25277 6602 1 15 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.800 0.060 25277 6603 1 15 . 1 1 65 65 ALA C C 65 179.630 179.630 179.397 0.233 25277 6604 1 15 . 1 1 65 65 ALA CA C 65 53.810 53.810 55.008 -1.198 25277 6605 1 15 . 1 1 65 65 ALA CB C 65 18.400 18.400 18.206 0.194 25277 6606 1 15 . 1 1 65 65 ALA H H 65 7.700 7.700 8.267 -0.567 25277 6607 1 15 . 1 1 66 66 ASN N N 66 112.360 112.360 115.342 -2.982 25277 6608 1 15 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.478 0.552 25277 6609 1 15 . 1 1 66 66 ASN C C 66 174.580 174.580 176.775 -2.195 25277 6610 1 15 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.824 -0.274 25277 6611 1 15 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.748 1.182 25277 6612 1 15 . 1 1 66 66 ASN H H 66 7.960 7.960 7.308 0.652 25277 6613 1 15 . 1 1 67 67 LEU N N 67 115.390 115.390 117.688 -2.298 25277 6614 1 15 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.452 0.198 25277 6615 1 15 . 1 1 67 67 LEU C C 67 176.500 176.500 176.390 0.110 25277 6616 1 15 . 1 1 67 67 LEU CA C 67 54.350 54.350 55.083 -0.733 25277 6617 1 15 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.189 2.481 25277 6618 1 15 . 1 1 67 67 LEU H H 67 7.050 7.050 7.511 -0.461 25277 6619 1 15 . 1 1 68 68 ALA N N 68 125.680 125.680 121.449 4.231 25277 6620 1 15 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.757 0.133 25277 6621 1 15 . 1 1 68 68 ALA C C 68 177.480 177.480 177.668 -0.188 25277 6622 1 15 . 1 1 68 68 ALA CA C 68 53.550 53.550 53.820 -0.270 25277 6623 1 15 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.190 -0.040 25277 6624 1 15 . 1 1 68 68 ALA H H 68 8.880 8.880 7.889 0.991 25277 6625 1 15 . 1 1 69 69 TYR N N 69 119.780 119.780 118.560 1.220 25277 6626 1 15 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.294 0.196 25277 6627 1 15 . 1 1 69 69 TYR C C 69 175.340 175.340 177.424 -2.084 25277 6628 1 15 . 1 1 69 69 TYR CA C 69 58.640 58.640 60.920 -2.280 25277 6629 1 15 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.080 -0.800 25277 6630 1 15 . 1 1 69 69 TYR H H 69 7.420 7.420 8.429 -1.009 25277 6631 1 15 . 1 1 70 70 LEU N N 70 118.820 118.820 118.428 0.392 25277 6632 1 15 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.148 0.142 25277 6633 1 15 . 1 1 70 70 LEU C C 70 176.770 176.770 177.143 -0.373 25277 6634 1 15 . 1 1 70 70 LEU CA C 70 53.880 53.880 56.248 -2.369 25277 6635 1 15 . 1 1 70 70 LEU CB C 70 41.300 41.300 42.137 -0.837 25277 6636 1 15 . 1 1 70 70 LEU H H 70 7.690 7.690 7.558 0.132 25277 6637 1 15 . 1 1 71 71 TRP N N 71 124.110 124.110 121.684 2.426 25277 6638 1 15 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.549 0.041 25277 6639 1 15 . 1 1 71 71 TRP CA C 71 54.150 54.150 56.237 -2.087 25277 6640 1 15 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.006 0.204 25277 6641 1 15 . 1 1 71 71 TRP H H 71 8.130 8.130 7.805 0.325 25277 6642 1 15 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.376 0.204 25277 6643 1 15 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.217 0.373 25277 6644 1 15 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.757 -1.697 25277 6645 1 15 . 1 1 73 73 LEU N N 73 118.760 118.760 117.857 0.903 25277 6646 1 15 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.570 0.830 25277 6647 1 15 . 1 1 73 73 LEU C C 73 176.620 176.620 178.380 -1.760 25277 6648 1 15 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.824 -0.774 25277 6649 1 15 . 1 1 73 73 LEU CB C 73 44.260 44.260 42.894 1.367 25277 6650 1 15 . 1 1 73 73 LEU H H 73 5.190 5.190 6.659 -1.469 25277 6651 1 15 . 1 1 74 74 THR N N 74 110.120 110.120 115.515 -5.395 25277 6652 1 15 . 1 1 74 74 THR HA H 74 4.250 4.250 4.232 0.018 25277 6653 1 15 . 1 1 74 74 THR C C 74 176.080 176.080 175.520 0.560 25277 6654 1 15 . 1 1 74 74 THR CA C 74 62.690 62.690 64.132 -1.442 25277 6655 1 15 . 1 1 74 74 THR CB C 74 67.930 67.930 69.242 -1.312 25277 6656 1 15 . 1 1 74 74 THR H H 74 9.010 9.010 8.649 0.361 25277 6657 1 15 . 1 1 75 75 VAL N N 75 113.030 113.030 118.674 -5.644 25277 6658 1 15 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.207 0.603 25277 6659 1 15 . 1 1 75 75 VAL C C 75 176.010 176.010 177.069 -1.059 25277 6660 1 15 . 1 1 75 75 VAL CA C 75 59.100 59.100 62.457 -3.357 25277 6661 1 15 . 1 1 75 75 VAL CB C 75 33.220 33.220 32.526 0.694 25277 6662 1 15 . 1 1 75 75 VAL H H 75 6.660 6.660 7.615 -0.955 25277 6663 1 15 . 1 1 76 76 ASP N N 76 119.590 119.590 123.335 -3.745 25277 6664 1 15 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.679 -0.189 25277 6665 1 15 . 1 1 76 76 ASP C C 76 175.060 175.060 176.159 -1.099 25277 6666 1 15 . 1 1 76 76 ASP CA C 76 55.110 55.110 56.986 -1.876 25277 6667 1 15 . 1 1 76 76 ASP CB C 76 41.300 41.300 41.008 0.292 25277 6668 1 15 . 1 1 76 76 ASP H H 76 8.770 8.770 9.084 -0.314 25277 6669 1 15 . 1 1 77 77 HIS N N 77 113.300 113.300 112.096 1.204 25277 6670 1 15 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.677 0.413 25277 6671 1 15 . 1 1 77 77 HIS C C 77 171.370 171.370 173.850 -2.480 25277 6672 1 15 . 1 1 77 77 HIS CA C 77 55.590 55.590 54.535 1.056 25277 6673 1 15 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.609 -2.419 25277 6674 1 15 . 1 1 77 77 HIS H H 77 7.650 7.650 7.684 -0.034 25277 6675 1 15 . 1 1 78 78 GLY N N 78 101.350 101.350 105.916 -4.566 25277 6676 1 15 . 1 1 78 78 GLY C C 78 172.110 172.110 172.216 -0.106 25277 6677 1 15 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.852 -0.042 25277 6678 1 15 . 1 1 78 78 GLY H H 78 8.450 8.450 8.799 -0.349 25277 6679 1 15 . 1 1 79 79 THR N N 79 120.230 120.230 117.111 3.119 25277 6680 1 15 . 1 1 79 79 THR HA H 79 5.110 5.110 4.863 0.247 25277 6681 1 15 . 1 1 79 79 THR C C 79 172.920 172.920 173.919 -0.999 25277 6682 1 15 . 1 1 79 79 THR CA C 79 61.480 61.480 61.707 -0.227 25277 6683 1 15 . 1 1 79 79 THR CB C 79 72.130 72.130 70.570 1.559 25277 6684 1 15 . 1 1 79 79 THR H H 79 8.080 8.080 8.450 -0.370 25277 6685 1 15 . 1 1 80 80 ILE N N 80 119.620 119.620 120.700 -1.080 25277 6686 1 15 . 1 1 80 80 ILE HA H 80 5.140 5.140 4.966 0.174 25277 6687 1 15 . 1 1 80 80 ILE C C 80 174.340 174.340 174.367 -0.027 25277 6688 1 15 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.510 -0.160 25277 6689 1 15 . 1 1 80 80 ILE CB C 80 39.550 39.550 40.091 -0.541 25277 6690 1 15 . 1 1 80 80 ILE H H 80 8.970 8.970 8.630 0.340 25277 6691 1 15 . 1 1 81 81 GLU N N 81 119.960 119.960 124.204 -4.244 25277 6692 1 15 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.166 -0.166 25277 6693 1 15 . 1 1 81 81 GLU C C 81 176.130 176.130 174.979 1.151 25277 6694 1 15 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.774 -0.214 25277 6695 1 15 . 1 1 81 81 GLU CB C 81 33.390 33.390 34.792 -1.402 25277 6696 1 15 . 1 1 81 81 GLU H H 81 8.350 8.350 8.299 0.051 25277 6697 1 15 . 1 1 82 82 CYS N N 82 123.110 123.110 122.482 0.628 25277 6698 1 15 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.075 -0.145 25277 6699 1 15 . 1 1 82 82 CYS C C 82 174.430 174.430 174.879 -0.449 25277 6700 1 15 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.271 -5.031 25277 6701 1 15 . 1 1 82 82 CYS CB C 82 43.720 43.720 26.828 16.892 25277 6702 1 15 . 1 1 82 82 CYS H H 82 8.220 8.220 8.537 -0.317 25277 6703 1 15 . 1 1 83 83 LEU N N 83 131.660 131.660 127.411 4.249 25277 6704 1 15 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.724 -0.194 25277 6705 1 15 . 1 1 83 83 LEU CA C 83 53.900 53.900 53.040 0.860 25277 6706 1 15 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.921 -2.721 25277 6707 1 15 . 1 1 83 83 LEU H H 83 8.910 8.910 8.018 0.892 25277 6708 1 15 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.250 0.120 25277 6709 1 15 . 1 1 84 84 PRO CA C 84 63.190 63.190 64.990 -1.800 25277 6710 1 15 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.814 0.116 25277 6711 1 15 . 1 1 85 85 SER N N 85 117.620 117.620 113.367 4.253 25277 6712 1 15 . 1 1 85 85 SER HA H 85 3.870 3.870 4.303 -0.433 25277 6713 1 15 . 1 1 85 85 SER C C 85 174.350 174.350 175.028 -0.678 25277 6714 1 15 . 1 1 85 85 SER CA C 85 58.970 58.970 58.355 0.616 25277 6715 1 15 . 1 1 85 85 SER CB C 85 63.820 63.820 63.332 0.488 25277 6716 1 15 . 1 1 85 85 SER H H 85 7.660 7.660 8.102 -0.442 25277 6717 1 15 . 1 1 86 86 ASP N N 86 117.590 117.590 120.659 -3.069 25277 6718 1 15 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.374 -0.234 25277 6719 1 15 . 1 1 86 86 ASP C C 86 174.480 174.480 173.965 0.515 25277 6720 1 15 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.648 -0.668 25277 6721 1 15 . 1 1 86 86 ASP CB C 86 37.850 37.850 39.963 -2.113 25277 6722 1 15 . 1 1 86 86 ASP H H 86 8.490 8.490 8.338 0.152 25277 6723 1 15 . 1 1 87 87 ASN N N 87 117.160 117.160 114.647 2.513 25277 6724 1 15 . 1 1 87 87 ASN HA H 87 4.530 4.530 4.986 -0.456 25277 6725 1 15 . 1 1 87 87 ASN CA C 87 52.480 52.480 51.490 0.990 25277 6726 1 15 . 1 1 87 87 ASN CB C 87 40.040 40.040 40.879 -0.839 25277 6727 1 15 . 1 1 87 87 ASN H H 87 7.260 7.260 7.631 -0.371 25277 6728 1 15 . 1 1 88 88 ALA HA H 88 4.730 4.730 4.771 -0.041 25277 6729 1 15 . 1 1 88 88 ALA C C 88 174.620 174.620 176.376 -1.756 25277 6730 1 15 . 1 1 88 88 ALA CA C 88 51.230 51.230 50.851 0.379 25277 6731 1 15 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.390 0.151 25277 6732 1 15 . 1 1 89 89 VAL N N 89 116.580 116.580 118.199 -1.619 25277 6733 1 15 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.110 -0.010 25277 6734 1 15 . 1 1 89 89 VAL C C 89 172.750 172.750 173.545 -0.795 25277 6735 1 15 . 1 1 89 89 VAL CA C 89 58.980 58.980 59.020 -0.040 25277 6736 1 15 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.319 0.901 25277 6737 1 15 . 1 1 89 89 VAL H H 89 8.740 8.740 8.390 0.350 25277 6738 1 15 . 1 1 90 90 PHE N N 90 120.300 120.300 123.565 -3.265 25277 6739 1 15 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.069 0.081 25277 6740 1 15 . 1 1 90 90 PHE C C 90 172.910 172.910 173.626 -0.716 25277 6741 1 15 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.500 0.300 25277 6742 1 15 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.097 1.553 25277 6743 1 15 . 1 1 90 90 PHE H H 90 8.950 8.950 9.109 -0.159 25277 6744 1 15 . 1 1 91 91 VAL N N 91 129.020 129.020 128.572 0.448 25277 6745 1 15 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.614 -0.154 25277 6746 1 15 . 1 1 91 91 VAL C C 91 175.910 175.910 174.052 1.858 25277 6747 1 15 . 1 1 91 91 VAL CA C 91 60.780 60.780 60.635 0.145 25277 6748 1 15 . 1 1 91 91 VAL CB C 91 32.020 32.020 33.923 -1.903 25277 6749 1 15 . 1 1 91 91 VAL H H 91 9.090 9.090 8.658 0.432 25277 6750 1 15 . 1 1 92 92 ALA N N 92 129.760 129.760 129.218 0.542 25277 6751 1 15 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.766 -0.266 25277 6752 1 15 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.597 2.253 25277 6753 1 15 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.435 -1.385 25277 6754 1 15 . 1 1 92 92 ALA H H 92 8.680 8.680 8.454 0.226 25277 6755 1 15 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.061 0.099 25277 6756 1 15 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.208 0.192 25277 6757 1 15 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.283 0.657 25277 6758 1 15 . 1 1 94 94 ASP N N 94 113.220 113.220 116.044 -2.824 25277 6759 1 15 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.461 -0.041 25277 6760 1 15 . 1 1 94 94 ASP C C 94 176.980 176.980 177.607 -0.627 25277 6761 1 15 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.896 -0.366 25277 6762 1 15 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.760 -0.180 25277 6763 1 15 . 1 1 94 94 ASP H H 94 7.890 7.890 7.975 -0.085 25277 6764 1 15 . 1 1 95 95 GLY N N 95 109.120 109.120 108.615 0.505 25277 6765 1 15 . 1 1 95 95 GLY C C 95 174.440 174.440 174.363 0.077 25277 6766 1 15 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.075 -0.515 25277 6767 1 15 . 1 1 95 95 GLY H H 95 8.500 8.500 8.166 0.334 25277 6768 1 15 . 1 1 96 96 THR N N 96 120.350 120.350 117.999 2.351 25277 6769 1 15 . 1 1 96 96 THR HA H 96 3.780 3.780 4.375 -0.595 25277 6770 1 15 . 1 1 96 96 THR C C 96 172.590 172.590 173.408 -0.818 25277 6771 1 15 . 1 1 96 96 THR CA C 96 64.660 64.660 62.487 2.173 25277 6772 1 15 . 1 1 96 96 THR CB C 96 68.330 68.330 70.144 -1.814 25277 6773 1 15 . 1 1 96 96 THR H H 96 8.100 8.100 8.493 -0.393 25277 6774 1 15 . 1 1 97 97 THR N N 97 122.660 122.660 121.445 1.215 25277 6775 1 15 . 1 1 97 97 THR HA H 97 4.590 4.590 4.704 -0.114 25277 6776 1 15 . 1 1 97 97 THR C C 97 173.000 173.000 173.105 -0.105 25277 6777 1 15 . 1 1 97 97 THR CA C 97 62.700 62.700 61.642 1.058 25277 6778 1 15 . 1 1 97 97 THR CB C 97 68.840 68.840 69.807 -0.967 25277 6779 1 15 . 1 1 97 97 THR H H 97 7.850 7.850 8.336 -0.486 25277 6780 1 15 . 1 1 98 98 TYR N N 98 122.890 122.890 124.882 -1.992 25277 6781 1 15 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.154 -0.214 25277 6782 1 15 . 1 1 98 98 TYR C C 98 178.970 178.970 174.888 4.082 25277 6783 1 15 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.195 0.315 25277 6784 1 15 . 1 1 98 98 TYR CB C 98 42.950 42.950 41.937 1.013 25277 6785 1 15 . 1 1 98 98 TYR H H 98 9.460 9.460 9.125 0.335 25277 6786 1 15 . 1 1 99 99 ALA N N 99 121.760 121.760 123.871 -2.111 25277 6787 1 15 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.685 -0.575 25277 6788 1 15 . 1 1 99 99 ALA C C 99 178.010 178.010 176.604 1.406 25277 6789 1 15 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.199 1.071 25277 6790 1 15 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.660 2.390 25277 6791 1 15 . 1 1 99 99 ALA H H 99 9.110 9.110 8.827 0.283 25277 6792 1 15 . 1 1 100 100 LEU N N 100 119.330 119.330 124.841 -5.511 25277 6793 1 15 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.249 0.221 25277 6794 1 15 . 1 1 100 100 LEU C C 100 174.720 174.720 177.319 -2.599 25277 6795 1 15 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.586 -2.446 25277 6796 1 15 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.687 1.944 25277 6797 1 15 . 1 1 100 100 LEU H H 100 8.950 8.950 8.362 0.588 25277 6798 1 15 . 1 1 101 101 ASN N N 101 112.600 112.600 115.899 -3.299 25277 6799 1 15 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.816 0.104 25277 6800 1 15 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.219 -1.289 25277 6801 1 15 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.620 0.980 25277 6802 1 15 . 1 1 101 101 ASN H H 101 7.550 7.550 7.587 -0.037 25277 6803 1 15 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.333 -0.143 25277 6804 1 15 . 1 1 102 102 ASP C C 102 178.770 178.770 177.888 0.882 25277 6805 1 15 . 1 1 102 102 ASP CA C 102 56.880 56.880 57.799 -0.919 25277 6806 1 15 . 1 1 102 102 ASP CB C 102 39.980 39.980 41.236 -1.256 25277 6807 1 15 . 1 1 103 103 ARG N N 103 119.370 119.370 119.451 -0.081 25277 6808 1 15 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.083 -0.253 25277 6809 1 15 . 1 1 103 103 ARG C C 103 178.550 178.550 178.337 0.213 25277 6810 1 15 . 1 1 103 103 ARG CA C 103 59.380 59.380 59.066 0.314 25277 6811 1 15 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.932 -0.432 25277 6812 1 15 . 1 1 103 103 ARG H H 103 7.970 7.970 8.081 -0.111 25277 6813 1 15 . 1 1 104 104 ALA N N 104 120.110 120.110 122.299 -2.189 25277 6814 1 15 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.069 0.141 25277 6815 1 15 . 1 1 104 104 ALA C C 104 179.510 179.510 179.443 0.067 25277 6816 1 15 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.295 -0.545 25277 6817 1 15 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.380 1.290 25277 6818 1 15 . 1 1 104 104 ALA H H 104 7.610 7.610 8.519 -0.909 25277 6819 1 15 . 1 1 105 105 GLU N N 105 120.460 120.460 118.554 1.906 25277 6820 1 15 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.276 0.434 25277 6821 1 15 . 1 1 105 105 GLU C C 105 181.710 181.710 179.722 1.988 25277 6822 1 15 . 1 1 105 105 GLU CA C 105 58.680 58.680 58.633 0.047 25277 6823 1 15 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.604 -0.114 25277 6824 1 15 . 1 1 105 105 GLU H H 105 7.750 7.750 7.827 -0.077 25277 6825 1 15 . 1 1 106 106 LYS N N 106 121.980 121.980 120.735 1.245 25277 6826 1 15 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.073 -0.053 25277 6827 1 15 . 1 1 106 106 LYS C C 106 177.890 177.890 177.991 -0.101 25277 6828 1 15 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.416 0.054 25277 6829 1 15 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.200 -0.470 25277 6830 1 15 . 1 1 106 106 LYS H H 106 8.380 8.380 7.933 0.447 25277 6831 1 15 . 1 1 107 107 ALA N N 107 119.850 119.850 118.780 1.070 25277 6832 1 15 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.287 -0.027 25277 6833 1 15 . 1 1 107 107 ALA C C 107 177.210 177.210 177.619 -0.409 25277 6834 1 15 . 1 1 107 107 ALA CA C 107 52.270 52.270 52.007 0.264 25277 6835 1 15 . 1 1 107 107 ALA CB C 107 18.740 18.740 18.749 -0.009 25277 6836 1 15 . 1 1 107 107 ALA H H 107 7.400 7.400 7.596 -0.196 25277 6837 1 15 . 1 1 108 108 GLY N N 108 104.560 104.560 106.054 -1.494 25277 6838 1 15 . 1 1 108 108 GLY C C 108 174.300 174.300 174.412 -0.112 25277 6839 1 15 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.048 -0.438 25277 6840 1 15 . 1 1 108 108 GLY H H 108 7.560 7.560 7.787 -0.227 25277 6841 1 15 . 1 1 109 109 HIS N N 109 122.550 122.550 120.827 1.723 25277 6842 1 15 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.937 -0.167 25277 6843 1 15 . 1 1 109 109 HIS CA C 109 54.580 54.580 53.668 0.912 25277 6844 1 15 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.311 -0.721 25277 6845 1 15 . 1 1 109 109 HIS H H 109 7.590 7.590 7.678 -0.088 25277 6846 1 15 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.659 -0.099 25277 6847 1 15 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.141 0.589 25277 6848 1 15 . 1 1 111 111 PRO CB C 111 32.800 32.800 33.081 -0.281 25277 6849 1 15 . 1 1 112 112 ILE N N 112 119.770 119.770 119.699 0.071 25277 6850 1 15 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.415 0.445 25277 6851 1 15 . 1 1 112 112 ILE C C 112 172.800 172.800 177.515 -4.715 25277 6852 1 15 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.221 -2.031 25277 6853 1 15 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.322 3.119 25277 6854 1 15 . 1 1 112 112 ILE H H 112 7.890 7.890 8.569 -0.679 25277 6855 1 15 . 1 1 113 113 THR N N 113 113.610 113.610 116.191 -2.581 25277 6856 1 15 . 1 1 113 113 THR HA H 113 3.010 3.010 3.931 -0.921 25277 6857 1 15 . 1 1 113 113 THR CA C 113 66.860 66.860 68.409 -1.549 25277 6858 1 15 . 1 1 113 113 THR CB C 113 66.920 66.920 67.620 -0.700 25277 6859 1 15 . 1 1 113 113 THR H H 113 7.070 7.070 8.483 -1.413 25277 6860 1 15 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.338 0.002 25277 6861 1 15 . 1 1 114 114 PRO CA C 114 66.080 66.080 65.015 1.065 25277 6862 1 15 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.537 0.544 25277 6863 1 15 . 1 1 115 115 ILE N N 115 134.770 134.770 109.948 24.822 25277 6864 1 15 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.420 0.191 25277 6865 1 15 . 1 1 115 115 ILE C C 115 174.800 174.800 174.895 -0.095 25277 6866 1 15 . 1 1 115 115 ILE CA C 115 60.000 60.000 59.932 0.068 25277 6867 1 15 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.592 0.268 25277 6868 1 15 . 1 1 115 115 ILE H H 115 7.510 7.510 7.539 -0.029 25277 6869 1 15 . 1 1 116 116 ARG N N 116 120.890 120.890 122.122 -1.232 25277 6870 1 15 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.155 -0.185 25277 6871 1 15 . 1 1 116 116 ARG C C 116 174.910 174.910 175.753 -0.843 25277 6872 1 15 . 1 1 116 116 ARG CA C 116 57.780 57.780 55.919 1.861 25277 6873 1 15 . 1 1 116 116 ARG CB C 116 31.870 31.870 31.463 0.407 25277 6874 1 15 . 1 1 116 116 ARG H H 116 7.280 7.280 7.525 -0.245 25277 6875 1 15 . 1 1 117 117 ALA N N 117 125.400 125.400 127.974 -2.574 25277 6876 1 15 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.373 -0.143 25277 6877 1 15 . 1 1 117 117 ALA C C 117 176.290 176.290 175.745 0.545 25277 6878 1 15 . 1 1 117 117 ALA CA C 117 50.780 50.780 51.122 -0.342 25277 6879 1 15 . 1 1 117 117 ALA CB C 117 20.290 20.290 20.888 -0.598 25277 6880 1 15 . 1 1 117 117 ALA H H 117 8.150 8.150 8.385 -0.235 25277 6881 1 15 . 1 1 118 118 LYS N N 118 119.890 119.890 122.397 -2.507 25277 6882 1 15 . 1 1 118 118 LYS HA H 118 4.590 4.590 3.703 0.887 25277 6883 1 15 . 1 1 118 118 LYS C C 118 177.400 177.400 176.402 0.998 25277 6884 1 15 . 1 1 118 118 LYS CA C 118 55.670 55.670 55.132 0.538 25277 6885 1 15 . 1 1 118 118 LYS CB C 118 34.510 34.510 33.448 1.062 25277 6886 1 15 . 1 1 118 118 LYS H H 118 8.360 8.360 8.287 0.073 25277 6887 1 15 . 1 1 119 119 GLY N N 119 108.630 108.630 112.312 -3.682 25277 6888 1 15 . 1 1 119 119 GLY CA C 119 43.610 43.610 44.004 -0.394 25277 6889 1 15 . 1 1 119 119 GLY H H 119 8.320 8.320 8.005 0.315 25277 6890 1 15 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.739 0.161 25277 6891 1 15 . 1 1 124 124 TYR C C 124 177.430 177.430 176.488 0.942 25277 6892 1 15 . 1 1 124 124 TYR CA C 124 57.970 57.970 57.337 0.633 25277 6893 1 15 . 1 1 124 124 TYR CB C 124 38.650 38.650 40.539 -1.889 25277 6894 1 15 . 1 1 125 125 ILE N N 125 123.670 123.670 122.694 0.976 25277 6895 1 15 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.150 -0.310 25277 6896 1 15 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.392 0.337 25277 6897 1 15 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.363 0.147 25277 6898 1 15 . 1 1 125 125 ILE H H 125 8.340 8.340 8.085 0.255 25277 6899 1 15 . 1 1 126 126 SER HA H 126 4.070 4.070 4.397 -0.327 25277 6900 1 15 . 1 1 126 126 SER C C 126 176.290 176.290 174.991 1.299 25277 6901 1 15 . 1 1 126 126 SER CA C 126 59.190 59.190 58.984 0.206 25277 6902 1 15 . 1 1 126 126 SER CB C 126 63.200 63.200 63.785 -0.585 25277 6903 1 15 . 1 1 127 127 LEU N N 127 127.030 127.030 124.075 2.955 25277 6904 1 15 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.314 -0.374 25277 6905 1 15 . 1 1 127 127 LEU C C 127 176.660 176.660 178.303 -1.643 25277 6906 1 15 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.603 0.507 25277 6907 1 15 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.714 1.216 25277 6908 1 15 . 1 1 127 127 LEU H H 127 8.790 8.790 8.325 0.465 25277 6909 1 15 . 1 1 128 128 GLY N N 128 106.600 106.600 108.895 -2.295 25277 6910 1 15 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.623 0.907 25277 6911 1 15 . 1 1 128 128 GLY H H 128 8.450 8.450 8.309 0.141 25277 6912 1 15 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.040 0.190 25277 6913 1 15 . 1 1 129 129 ALA C C 129 180.410 180.410 179.206 1.204 25277 6914 1 15 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.577 0.343 25277 6915 1 15 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.307 0.823 25277 6916 1 15 . 1 1 130 130 LEU N N 130 122.550 122.550 120.613 1.937 25277 6917 1 15 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.044 -0.124 25277 6918 1 15 . 1 1 130 130 LEU C C 130 179.020 179.020 178.475 0.545 25277 6919 1 15 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.431 0.199 25277 6920 1 15 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.641 0.499 25277 6921 1 15 . 1 1 130 130 LEU H H 130 8.040 8.040 7.446 0.594 25277 6922 1 15 . 1 1 131 131 LEU N N 131 121.910 121.910 119.534 2.376 25277 6923 1 15 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.895 0.025 25277 6924 1 15 . 1 1 131 131 LEU C C 131 177.910 177.910 178.494 -0.584 25277 6925 1 15 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.151 0.419 25277 6926 1 15 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.505 -0.785 25277 6927 1 15 . 1 1 131 131 LEU H H 131 9.060 9.060 7.899 1.161 25277 6928 1 15 . 1 1 132 132 SER N N 132 115.530 115.530 114.810 0.720 25277 6929 1 15 . 1 1 132 132 SER HA H 132 3.970 3.970 4.128 -0.158 25277 6930 1 15 . 1 1 132 132 SER C C 132 177.140 177.140 176.813 0.327 25277 6931 1 15 . 1 1 132 132 SER CA C 132 62.340 62.340 62.418 -0.078 25277 6932 1 15 . 1 1 132 132 SER CB C 132 62.370 62.370 62.707 -0.337 25277 6933 1 15 . 1 1 132 132 SER H H 132 8.730 8.730 8.161 0.569 25277 6934 1 15 . 1 1 133 133 THR N N 133 116.960 116.960 119.105 -2.145 25277 6935 1 15 . 1 1 133 133 THR HA H 133 3.860 3.860 4.058 -0.198 25277 6936 1 15 . 1 1 133 133 THR C C 133 175.670 175.670 176.538 -0.868 25277 6937 1 15 . 1 1 133 133 THR CA C 133 66.930 66.930 67.131 -0.201 25277 6938 1 15 . 1 1 133 133 THR CB C 133 68.880 68.880 68.596 0.284 25277 6939 1 15 . 1 1 133 133 THR H H 133 7.750 7.750 7.836 -0.086 25277 6940 1 15 . 1 1 134 134 THR N N 134 118.830 118.830 119.523 -0.693 25277 6941 1 15 . 1 1 134 134 THR HA H 134 3.780 3.780 3.971 -0.191 25277 6942 1 15 . 1 1 134 134 THR C C 134 176.750 176.750 176.263 0.487 25277 6943 1 15 . 1 1 134 134 THR CA C 134 67.650 67.650 67.354 0.296 25277 6944 1 15 . 1 1 134 134 THR CB C 134 67.560 67.560 68.658 -1.098 25277 6945 1 15 . 1 1 134 134 THR H H 134 7.570 7.570 7.656 -0.086 25277 6946 1 15 . 1 1 135 135 LEU N N 135 121.420 121.420 121.840 -0.420 25277 6947 1 15 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.927 0.563 25277 6948 1 15 . 1 1 135 135 LEU C C 135 180.050 180.050 178.823 1.227 25277 6949 1 15 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.258 -1.248 25277 6950 1 15 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.532 -0.922 25277 6951 1 15 . 1 1 135 135 LEU H H 135 8.650 8.650 8.218 0.432 25277 6952 1 15 . 1 1 136 136 ASN N N 136 117.010 117.010 117.485 -0.475 25277 6953 1 15 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.459 0.081 25277 6954 1 15 . 1 1 136 136 ASN C C 136 175.980 175.980 177.865 -1.885 25277 6955 1 15 . 1 1 136 136 ASN CA C 136 54.770 54.770 55.776 -1.006 25277 6956 1 15 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.267 0.172 25277 6957 1 15 . 1 1 136 136 ASN H H 136 7.360 7.360 7.874 -0.514 25277 6958 1 15 . 1 1 137 137 LEU N N 137 116.940 116.940 120.656 -3.716 25277 6959 1 15 . 1 1 137 137 LEU HA H 137 4.160 4.160 4.027 0.133 25277 6960 1 15 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.638 -2.208 25277 6961 1 15 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.652 -0.082 25277 6962 1 15 . 1 1 137 137 LEU H H 137 7.810 7.810 7.578 0.232 25277 6963 1 15 . 1 1 138 138 CYS N N 138 115.430 115.430 115.024 0.406 25277 6964 1 15 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.222 0.188 25277 6965 1 15 . 1 1 138 138 CYS CA C 138 55.480 55.480 60.816 -5.336 25277 6966 1 15 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.434 14.766 25277 6967 1 15 . 1 1 138 138 CYS H H 138 7.450 7.450 7.908 -0.458 25277 6968 1 15 . 1 1 139 139 GLY C C 139 178.800 178.800 174.031 4.769 25277 6969 1 15 . 1 1 139 139 GLY CA C 139 45.500 45.500 44.989 0.511 25277 6970 1 15 . 1 1 140 140 LYS N N 140 119.830 119.830 122.317 -2.487 25277 6971 1 15 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.350 -0.030 25277 6972 1 15 . 1 1 140 140 LYS C C 140 175.820 175.820 176.929 -1.109 25277 6973 1 15 . 1 1 140 140 LYS CA C 140 55.680 55.680 56.042 -0.362 25277 6974 1 15 . 1 1 140 140 LYS CB C 140 32.800 32.800 32.946 -0.146 25277 6975 1 15 . 1 1 140 140 LYS H H 140 7.760 7.760 7.410 0.350 25277 6976 1 16 . 1 1 27 27 PRO CA C 27 63.230 63.230 63.039 0.191 25277 6977 1 16 . 1 1 27 27 PRO CB C 27 32.050 32.050 32.233 -0.183 25277 6978 1 16 . 1 1 28 28 ASP N N 28 120.030 120.030 121.588 -1.558 25277 6979 1 16 . 1 1 28 28 ASP C C 28 176.130 176.130 175.800 0.330 25277 6980 1 16 . 1 1 28 28 ASP CA C 28 54.170 54.170 53.357 0.813 25277 6981 1 16 . 1 1 28 28 ASP CB C 28 40.860 40.860 43.018 -2.158 25277 6982 1 16 . 1 1 28 28 ASP H H 28 8.260 8.260 8.270 -0.010 25277 6983 1 16 . 1 1 29 29 LEU N N 29 123.030 123.030 121.136 1.894 25277 6984 1 16 . 1 1 29 29 LEU C C 29 177.870 177.870 177.724 0.146 25277 6985 1 16 . 1 1 29 29 LEU CA C 29 55.160 55.160 54.999 0.161 25277 6986 1 16 . 1 1 29 29 LEU CB C 29 42.270 42.270 42.612 -0.342 25277 6987 1 16 . 1 1 29 29 LEU H H 29 8.120 8.120 8.375 -0.255 25277 6988 1 16 . 1 1 30 30 GLY N N 30 109.350 109.350 109.870 -0.520 25277 6989 1 16 . 1 1 30 30 GLY CA C 30 45.340 45.340 45.078 0.262 25277 6990 1 16 . 1 1 30 30 GLY H H 30 8.410 8.410 8.333 0.077 25277 6991 1 16 . 1 1 44 44 PRO CA C 44 63.590 63.590 63.083 0.507 25277 6992 1 16 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.336 -0.346 25277 6993 1 16 . 1 1 45 45 ALA N N 45 122.140 122.140 123.408 -1.268 25277 6994 1 16 . 1 1 45 45 ALA CA C 45 52.670 52.670 52.578 0.092 25277 6995 1 16 . 1 1 45 45 ALA H H 45 8.350 8.350 8.107 0.243 25277 6996 1 16 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.339 -0.039 25277 6997 1 16 . 1 1 49 49 PRO CA C 49 62.950 62.950 62.621 0.329 25277 6998 1 16 . 1 1 49 49 PRO CB C 49 31.990 31.990 32.472 -0.482 25277 6999 1 16 . 1 1 50 50 VAL N N 50 124.190 124.190 122.221 1.969 25277 7000 1 16 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.371 -0.051 25277 7001 1 16 . 1 1 50 50 VAL CA C 50 59.850 59.850 59.878 -0.028 25277 7002 1 16 . 1 1 50 50 VAL CB C 50 32.480 32.480 32.108 0.372 25277 7003 1 16 . 1 1 50 50 VAL H H 50 8.070 8.070 8.271 -0.201 25277 7004 1 16 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.274 0.076 25277 7005 1 16 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.403 -0.473 25277 7006 1 16 . 1 1 51 51 PRO CB C 51 31.980 31.980 31.925 0.054 25277 7007 1 16 . 1 1 52 52 LEU N N 52 124.500 124.500 124.560 -0.060 25277 7008 1 16 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.266 0.224 25277 7009 1 16 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.748 -0.858 25277 7010 1 16 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.851 0.339 25277 7011 1 16 . 1 1 52 52 LEU H H 52 8.360 8.360 8.158 0.202 25277 7012 1 16 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.470 -0.060 25277 7013 1 16 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.764 -0.434 25277 7014 1 16 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.137 -0.147 25277 7015 1 16 . 1 1 54 54 SER N N 54 117.380 117.380 117.935 -0.555 25277 7016 1 16 . 1 1 54 54 SER HA H 54 4.600 4.600 4.360 0.240 25277 7017 1 16 . 1 1 54 54 SER CA C 54 56.710 56.710 57.390 -0.680 25277 7018 1 16 . 1 1 54 54 SER CB C 54 62.500 62.500 63.368 -0.868 25277 7019 1 16 . 1 1 54 54 SER H H 54 8.400 8.400 8.243 0.157 25277 7020 1 16 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.567 -0.017 25277 7021 1 16 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.431 0.109 25277 7022 1 16 . 1 1 55 55 PRO CB C 55 32.620 32.620 32.172 0.448 25277 7023 1 16 . 1 1 57 57 SER HA H 57 4.420 4.420 4.310 0.110 25277 7024 1 16 . 1 1 57 57 SER CA C 57 57.580 57.580 60.619 -3.039 25277 7025 1 16 . 1 1 57 57 SER CB C 57 63.780 63.780 63.171 0.609 25277 7026 1 16 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.364 0.626 25277 7027 1 16 . 1 1 58 58 ASN C C 58 172.230 172.230 173.827 -1.597 25277 7028 1 16 . 1 1 58 58 ASN CA C 58 53.670 53.670 54.656 -0.986 25277 7029 1 16 . 1 1 58 58 ASN CB C 58 37.850 37.850 37.014 0.836 25277 7030 1 16 . 1 1 59 59 LYS N N 59 117.660 117.660 117.879 -0.219 25277 7031 1 16 . 1 1 59 59 LYS HA H 59 5.360 5.360 4.932 0.428 25277 7032 1 16 . 1 1 59 59 LYS C C 59 175.120 175.120 173.845 1.275 25277 7033 1 16 . 1 1 59 59 LYS CA C 59 54.860 54.860 56.084 -1.224 25277 7034 1 16 . 1 1 59 59 LYS CB C 59 36.450 36.450 36.512 -0.062 25277 7035 1 16 . 1 1 59 59 LYS H H 59 7.640 7.640 7.781 -0.141 25277 7036 1 16 . 1 1 60 60 GLN N N 60 120.680 120.680 121.502 -0.822 25277 7037 1 16 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.654 -0.164 25277 7038 1 16 . 1 1 60 60 GLN C C 60 173.640 173.640 173.276 0.364 25277 7039 1 16 . 1 1 60 60 GLN CA C 60 55.480 55.480 54.727 0.753 25277 7040 1 16 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.216 -0.226 25277 7041 1 16 . 1 1 60 60 GLN H H 60 8.930 8.930 8.446 0.484 25277 7042 1 16 . 1 1 61 61 ASP N N 61 126.170 126.170 121.468 4.702 25277 7043 1 16 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.825 0.225 25277 7044 1 16 . 1 1 61 61 ASP C C 61 175.000 175.000 175.236 -0.236 25277 7045 1 16 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.459 0.421 25277 7046 1 16 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.432 -0.662 25277 7047 1 16 . 1 1 61 61 ASP H H 61 8.540 8.540 8.584 -0.044 25277 7048 1 16 . 1 1 62 62 ILE N N 62 121.100 121.100 125.471 -4.371 25277 7049 1 16 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.569 0.211 25277 7050 1 16 . 1 1 62 62 ILE C C 62 171.480 171.480 173.638 -2.158 25277 7051 1 16 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.586 0.504 25277 7052 1 16 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.399 0.741 25277 7053 1 16 . 1 1 62 62 ILE H H 62 8.970 8.970 8.420 0.550 25277 7054 1 16 . 1 1 63 63 SER N N 63 119.430 119.430 121.414 -1.984 25277 7055 1 16 . 1 1 63 63 SER HA H 63 4.680 4.680 4.514 0.166 25277 7056 1 16 . 1 1 63 63 SER C C 63 174.030 174.030 174.421 -0.391 25277 7057 1 16 . 1 1 63 63 SER CA C 63 56.550 56.550 56.387 0.163 25277 7058 1 16 . 1 1 63 63 SER CB C 63 67.320 67.320 66.037 1.283 25277 7059 1 16 . 1 1 63 63 SER H H 63 8.520 8.520 7.956 0.564 25277 7060 1 16 . 1 1 64 64 GLU N N 64 121.250 121.250 120.020 1.230 25277 7061 1 16 . 1 1 64 64 GLU HA H 64 2.770 2.770 3.017 -0.247 25277 7062 1 16 . 1 1 64 64 GLU C C 64 177.190 177.190 177.851 -0.661 25277 7063 1 16 . 1 1 64 64 GLU CA C 64 58.590 58.590 58.832 -0.242 25277 7064 1 16 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.648 -0.508 25277 7065 1 16 . 1 1 64 64 GLU H H 64 7.400 7.400 7.549 -0.149 25277 7066 1 16 . 1 1 65 65 ALA N N 65 119.250 119.250 122.228 -2.978 25277 7067 1 16 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.960 -0.100 25277 7068 1 16 . 1 1 65 65 ALA C C 65 179.630 179.630 179.778 -0.148 25277 7069 1 16 . 1 1 65 65 ALA CA C 65 53.810 53.810 54.700 -0.890 25277 7070 1 16 . 1 1 65 65 ALA CB C 65 18.400 18.400 17.945 0.455 25277 7071 1 16 . 1 1 65 65 ALA H H 65 7.700 7.700 8.311 -0.611 25277 7072 1 16 . 1 1 66 66 ASN N N 66 112.360 112.360 116.600 -4.240 25277 7073 1 16 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.510 0.520 25277 7074 1 16 . 1 1 66 66 ASN C C 66 174.580 174.580 177.271 -2.691 25277 7075 1 16 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.654 -0.104 25277 7076 1 16 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.546 1.384 25277 7077 1 16 . 1 1 66 66 ASN H H 66 7.960 7.960 7.553 0.407 25277 7078 1 16 . 1 1 67 67 LEU N N 67 115.390 115.390 118.629 -3.239 25277 7079 1 16 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.239 0.411 25277 7080 1 16 . 1 1 67 67 LEU C C 67 176.500 176.500 176.814 -0.314 25277 7081 1 16 . 1 1 67 67 LEU CA C 67 54.350 54.350 56.020 -1.670 25277 7082 1 16 . 1 1 67 67 LEU CB C 67 44.670 44.670 41.968 2.702 25277 7083 1 16 . 1 1 67 67 LEU H H 67 7.050 7.050 7.619 -0.569 25277 7084 1 16 . 1 1 68 68 ALA N N 68 125.680 125.680 120.535 5.145 25277 7085 1 16 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.903 -0.013 25277 7086 1 16 . 1 1 68 68 ALA C C 68 177.480 177.480 177.967 -0.487 25277 7087 1 16 . 1 1 68 68 ALA CA C 68 53.550 53.550 53.368 0.181 25277 7088 1 16 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.399 -0.249 25277 7089 1 16 . 1 1 68 68 ALA H H 68 8.880 8.880 7.928 0.952 25277 7090 1 16 . 1 1 69 69 TYR N N 69 119.780 119.780 121.299 -1.519 25277 7091 1 16 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.263 0.227 25277 7092 1 16 . 1 1 69 69 TYR C C 69 175.340 175.340 176.748 -1.408 25277 7093 1 16 . 1 1 69 69 TYR CA C 69 58.640 58.640 60.761 -2.121 25277 7094 1 16 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.283 -1.003 25277 7095 1 16 . 1 1 69 69 TYR H H 69 7.420 7.420 8.670 -1.250 25277 7096 1 16 . 1 1 70 70 LEU N N 70 118.820 118.820 118.409 0.411 25277 7097 1 16 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.070 0.220 25277 7098 1 16 . 1 1 70 70 LEU C C 70 176.770 176.770 177.133 -0.363 25277 7099 1 16 . 1 1 70 70 LEU CA C 70 53.880 53.880 56.322 -2.442 25277 7100 1 16 . 1 1 70 70 LEU CB C 70 41.300 41.300 41.987 -0.687 25277 7101 1 16 . 1 1 70 70 LEU H H 70 7.690 7.690 7.525 0.165 25277 7102 1 16 . 1 1 71 71 TRP N N 71 124.110 124.110 121.526 2.584 25277 7103 1 16 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.499 0.091 25277 7104 1 16 . 1 1 71 71 TRP CA C 71 54.150 54.150 56.122 -1.972 25277 7105 1 16 . 1 1 71 71 TRP CB C 71 30.210 30.210 29.947 0.263 25277 7106 1 16 . 1 1 71 71 TRP H H 71 8.130 8.130 7.635 0.495 25277 7107 1 16 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.269 0.311 25277 7108 1 16 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.103 0.487 25277 7109 1 16 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.741 -1.681 25277 7110 1 16 . 1 1 73 73 LEU N N 73 118.760 118.760 118.061 0.699 25277 7111 1 16 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.536 0.864 25277 7112 1 16 . 1 1 73 73 LEU C C 73 176.620 176.620 178.392 -1.772 25277 7113 1 16 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.873 -0.823 25277 7114 1 16 . 1 1 73 73 LEU CB C 73 44.260 44.260 42.713 1.547 25277 7115 1 16 . 1 1 73 73 LEU H H 73 5.190 5.190 6.638 -1.448 25277 7116 1 16 . 1 1 74 74 THR N N 74 110.120 110.120 115.773 -5.653 25277 7117 1 16 . 1 1 74 74 THR HA H 74 4.250 4.250 4.174 0.076 25277 7118 1 16 . 1 1 74 74 THR C C 74 176.080 176.080 175.451 0.629 25277 7119 1 16 . 1 1 74 74 THR CA C 74 62.690 62.690 64.198 -1.508 25277 7120 1 16 . 1 1 74 74 THR CB C 74 67.930 67.930 69.200 -1.270 25277 7121 1 16 . 1 1 74 74 THR H H 74 9.010 9.010 8.567 0.443 25277 7122 1 16 . 1 1 75 75 VAL N N 75 113.030 113.030 118.357 -5.327 25277 7123 1 16 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.252 0.558 25277 7124 1 16 . 1 1 75 75 VAL C C 75 176.010 176.010 177.234 -1.224 25277 7125 1 16 . 1 1 75 75 VAL CA C 75 59.100 59.100 62.562 -3.462 25277 7126 1 16 . 1 1 75 75 VAL CB C 75 33.220 33.220 32.545 0.675 25277 7127 1 16 . 1 1 75 75 VAL H H 75 6.660 6.660 7.658 -0.998 25277 7128 1 16 . 1 1 76 76 ASP N N 76 119.590 119.590 124.521 -4.931 25277 7129 1 16 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.653 -0.163 25277 7130 1 16 . 1 1 76 76 ASP C C 76 175.060 175.060 175.960 -0.900 25277 7131 1 16 . 1 1 76 76 ASP CA C 76 55.110 55.110 57.123 -2.013 25277 7132 1 16 . 1 1 76 76 ASP CB C 76 41.300 41.300 41.137 0.163 25277 7133 1 16 . 1 1 76 76 ASP H H 76 8.770 8.770 9.039 -0.269 25277 7134 1 16 . 1 1 77 77 HIS N N 77 113.300 113.300 112.035 1.265 25277 7135 1 16 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.686 0.404 25277 7136 1 16 . 1 1 77 77 HIS C C 77 171.370 171.370 173.858 -2.488 25277 7137 1 16 . 1 1 77 77 HIS CA C 77 55.590 55.590 54.523 1.067 25277 7138 1 16 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.609 -2.419 25277 7139 1 16 . 1 1 77 77 HIS H H 77 7.650 7.650 7.670 -0.020 25277 7140 1 16 . 1 1 78 78 GLY N N 78 101.350 101.350 105.345 -3.995 25277 7141 1 16 . 1 1 78 78 GLY C C 78 172.110 172.110 172.419 -0.309 25277 7142 1 16 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.821 -0.011 25277 7143 1 16 . 1 1 78 78 GLY H H 78 8.450 8.450 8.738 -0.288 25277 7144 1 16 . 1 1 79 79 THR N N 79 120.230 120.230 117.038 3.192 25277 7145 1 16 . 1 1 79 79 THR HA H 79 5.110 5.110 4.877 0.233 25277 7146 1 16 . 1 1 79 79 THR C C 79 172.920 172.920 173.763 -0.843 25277 7147 1 16 . 1 1 79 79 THR CA C 79 61.480 61.480 62.124 -0.644 25277 7148 1 16 . 1 1 79 79 THR CB C 79 72.130 72.130 70.709 1.421 25277 7149 1 16 . 1 1 79 79 THR H H 79 8.080 8.080 8.490 -0.410 25277 7150 1 16 . 1 1 80 80 ILE N N 80 119.620 119.620 120.554 -0.934 25277 7151 1 16 . 1 1 80 80 ILE HA H 80 5.140 5.140 4.913 0.227 25277 7152 1 16 . 1 1 80 80 ILE C C 80 174.340 174.340 174.000 0.340 25277 7153 1 16 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.545 -0.195 25277 7154 1 16 . 1 1 80 80 ILE CB C 80 39.550 39.550 40.275 -0.725 25277 7155 1 16 . 1 1 80 80 ILE H H 80 8.970 8.970 8.758 0.212 25277 7156 1 16 . 1 1 81 81 GLU N N 81 119.960 119.960 125.697 -5.737 25277 7157 1 16 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.094 -0.094 25277 7158 1 16 . 1 1 81 81 GLU C C 81 176.130 176.130 174.592 1.538 25277 7159 1 16 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.797 -0.237 25277 7160 1 16 . 1 1 81 81 GLU CB C 81 33.390 33.390 34.598 -1.208 25277 7161 1 16 . 1 1 81 81 GLU H H 81 8.350 8.350 8.274 0.076 25277 7162 1 16 . 1 1 82 82 CYS N N 82 123.110 123.110 124.490 -1.380 25277 7163 1 16 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.099 -0.169 25277 7164 1 16 . 1 1 82 82 CYS C C 82 174.430 174.430 175.098 -0.668 25277 7165 1 16 . 1 1 82 82 CYS CA C 82 54.240 54.240 58.796 -4.556 25277 7166 1 16 . 1 1 82 82 CYS CB C 82 43.720 43.720 26.343 17.377 25277 7167 1 16 . 1 1 82 82 CYS H H 82 8.220 8.220 8.368 -0.148 25277 7168 1 16 . 1 1 83 83 LEU N N 83 131.660 131.660 126.549 5.111 25277 7169 1 16 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.731 -0.201 25277 7170 1 16 . 1 1 83 83 LEU CA C 83 53.900 53.900 52.784 1.116 25277 7171 1 16 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.251 -2.051 25277 7172 1 16 . 1 1 83 83 LEU H H 83 8.910 8.910 8.002 0.908 25277 7173 1 16 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.259 0.111 25277 7174 1 16 . 1 1 84 84 PRO CA C 84 63.190 63.190 65.159 -1.970 25277 7175 1 16 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.899 0.031 25277 7176 1 16 . 1 1 85 85 SER N N 85 117.620 117.620 112.483 5.137 25277 7177 1 16 . 1 1 85 85 SER HA H 85 3.870 3.870 4.342 -0.472 25277 7178 1 16 . 1 1 85 85 SER C C 85 174.350 174.350 174.688 -0.338 25277 7179 1 16 . 1 1 85 85 SER CA C 85 58.970 58.970 58.581 0.389 25277 7180 1 16 . 1 1 85 85 SER CB C 85 63.820 63.820 63.152 0.668 25277 7181 1 16 . 1 1 85 85 SER H H 85 7.660 7.660 8.100 -0.440 25277 7182 1 16 . 1 1 86 86 ASP N N 86 117.590 117.590 118.995 -1.405 25277 7183 1 16 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.319 -0.179 25277 7184 1 16 . 1 1 86 86 ASP C C 86 174.480 174.480 174.156 0.324 25277 7185 1 16 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.734 -0.754 25277 7186 1 16 . 1 1 86 86 ASP CB C 86 37.850 37.850 38.701 -0.851 25277 7187 1 16 . 1 1 86 86 ASP H H 86 8.490 8.490 8.448 0.042 25277 7188 1 16 . 1 1 87 87 ASN N N 87 117.160 117.160 113.709 3.451 25277 7189 1 16 . 1 1 87 87 ASN HA H 87 4.530 4.530 5.111 -0.581 25277 7190 1 16 . 1 1 87 87 ASN CA C 87 52.480 52.480 51.686 0.794 25277 7191 1 16 . 1 1 87 87 ASN CB C 87 40.040 40.040 41.413 -1.373 25277 7192 1 16 . 1 1 87 87 ASN H H 87 7.260 7.260 7.619 -0.359 25277 7193 1 16 . 1 1 88 88 ALA HA H 88 4.730 4.730 4.714 0.016 25277 7194 1 16 . 1 1 88 88 ALA C C 88 174.620 174.620 176.161 -1.541 25277 7195 1 16 . 1 1 88 88 ALA CA C 88 51.230 51.230 50.791 0.439 25277 7196 1 16 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.161 0.379 25277 7197 1 16 . 1 1 89 89 VAL N N 89 116.580 116.580 119.011 -2.431 25277 7198 1 16 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.012 0.088 25277 7199 1 16 . 1 1 89 89 VAL C C 89 172.750 172.750 173.498 -0.748 25277 7200 1 16 . 1 1 89 89 VAL CA C 89 58.980 58.980 59.503 -0.523 25277 7201 1 16 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.390 0.830 25277 7202 1 16 . 1 1 89 89 VAL H H 89 8.740 8.740 8.235 0.505 25277 7203 1 16 . 1 1 90 90 PHE N N 90 120.300 120.300 123.292 -2.992 25277 7204 1 16 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.109 0.041 25277 7205 1 16 . 1 1 90 90 PHE C C 90 172.910 172.910 173.681 -0.771 25277 7206 1 16 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.434 0.366 25277 7207 1 16 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.618 1.032 25277 7208 1 16 . 1 1 90 90 PHE H H 90 8.950 8.950 8.996 -0.046 25277 7209 1 16 . 1 1 91 91 VAL N N 91 129.020 129.020 127.481 1.539 25277 7210 1 16 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.647 -0.187 25277 7211 1 16 . 1 1 91 91 VAL C C 91 175.910 175.910 173.979 1.931 25277 7212 1 16 . 1 1 91 91 VAL CA C 91 60.780 60.780 60.541 0.239 25277 7213 1 16 . 1 1 91 91 VAL CB C 91 32.020 32.020 34.033 -2.013 25277 7214 1 16 . 1 1 91 91 VAL H H 91 9.090 9.090 8.614 0.476 25277 7215 1 16 . 1 1 92 92 ALA N N 92 129.760 129.760 129.834 -0.074 25277 7216 1 16 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.733 -0.233 25277 7217 1 16 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.784 2.066 25277 7218 1 16 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.528 -1.478 25277 7219 1 16 . 1 1 92 92 ALA H H 92 8.680 8.680 8.406 0.274 25277 7220 1 16 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.062 0.098 25277 7221 1 16 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.180 0.220 25277 7222 1 16 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.275 0.665 25277 7223 1 16 . 1 1 94 94 ASP N N 94 113.220 113.220 116.034 -2.814 25277 7224 1 16 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.460 -0.040 25277 7225 1 16 . 1 1 94 94 ASP C C 94 176.980 176.980 177.618 -0.638 25277 7226 1 16 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.895 -0.365 25277 7227 1 16 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.757 -0.177 25277 7228 1 16 . 1 1 94 94 ASP H H 94 7.890 7.890 7.971 -0.081 25277 7229 1 16 . 1 1 95 95 GLY N N 95 109.120 109.120 108.684 0.436 25277 7230 1 16 . 1 1 95 95 GLY C C 95 174.440 174.440 174.253 0.187 25277 7231 1 16 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.140 -0.580 25277 7232 1 16 . 1 1 95 95 GLY H H 95 8.500 8.500 8.155 0.345 25277 7233 1 16 . 1 1 96 96 THR N N 96 120.350 120.350 118.402 1.948 25277 7234 1 16 . 1 1 96 96 THR HA H 96 3.780 3.780 4.342 -0.562 25277 7235 1 16 . 1 1 96 96 THR C C 96 172.590 172.590 173.236 -0.646 25277 7236 1 16 . 1 1 96 96 THR CA C 96 64.660 64.660 61.912 2.748 25277 7237 1 16 . 1 1 96 96 THR CB C 96 68.330 68.330 70.135 -1.805 25277 7238 1 16 . 1 1 96 96 THR H H 96 8.100 8.100 8.420 -0.320 25277 7239 1 16 . 1 1 97 97 THR N N 97 122.660 122.660 121.232 1.428 25277 7240 1 16 . 1 1 97 97 THR HA H 97 4.590 4.590 4.785 -0.195 25277 7241 1 16 . 1 1 97 97 THR C C 97 173.000 173.000 173.631 -0.631 25277 7242 1 16 . 1 1 97 97 THR CA C 97 62.700 62.700 62.114 0.586 25277 7243 1 16 . 1 1 97 97 THR CB C 97 68.840 68.840 69.671 -0.831 25277 7244 1 16 . 1 1 97 97 THR H H 97 7.850 7.850 8.435 -0.585 25277 7245 1 16 . 1 1 98 98 TYR N N 98 122.890 122.890 125.638 -2.748 25277 7246 1 16 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.254 -0.314 25277 7247 1 16 . 1 1 98 98 TYR C C 98 178.970 178.970 174.833 4.137 25277 7248 1 16 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.043 0.467 25277 7249 1 16 . 1 1 98 98 TYR CB C 98 42.950 42.950 41.927 1.023 25277 7250 1 16 . 1 1 98 98 TYR H H 98 9.460 9.460 9.271 0.189 25277 7251 1 16 . 1 1 99 99 ALA N N 99 121.760 121.760 123.784 -2.024 25277 7252 1 16 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.635 -0.525 25277 7253 1 16 . 1 1 99 99 ALA C C 99 178.010 178.010 176.395 1.615 25277 7254 1 16 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.176 1.094 25277 7255 1 16 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.640 2.410 25277 7256 1 16 . 1 1 99 99 ALA H H 99 9.110 9.110 8.890 0.220 25277 7257 1 16 . 1 1 100 100 LEU N N 100 119.330 119.330 124.387 -5.057 25277 7258 1 16 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.250 0.220 25277 7259 1 16 . 1 1 100 100 LEU C C 100 174.720 174.720 177.218 -2.498 25277 7260 1 16 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.855 -2.715 25277 7261 1 16 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.637 1.993 25277 7262 1 16 . 1 1 100 100 LEU H H 100 8.950 8.950 8.417 0.533 25277 7263 1 16 . 1 1 101 101 ASN N N 101 112.600 112.600 115.728 -3.128 25277 7264 1 16 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.914 0.006 25277 7265 1 16 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.456 -1.526 25277 7266 1 16 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.634 0.966 25277 7267 1 16 . 1 1 101 101 ASN H H 101 7.550 7.550 7.743 -0.193 25277 7268 1 16 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.341 -0.151 25277 7269 1 16 . 1 1 102 102 ASP C C 102 178.770 178.770 178.516 0.254 25277 7270 1 16 . 1 1 102 102 ASP CA C 102 56.880 56.880 58.056 -1.176 25277 7271 1 16 . 1 1 102 102 ASP CB C 102 39.980 39.980 40.524 -0.544 25277 7272 1 16 . 1 1 103 103 ARG N N 103 119.370 119.370 119.721 -0.351 25277 7273 1 16 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.055 -0.225 25277 7274 1 16 . 1 1 103 103 ARG C C 103 178.550 178.550 178.420 0.130 25277 7275 1 16 . 1 1 103 103 ARG CA C 103 59.380 59.380 58.837 0.543 25277 7276 1 16 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.975 -0.475 25277 7277 1 16 . 1 1 103 103 ARG H H 103 7.970 7.970 8.245 -0.275 25277 7278 1 16 . 1 1 104 104 ALA N N 104 120.110 120.110 121.718 -1.608 25277 7279 1 16 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.076 0.134 25277 7280 1 16 . 1 1 104 104 ALA C C 104 179.510 179.510 179.566 -0.056 25277 7281 1 16 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.309 -0.559 25277 7282 1 16 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.289 1.381 25277 7283 1 16 . 1 1 104 104 ALA H H 104 7.610 7.610 8.541 -0.931 25277 7284 1 16 . 1 1 105 105 GLU N N 105 120.460 120.460 118.501 1.959 25277 7285 1 16 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.165 0.545 25277 7286 1 16 . 1 1 105 105 GLU C C 105 181.710 181.710 179.778 1.932 25277 7287 1 16 . 1 1 105 105 GLU CA C 105 58.680 58.680 58.536 0.144 25277 7288 1 16 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.332 0.158 25277 7289 1 16 . 1 1 105 105 GLU H H 105 7.750 7.750 7.832 -0.082 25277 7290 1 16 . 1 1 106 106 LYS N N 106 121.980 121.980 120.698 1.282 25277 7291 1 16 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.108 -0.088 25277 7292 1 16 . 1 1 106 106 LYS C C 106 177.890 177.890 178.280 -0.390 25277 7293 1 16 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.355 0.115 25277 7294 1 16 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.177 -0.447 25277 7295 1 16 . 1 1 106 106 LYS H H 106 8.380 8.380 8.009 0.371 25277 7296 1 16 . 1 1 107 107 ALA N N 107 119.850 119.850 118.895 0.955 25277 7297 1 16 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.314 -0.054 25277 7298 1 16 . 1 1 107 107 ALA C C 107 177.210 177.210 177.779 -0.569 25277 7299 1 16 . 1 1 107 107 ALA CA C 107 52.270 52.270 52.199 0.071 25277 7300 1 16 . 1 1 107 107 ALA CB C 107 18.740 18.740 18.986 -0.246 25277 7301 1 16 . 1 1 107 107 ALA H H 107 7.400 7.400 7.613 -0.213 25277 7302 1 16 . 1 1 108 108 GLY N N 108 104.560 104.560 105.766 -1.206 25277 7303 1 16 . 1 1 108 108 GLY C C 108 174.300 174.300 174.447 -0.147 25277 7304 1 16 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.015 -0.405 25277 7305 1 16 . 1 1 108 108 GLY H H 108 7.560 7.560 7.817 -0.257 25277 7306 1 16 . 1 1 109 109 HIS N N 109 122.550 122.550 120.630 1.920 25277 7307 1 16 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.938 -0.168 25277 7308 1 16 . 1 1 109 109 HIS CA C 109 54.580 54.580 54.628 -0.048 25277 7309 1 16 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.956 -1.366 25277 7310 1 16 . 1 1 109 109 HIS H H 109 7.590 7.590 7.704 -0.114 25277 7311 1 16 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.923 -0.363 25277 7312 1 16 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.206 0.524 25277 7313 1 16 . 1 1 111 111 PRO CB C 111 32.800 32.800 33.259 -0.459 25277 7314 1 16 . 1 1 112 112 ILE N N 112 119.770 119.770 119.262 0.508 25277 7315 1 16 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.496 0.364 25277 7316 1 16 . 1 1 112 112 ILE C C 112 172.800 172.800 177.576 -4.776 25277 7317 1 16 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.616 -2.426 25277 7318 1 16 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.504 2.936 25277 7319 1 16 . 1 1 112 112 ILE H H 112 7.890 7.890 8.278 -0.388 25277 7320 1 16 . 1 1 113 113 THR N N 113 113.610 113.610 115.948 -2.338 25277 7321 1 16 . 1 1 113 113 THR HA H 113 3.010 3.010 4.003 -0.993 25277 7322 1 16 . 1 1 113 113 THR CA C 113 66.860 66.860 68.061 -1.201 25277 7323 1 16 . 1 1 113 113 THR CB C 113 66.920 66.920 67.257 -0.337 25277 7324 1 16 . 1 1 113 113 THR H H 113 7.070 7.070 8.552 -1.482 25277 7325 1 16 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.394 -0.054 25277 7326 1 16 . 1 1 114 114 PRO CA C 114 66.080 66.080 64.897 1.183 25277 7327 1 16 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.563 0.517 25277 7328 1 16 . 1 1 115 115 ILE N N 115 134.770 134.770 110.428 24.342 25277 7329 1 16 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.371 0.239 25277 7330 1 16 . 1 1 115 115 ILE C C 115 174.800 174.800 174.968 -0.168 25277 7331 1 16 . 1 1 115 115 ILE CA C 115 60.000 60.000 59.985 0.015 25277 7332 1 16 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.451 0.409 25277 7333 1 16 . 1 1 115 115 ILE H H 115 7.510 7.510 7.642 -0.132 25277 7334 1 16 . 1 1 116 116 ARG N N 116 120.890 120.890 121.366 -0.476 25277 7335 1 16 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.109 -0.139 25277 7336 1 16 . 1 1 116 116 ARG C C 116 174.910 174.910 176.113 -1.203 25277 7337 1 16 . 1 1 116 116 ARG CA C 116 57.780 57.780 55.987 1.793 25277 7338 1 16 . 1 1 116 116 ARG CB C 116 31.870 31.870 30.835 1.035 25277 7339 1 16 . 1 1 116 116 ARG H H 116 7.280 7.280 7.515 -0.235 25277 7340 1 16 . 1 1 117 117 ALA N N 117 125.400 125.400 125.740 -0.340 25277 7341 1 16 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.269 -0.039 25277 7342 1 16 . 1 1 117 117 ALA C C 117 176.290 176.290 176.269 0.021 25277 7343 1 16 . 1 1 117 117 ALA CA C 117 50.780 50.780 51.153 -0.373 25277 7344 1 16 . 1 1 117 117 ALA CB C 117 20.290 20.290 20.620 -0.330 25277 7345 1 16 . 1 1 117 117 ALA H H 117 8.150 8.150 8.358 -0.208 25277 7346 1 16 . 1 1 118 118 LYS N N 118 119.890 119.890 122.230 -2.340 25277 7347 1 16 . 1 1 118 118 LYS HA H 118 4.590 4.590 3.850 0.740 25277 7348 1 16 . 1 1 118 118 LYS C C 118 177.400 177.400 176.228 1.172 25277 7349 1 16 . 1 1 118 118 LYS CA C 118 55.670 55.670 55.946 -0.276 25277 7350 1 16 . 1 1 118 118 LYS CB C 118 34.510 34.510 33.289 1.221 25277 7351 1 16 . 1 1 118 118 LYS H H 118 8.360 8.360 8.315 0.045 25277 7352 1 16 . 1 1 119 119 GLY N N 119 108.630 108.630 112.348 -3.718 25277 7353 1 16 . 1 1 119 119 GLY CA C 119 43.610 43.610 44.162 -0.552 25277 7354 1 16 . 1 1 119 119 GLY H H 119 8.320 8.320 8.286 0.034 25277 7355 1 16 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.851 0.049 25277 7356 1 16 . 1 1 124 124 TYR C C 124 177.430 177.430 176.152 1.278 25277 7357 1 16 . 1 1 124 124 TYR CA C 124 57.970 57.970 57.419 0.551 25277 7358 1 16 . 1 1 124 124 TYR CB C 124 38.650 38.650 40.734 -2.084 25277 7359 1 16 . 1 1 125 125 ILE N N 125 123.670 123.670 123.424 0.246 25277 7360 1 16 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.088 -0.248 25277 7361 1 16 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.770 -0.040 25277 7362 1 16 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.321 0.189 25277 7363 1 16 . 1 1 125 125 ILE H H 125 8.340 8.340 7.997 0.343 25277 7364 1 16 . 1 1 126 126 SER HA H 126 4.070 4.070 4.354 -0.284 25277 7365 1 16 . 1 1 126 126 SER C C 126 176.290 176.290 174.965 1.325 25277 7366 1 16 . 1 1 126 126 SER CA C 126 59.190 59.190 59.121 0.069 25277 7367 1 16 . 1 1 126 126 SER CB C 126 63.200 63.200 63.689 -0.489 25277 7368 1 16 . 1 1 127 127 LEU N N 127 127.030 127.030 124.276 2.754 25277 7369 1 16 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.360 -0.420 25277 7370 1 16 . 1 1 127 127 LEU C C 127 176.660 176.660 178.141 -1.481 25277 7371 1 16 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.567 0.543 25277 7372 1 16 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.566 1.364 25277 7373 1 16 . 1 1 127 127 LEU H H 127 8.790 8.790 8.347 0.443 25277 7374 1 16 . 1 1 128 128 GLY N N 128 106.600 106.600 108.989 -2.389 25277 7375 1 16 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.639 0.891 25277 7376 1 16 . 1 1 128 128 GLY H H 128 8.450 8.450 8.291 0.159 25277 7377 1 16 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.043 0.187 25277 7378 1 16 . 1 1 129 129 ALA C C 129 180.410 180.410 179.230 1.180 25277 7379 1 16 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.602 0.318 25277 7380 1 16 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.299 0.831 25277 7381 1 16 . 1 1 130 130 LEU N N 130 122.550 122.550 120.539 2.011 25277 7382 1 16 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.031 -0.111 25277 7383 1 16 . 1 1 130 130 LEU C C 130 179.020 179.020 178.477 0.543 25277 7384 1 16 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.418 0.212 25277 7385 1 16 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.620 0.520 25277 7386 1 16 . 1 1 130 130 LEU H H 130 8.040 8.040 7.436 0.604 25277 7387 1 16 . 1 1 131 131 LEU N N 131 121.910 121.910 119.448 2.462 25277 7388 1 16 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.867 0.053 25277 7389 1 16 . 1 1 131 131 LEU C C 131 177.910 177.910 178.447 -0.537 25277 7390 1 16 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.124 0.446 25277 7391 1 16 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.528 -0.808 25277 7392 1 16 . 1 1 131 131 LEU H H 131 9.060 9.060 7.891 1.169 25277 7393 1 16 . 1 1 132 132 SER N N 132 115.530 115.530 114.942 0.588 25277 7394 1 16 . 1 1 132 132 SER HA H 132 3.970 3.970 4.075 -0.105 25277 7395 1 16 . 1 1 132 132 SER C C 132 177.140 177.140 176.651 0.489 25277 7396 1 16 . 1 1 132 132 SER CA C 132 62.340 62.340 62.117 0.223 25277 7397 1 16 . 1 1 132 132 SER CB C 132 62.370 62.370 62.840 -0.470 25277 7398 1 16 . 1 1 132 132 SER H H 132 8.730 8.730 8.118 0.612 25277 7399 1 16 . 1 1 133 133 THR N N 133 116.960 116.960 118.689 -1.729 25277 7400 1 16 . 1 1 133 133 THR HA H 133 3.860 3.860 4.024 -0.164 25277 7401 1 16 . 1 1 133 133 THR C C 133 175.670 175.670 176.573 -0.903 25277 7402 1 16 . 1 1 133 133 THR CA C 133 66.930 66.930 67.003 -0.073 25277 7403 1 16 . 1 1 133 133 THR CB C 133 68.880 68.880 68.390 0.490 25277 7404 1 16 . 1 1 133 133 THR H H 133 7.750 7.750 7.776 -0.026 25277 7405 1 16 . 1 1 134 134 THR N N 134 118.830 118.830 119.502 -0.672 25277 7406 1 16 . 1 1 134 134 THR HA H 134 3.780 3.780 3.998 -0.218 25277 7407 1 16 . 1 1 134 134 THR C C 134 176.750 176.750 176.471 0.279 25277 7408 1 16 . 1 1 134 134 THR CA C 134 67.650 67.650 67.357 0.293 25277 7409 1 16 . 1 1 134 134 THR CB C 134 67.560 67.560 68.721 -1.161 25277 7410 1 16 . 1 1 134 134 THR H H 134 7.570 7.570 7.751 -0.181 25277 7411 1 16 . 1 1 135 135 LEU N N 135 121.420 121.420 121.622 -0.202 25277 7412 1 16 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.964 0.526 25277 7413 1 16 . 1 1 135 135 LEU C C 135 180.050 180.050 178.546 1.504 25277 7414 1 16 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.064 -1.054 25277 7415 1 16 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.566 -0.956 25277 7416 1 16 . 1 1 135 135 LEU H H 135 8.650 8.650 8.075 0.575 25277 7417 1 16 . 1 1 136 136 ASN N N 136 117.010 117.010 117.001 0.009 25277 7418 1 16 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.424 0.116 25277 7419 1 16 . 1 1 136 136 ASN C C 136 175.980 175.980 177.824 -1.844 25277 7420 1 16 . 1 1 136 136 ASN CA C 136 54.770 54.770 55.722 -0.952 25277 7421 1 16 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.293 0.147 25277 7422 1 16 . 1 1 136 136 ASN H H 136 7.360 7.360 7.811 -0.451 25277 7423 1 16 . 1 1 137 137 LEU N N 137 116.940 116.940 120.716 -3.776 25277 7424 1 16 . 1 1 137 137 LEU HA H 137 4.160 4.160 3.984 0.176 25277 7425 1 16 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.797 -2.367 25277 7426 1 16 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.545 0.025 25277 7427 1 16 . 1 1 137 137 LEU H H 137 7.810 7.810 7.613 0.197 25277 7428 1 16 . 1 1 138 138 CYS N N 138 115.430 115.430 114.452 0.978 25277 7429 1 16 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.206 0.204 25277 7430 1 16 . 1 1 138 138 CYS CA C 138 55.480 55.480 60.917 -5.437 25277 7431 1 16 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.312 14.888 25277 7432 1 16 . 1 1 138 138 CYS H H 138 7.450 7.450 7.856 -0.406 25277 7433 1 16 . 1 1 139 139 GLY C C 139 178.800 178.800 174.312 4.488 25277 7434 1 16 . 1 1 139 139 GLY CA C 139 45.500 45.500 45.225 0.275 25277 7435 1 16 . 1 1 140 140 LYS N N 140 119.830 119.830 121.640 -1.810 25277 7436 1 16 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.178 0.142 25277 7437 1 16 . 1 1 140 140 LYS C C 140 175.820 175.820 177.251 -1.431 25277 7438 1 16 . 1 1 140 140 LYS CA C 140 55.680 55.680 57.019 -1.339 25277 7439 1 16 . 1 1 140 140 LYS CB C 140 32.800 32.800 32.563 0.237 25277 7440 1 16 . 1 1 140 140 LYS H H 140 7.760 7.760 7.551 0.209 25277 7441 1 17 . 1 1 27 27 PRO CA C 27 63.230 63.230 63.214 0.016 25277 7442 1 17 . 1 1 27 27 PRO CB C 27 32.050 32.050 32.105 -0.055 25277 7443 1 17 . 1 1 28 28 ASP N N 28 120.030 120.030 120.378 -0.348 25277 7444 1 17 . 1 1 28 28 ASP C C 28 176.130 176.130 176.142 -0.012 25277 7445 1 17 . 1 1 28 28 ASP CA C 28 54.170 54.170 53.445 0.725 25277 7446 1 17 . 1 1 28 28 ASP CB C 28 40.860 40.860 40.914 -0.055 25277 7447 1 17 . 1 1 28 28 ASP H H 28 8.260 8.260 8.291 -0.031 25277 7448 1 17 . 1 1 29 29 LEU N N 29 123.030 123.030 119.588 3.442 25277 7449 1 17 . 1 1 29 29 LEU C C 29 177.870 177.870 177.446 0.424 25277 7450 1 17 . 1 1 29 29 LEU CA C 29 55.160 55.160 54.348 0.812 25277 7451 1 17 . 1 1 29 29 LEU CB C 29 42.270 42.270 42.876 -0.606 25277 7452 1 17 . 1 1 29 29 LEU H H 29 8.120 8.120 8.131 -0.011 25277 7453 1 17 . 1 1 30 30 GLY N N 30 109.350 109.350 112.848 -3.498 25277 7454 1 17 . 1 1 30 30 GLY CA C 30 45.340 45.340 45.376 -0.035 25277 7455 1 17 . 1 1 30 30 GLY H H 30 8.410 8.410 8.512 -0.102 25277 7456 1 17 . 1 1 44 44 PRO CA C 44 63.590 63.590 63.737 -0.147 25277 7457 1 17 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.026 -0.037 25277 7458 1 17 . 1 1 45 45 ALA N N 45 122.140 122.140 125.505 -3.365 25277 7459 1 17 . 1 1 45 45 ALA CA C 45 52.670 52.670 51.212 1.458 25277 7460 1 17 . 1 1 45 45 ALA H H 45 8.350 8.350 7.912 0.438 25277 7461 1 17 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.281 0.019 25277 7462 1 17 . 1 1 49 49 PRO CA C 49 62.950 62.950 63.306 -0.356 25277 7463 1 17 . 1 1 49 49 PRO CB C 49 31.990 31.990 32.115 -0.125 25277 7464 1 17 . 1 1 50 50 VAL N N 50 124.190 124.190 125.216 -1.026 25277 7465 1 17 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.244 0.076 25277 7466 1 17 . 1 1 50 50 VAL CA C 50 59.850 59.850 59.857 -0.007 25277 7467 1 17 . 1 1 50 50 VAL CB C 50 32.480 32.480 32.423 0.057 25277 7468 1 17 . 1 1 50 50 VAL H H 50 8.070 8.070 8.057 0.013 25277 7469 1 17 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.299 0.051 25277 7470 1 17 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.153 -0.223 25277 7471 1 17 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.191 -0.211 25277 7472 1 17 . 1 1 52 52 LEU N N 52 124.500 124.500 121.295 3.205 25277 7473 1 17 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.293 0.197 25277 7474 1 17 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.768 -0.878 25277 7475 1 17 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.969 0.221 25277 7476 1 17 . 1 1 52 52 LEU H H 52 8.360 8.360 8.247 0.113 25277 7477 1 17 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.640 -0.230 25277 7478 1 17 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.243 0.087 25277 7479 1 17 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.377 -0.386 25277 7480 1 17 . 1 1 54 54 SER N N 54 117.380 117.380 116.854 0.526 25277 7481 1 17 . 1 1 54 54 SER HA H 54 4.600 4.600 4.478 0.122 25277 7482 1 17 . 1 1 54 54 SER CA C 54 56.710 56.710 57.113 -0.403 25277 7483 1 17 . 1 1 54 54 SER CB C 54 62.500 62.500 63.017 -0.517 25277 7484 1 17 . 1 1 54 54 SER H H 54 8.400 8.400 8.321 0.079 25277 7485 1 17 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.619 -0.069 25277 7486 1 17 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.485 0.055 25277 7487 1 17 . 1 1 55 55 PRO CB C 55 32.620 32.620 32.236 0.384 25277 7488 1 17 . 1 1 57 57 SER HA H 57 4.420 4.420 4.241 0.179 25277 7489 1 17 . 1 1 57 57 SER CA C 57 57.580 57.580 60.451 -2.871 25277 7490 1 17 . 1 1 57 57 SER CB C 57 63.780 63.780 63.119 0.661 25277 7491 1 17 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.229 0.761 25277 7492 1 17 . 1 1 58 58 ASN C C 58 172.230 172.230 173.753 -1.523 25277 7493 1 17 . 1 1 58 58 ASN CA C 58 53.670 53.670 54.819 -1.149 25277 7494 1 17 . 1 1 58 58 ASN CB C 58 37.850 37.850 37.169 0.681 25277 7495 1 17 . 1 1 59 59 LYS N N 59 117.660 117.660 119.161 -1.501 25277 7496 1 17 . 1 1 59 59 LYS HA H 59 5.360 5.360 5.040 0.320 25277 7497 1 17 . 1 1 59 59 LYS C C 59 175.120 175.120 173.926 1.194 25277 7498 1 17 . 1 1 59 59 LYS CA C 59 54.860 54.860 55.866 -1.006 25277 7499 1 17 . 1 1 59 59 LYS CB C 59 36.450 36.450 36.173 0.277 25277 7500 1 17 . 1 1 59 59 LYS H H 59 7.640 7.640 7.687 -0.047 25277 7501 1 17 . 1 1 60 60 GLN N N 60 120.680 120.680 121.915 -1.235 25277 7502 1 17 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.640 -0.150 25277 7503 1 17 . 1 1 60 60 GLN C C 60 173.640 173.640 173.280 0.360 25277 7504 1 17 . 1 1 60 60 GLN CA C 60 55.480 55.480 54.821 0.659 25277 7505 1 17 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.106 -0.116 25277 7506 1 17 . 1 1 60 60 GLN H H 60 8.930 8.930 8.267 0.663 25277 7507 1 17 . 1 1 61 61 ASP N N 61 126.170 126.170 121.871 4.299 25277 7508 1 17 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.837 0.213 25277 7509 1 17 . 1 1 61 61 ASP C C 61 175.000 175.000 175.180 -0.180 25277 7510 1 17 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.167 0.713 25277 7511 1 17 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.531 -0.761 25277 7512 1 17 . 1 1 61 61 ASP H H 61 8.540 8.540 8.560 -0.020 25277 7513 1 17 . 1 1 62 62 ILE N N 62 121.100 121.100 125.399 -4.299 25277 7514 1 17 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.556 0.224 25277 7515 1 17 . 1 1 62 62 ILE C C 62 171.480 171.480 173.672 -2.192 25277 7516 1 17 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.228 0.862 25277 7517 1 17 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.112 1.028 25277 7518 1 17 . 1 1 62 62 ILE H H 62 8.970 8.970 8.517 0.453 25277 7519 1 17 . 1 1 63 63 SER N N 63 119.430 119.430 121.527 -2.097 25277 7520 1 17 . 1 1 63 63 SER HA H 63 4.680 4.680 4.481 0.199 25277 7521 1 17 . 1 1 63 63 SER C C 63 174.030 174.030 174.561 -0.531 25277 7522 1 17 . 1 1 63 63 SER CA C 63 56.550 56.550 56.701 -0.151 25277 7523 1 17 . 1 1 63 63 SER CB C 63 67.320 67.320 66.302 1.018 25277 7524 1 17 . 1 1 63 63 SER H H 63 8.520 8.520 7.931 0.589 25277 7525 1 17 . 1 1 64 64 GLU N N 64 121.250 121.250 120.309 0.941 25277 7526 1 17 . 1 1 64 64 GLU HA H 64 2.770 2.770 2.954 -0.184 25277 7527 1 17 . 1 1 64 64 GLU C C 64 177.190 177.190 177.909 -0.719 25277 7528 1 17 . 1 1 64 64 GLU CA C 64 58.590 58.590 59.017 -0.427 25277 7529 1 17 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.603 -0.463 25277 7530 1 17 . 1 1 64 64 GLU H H 64 7.400 7.400 7.664 -0.264 25277 7531 1 17 . 1 1 65 65 ALA N N 65 119.250 119.250 121.745 -2.495 25277 7532 1 17 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.817 0.043 25277 7533 1 17 . 1 1 65 65 ALA C C 65 179.630 179.630 179.496 0.134 25277 7534 1 17 . 1 1 65 65 ALA CA C 65 53.810 53.810 54.940 -1.130 25277 7535 1 17 . 1 1 65 65 ALA CB C 65 18.400 18.400 18.235 0.165 25277 7536 1 17 . 1 1 65 65 ALA H H 65 7.700 7.700 8.248 -0.548 25277 7537 1 17 . 1 1 66 66 ASN N N 66 112.360 112.360 116.087 -3.727 25277 7538 1 17 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.429 0.601 25277 7539 1 17 . 1 1 66 66 ASN C C 66 174.580 174.580 177.040 -2.460 25277 7540 1 17 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.634 -0.084 25277 7541 1 17 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.523 1.407 25277 7542 1 17 . 1 1 66 66 ASN H H 66 7.960 7.960 7.455 0.505 25277 7543 1 17 . 1 1 67 67 LEU N N 67 115.390 115.390 118.473 -3.083 25277 7544 1 17 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.252 0.398 25277 7545 1 17 . 1 1 67 67 LEU C C 67 176.500 176.500 176.739 -0.239 25277 7546 1 17 . 1 1 67 67 LEU CA C 67 54.350 54.350 56.117 -1.767 25277 7547 1 17 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.307 2.363 25277 7548 1 17 . 1 1 67 67 LEU H H 67 7.050 7.050 7.487 -0.437 25277 7549 1 17 . 1 1 68 68 ALA N N 68 125.680 125.680 120.320 5.360 25277 7550 1 17 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.787 0.103 25277 7551 1 17 . 1 1 68 68 ALA C C 68 177.480 177.480 178.249 -0.769 25277 7552 1 17 . 1 1 68 68 ALA CA C 68 53.550 53.550 53.327 0.223 25277 7553 1 17 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.245 -0.096 25277 7554 1 17 . 1 1 68 68 ALA H H 68 8.880 8.880 8.008 0.872 25277 7555 1 17 . 1 1 69 69 TYR N N 69 119.780 119.780 120.086 -0.306 25277 7556 1 17 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.338 0.152 25277 7557 1 17 . 1 1 69 69 TYR C C 69 175.340 175.340 177.310 -1.970 25277 7558 1 17 . 1 1 69 69 TYR CA C 69 58.640 58.640 60.688 -2.048 25277 7559 1 17 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.045 -0.765 25277 7560 1 17 . 1 1 69 69 TYR H H 69 7.420 7.420 8.528 -1.108 25277 7561 1 17 . 1 1 70 70 LEU N N 70 118.820 118.820 117.015 1.805 25277 7562 1 17 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.166 0.124 25277 7563 1 17 . 1 1 70 70 LEU C C 70 176.770 176.770 177.475 -0.705 25277 7564 1 17 . 1 1 70 70 LEU CA C 70 53.880 53.880 55.599 -1.719 25277 7565 1 17 . 1 1 70 70 LEU CB C 70 41.300 41.300 41.773 -0.473 25277 7566 1 17 . 1 1 70 70 LEU H H 70 7.690 7.690 7.473 0.217 25277 7567 1 17 . 1 1 71 71 TRP N N 71 124.110 124.110 122.709 1.401 25277 7568 1 17 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.550 0.040 25277 7569 1 17 . 1 1 71 71 TRP CA C 71 54.150 54.150 56.008 -1.858 25277 7570 1 17 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.462 -0.253 25277 7571 1 17 . 1 1 71 71 TRP H H 71 8.130 8.130 7.706 0.424 25277 7572 1 17 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.393 0.187 25277 7573 1 17 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.187 0.403 25277 7574 1 17 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.763 -1.703 25277 7575 1 17 . 1 1 73 73 LEU N N 73 118.760 118.760 117.798 0.962 25277 7576 1 17 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.600 0.800 25277 7577 1 17 . 1 1 73 73 LEU C C 73 176.620 176.620 178.312 -1.692 25277 7578 1 17 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.676 -0.626 25277 7579 1 17 . 1 1 73 73 LEU CB C 73 44.260 44.260 43.107 1.153 25277 7580 1 17 . 1 1 73 73 LEU H H 73 5.190 5.190 6.622 -1.432 25277 7581 1 17 . 1 1 74 74 THR N N 74 110.120 110.120 115.622 -5.502 25277 7582 1 17 . 1 1 74 74 THR HA H 74 4.250 4.250 4.230 0.020 25277 7583 1 17 . 1 1 74 74 THR C C 74 176.080 176.080 175.493 0.587 25277 7584 1 17 . 1 1 74 74 THR CA C 74 62.690 62.690 64.148 -1.458 25277 7585 1 17 . 1 1 74 74 THR CB C 74 67.930 67.930 69.223 -1.293 25277 7586 1 17 . 1 1 74 74 THR H H 74 9.010 9.010 8.655 0.355 25277 7587 1 17 . 1 1 75 75 VAL N N 75 113.030 113.030 118.410 -5.380 25277 7588 1 17 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.238 0.572 25277 7589 1 17 . 1 1 75 75 VAL C C 75 176.010 176.010 177.086 -1.076 25277 7590 1 17 . 1 1 75 75 VAL CA C 75 59.100 59.100 62.078 -2.978 25277 7591 1 17 . 1 1 75 75 VAL CB C 75 33.220 33.220 32.518 0.702 25277 7592 1 17 . 1 1 75 75 VAL H H 75 6.660 6.660 7.643 -0.983 25277 7593 1 17 . 1 1 76 76 ASP N N 76 119.590 119.590 123.528 -3.938 25277 7594 1 17 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.707 -0.217 25277 7595 1 17 . 1 1 76 76 ASP C C 76 175.060 175.060 176.280 -1.220 25277 7596 1 17 . 1 1 76 76 ASP CA C 76 55.110 55.110 57.062 -1.952 25277 7597 1 17 . 1 1 76 76 ASP CB C 76 41.300 41.300 41.042 0.258 25277 7598 1 17 . 1 1 76 76 ASP H H 76 8.770 8.770 9.090 -0.320 25277 7599 1 17 . 1 1 77 77 HIS N N 77 113.300 113.300 112.022 1.278 25277 7600 1 17 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.710 0.380 25277 7601 1 17 . 1 1 77 77 HIS C C 77 171.370 171.370 173.836 -2.466 25277 7602 1 17 . 1 1 77 77 HIS CA C 77 55.590 55.590 54.555 1.035 25277 7603 1 17 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.574 -2.384 25277 7604 1 17 . 1 1 77 77 HIS H H 77 7.650 7.650 7.680 -0.030 25277 7605 1 17 . 1 1 78 78 GLY N N 78 101.350 101.350 105.298 -3.948 25277 7606 1 17 . 1 1 78 78 GLY C C 78 172.110 172.110 172.396 -0.286 25277 7607 1 17 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.797 0.014 25277 7608 1 17 . 1 1 78 78 GLY H H 78 8.450 8.450 8.672 -0.222 25277 7609 1 17 . 1 1 79 79 THR N N 79 120.230 120.230 116.959 3.271 25277 7610 1 17 . 1 1 79 79 THR HA H 79 5.110 5.110 4.901 0.209 25277 7611 1 17 . 1 1 79 79 THR C C 79 172.920 172.920 173.755 -0.835 25277 7612 1 17 . 1 1 79 79 THR CA C 79 61.480 61.480 62.040 -0.560 25277 7613 1 17 . 1 1 79 79 THR CB C 79 72.130 72.130 70.823 1.307 25277 7614 1 17 . 1 1 79 79 THR H H 79 8.080 8.080 8.482 -0.402 25277 7615 1 17 . 1 1 80 80 ILE N N 80 119.620 119.620 120.811 -1.191 25277 7616 1 17 . 1 1 80 80 ILE HA H 80 5.140 5.140 4.942 0.198 25277 7617 1 17 . 1 1 80 80 ILE C C 80 174.340 174.340 174.154 0.186 25277 7618 1 17 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.414 -0.065 25277 7619 1 17 . 1 1 80 80 ILE CB C 80 39.550 39.550 40.002 -0.452 25277 7620 1 17 . 1 1 80 80 ILE H H 80 8.970 8.970 8.682 0.288 25277 7621 1 17 . 1 1 81 81 GLU N N 81 119.960 119.960 124.191 -4.231 25277 7622 1 17 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.149 -0.149 25277 7623 1 17 . 1 1 81 81 GLU C C 81 176.130 176.130 174.901 1.229 25277 7624 1 17 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.663 -0.103 25277 7625 1 17 . 1 1 81 81 GLU CB C 81 33.390 33.390 34.679 -1.289 25277 7626 1 17 . 1 1 81 81 GLU H H 81 8.350 8.350 8.320 0.030 25277 7627 1 17 . 1 1 82 82 CYS N N 82 123.110 123.110 122.416 0.694 25277 7628 1 17 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.076 -0.146 25277 7629 1 17 . 1 1 82 82 CYS C C 82 174.430 174.430 174.892 -0.462 25277 7630 1 17 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.115 -4.875 25277 7631 1 17 . 1 1 82 82 CYS CB C 82 43.720 43.720 27.017 16.703 25277 7632 1 17 . 1 1 82 82 CYS H H 82 8.220 8.220 8.459 -0.239 25277 7633 1 17 . 1 1 83 83 LEU N N 83 131.660 131.660 127.515 4.145 25277 7634 1 17 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.736 -0.206 25277 7635 1 17 . 1 1 83 83 LEU CA C 83 53.900 53.900 52.935 0.965 25277 7636 1 17 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.356 -2.156 25277 7637 1 17 . 1 1 83 83 LEU H H 83 8.910 8.910 8.382 0.528 25277 7638 1 17 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.238 0.132 25277 7639 1 17 . 1 1 84 84 PRO CA C 84 63.190 63.190 64.907 -1.717 25277 7640 1 17 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.660 0.270 25277 7641 1 17 . 1 1 85 85 SER N N 85 117.620 117.620 113.708 3.912 25277 7642 1 17 . 1 1 85 85 SER HA H 85 3.870 3.870 4.429 -0.559 25277 7643 1 17 . 1 1 85 85 SER C C 85 174.350 174.350 173.842 0.508 25277 7644 1 17 . 1 1 85 85 SER CA C 85 58.970 58.970 58.786 0.184 25277 7645 1 17 . 1 1 85 85 SER CB C 85 63.820 63.820 63.116 0.704 25277 7646 1 17 . 1 1 85 85 SER H H 85 7.660 7.660 8.076 -0.416 25277 7647 1 17 . 1 1 86 86 ASP N N 86 117.590 117.590 117.658 -0.068 25277 7648 1 17 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.347 -0.207 25277 7649 1 17 . 1 1 86 86 ASP C C 86 174.480 174.480 174.186 0.294 25277 7650 1 17 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.577 -0.597 25277 7651 1 17 . 1 1 86 86 ASP CB C 86 37.850 37.850 38.771 -0.921 25277 7652 1 17 . 1 1 86 86 ASP H H 86 8.490 8.490 8.235 0.255 25277 7653 1 17 . 1 1 87 87 ASN N N 87 117.160 117.160 117.203 -0.043 25277 7654 1 17 . 1 1 87 87 ASN HA H 87 4.530 4.530 5.056 -0.526 25277 7655 1 17 . 1 1 87 87 ASN CA C 87 52.480 52.480 51.829 0.651 25277 7656 1 17 . 1 1 87 87 ASN CB C 87 40.040 40.040 41.125 -1.085 25277 7657 1 17 . 1 1 87 87 ASN H H 87 7.260 7.260 7.741 -0.481 25277 7658 1 17 . 1 1 88 88 ALA HA H 88 4.730 4.730 4.918 -0.188 25277 7659 1 17 . 1 1 88 88 ALA C C 88 174.620 174.620 176.241 -1.621 25277 7660 1 17 . 1 1 88 88 ALA CA C 88 51.230 51.230 50.924 0.306 25277 7661 1 17 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.323 0.217 25277 7662 1 17 . 1 1 89 89 VAL N N 89 116.580 116.580 118.770 -2.190 25277 7663 1 17 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.041 0.059 25277 7664 1 17 . 1 1 89 89 VAL C C 89 172.750 172.750 173.565 -0.815 25277 7665 1 17 . 1 1 89 89 VAL CA C 89 58.980 58.980 59.460 -0.480 25277 7666 1 17 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.359 0.861 25277 7667 1 17 . 1 1 89 89 VAL H H 89 8.740 8.740 8.318 0.422 25277 7668 1 17 . 1 1 90 90 PHE N N 90 120.300 120.300 123.703 -3.403 25277 7669 1 17 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.104 0.046 25277 7670 1 17 . 1 1 90 90 PHE C C 90 172.910 172.910 173.684 -0.774 25277 7671 1 17 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.430 0.370 25277 7672 1 17 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.378 1.272 25277 7673 1 17 . 1 1 90 90 PHE H H 90 8.950 8.950 9.105 -0.155 25277 7674 1 17 . 1 1 91 91 VAL N N 91 129.020 129.020 128.674 0.346 25277 7675 1 17 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.630 -0.170 25277 7676 1 17 . 1 1 91 91 VAL C C 91 175.910 175.910 174.071 1.839 25277 7677 1 17 . 1 1 91 91 VAL CA C 91 60.780 60.780 60.677 0.103 25277 7678 1 17 . 1 1 91 91 VAL CB C 91 32.020 32.020 33.848 -1.828 25277 7679 1 17 . 1 1 91 91 VAL H H 91 9.090 9.090 8.690 0.400 25277 7680 1 17 . 1 1 92 92 ALA N N 92 129.760 129.760 129.322 0.438 25277 7681 1 17 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.758 -0.258 25277 7682 1 17 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.610 2.240 25277 7683 1 17 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.412 -1.362 25277 7684 1 17 . 1 1 92 92 ALA H H 92 8.680 8.680 8.482 0.198 25277 7685 1 17 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.062 0.098 25277 7686 1 17 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.210 0.190 25277 7687 1 17 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.283 0.657 25277 7688 1 17 . 1 1 94 94 ASP N N 94 113.220 113.220 116.039 -2.819 25277 7689 1 17 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.462 -0.042 25277 7690 1 17 . 1 1 94 94 ASP C C 94 176.980 176.980 177.612 -0.632 25277 7691 1 17 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.910 -0.380 25277 7692 1 17 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.767 -0.187 25277 7693 1 17 . 1 1 94 94 ASP H H 94 7.890 7.890 7.981 -0.091 25277 7694 1 17 . 1 1 95 95 GLY N N 95 109.120 109.120 109.226 -0.106 25277 7695 1 17 . 1 1 95 95 GLY C C 95 174.440 174.440 174.403 0.037 25277 7696 1 17 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.102 -0.541 25277 7697 1 17 . 1 1 95 95 GLY H H 95 8.500 8.500 8.249 0.251 25277 7698 1 17 . 1 1 96 96 THR N N 96 120.350 120.350 118.117 2.233 25277 7699 1 17 . 1 1 96 96 THR HA H 96 3.780 3.780 4.413 -0.633 25277 7700 1 17 . 1 1 96 96 THR C C 96 172.590 172.590 173.436 -0.846 25277 7701 1 17 . 1 1 96 96 THR CA C 96 64.660 64.660 61.609 3.051 25277 7702 1 17 . 1 1 96 96 THR CB C 96 68.330 68.330 70.160 -1.830 25277 7703 1 17 . 1 1 96 96 THR H H 96 8.100 8.100 8.467 -0.367 25277 7704 1 17 . 1 1 97 97 THR N N 97 122.660 122.660 120.736 1.924 25277 7705 1 17 . 1 1 97 97 THR HA H 97 4.590 4.590 4.785 -0.195 25277 7706 1 17 . 1 1 97 97 THR C C 97 173.000 173.000 173.511 -0.511 25277 7707 1 17 . 1 1 97 97 THR CA C 97 62.700 62.700 61.773 0.928 25277 7708 1 17 . 1 1 97 97 THR CB C 97 68.840 68.840 69.712 -0.872 25277 7709 1 17 . 1 1 97 97 THR H H 97 7.850 7.850 8.396 -0.546 25277 7710 1 17 . 1 1 98 98 TYR N N 98 122.890 122.890 124.823 -1.933 25277 7711 1 17 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.159 -0.219 25277 7712 1 17 . 1 1 98 98 TYR C C 98 178.970 178.970 174.783 4.187 25277 7713 1 17 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.145 0.365 25277 7714 1 17 . 1 1 98 98 TYR CB C 98 42.950 42.950 41.991 0.959 25277 7715 1 17 . 1 1 98 98 TYR H H 98 9.460 9.460 9.235 0.225 25277 7716 1 17 . 1 1 99 99 ALA N N 99 121.760 121.760 123.795 -2.035 25277 7717 1 17 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.658 -0.548 25277 7718 1 17 . 1 1 99 99 ALA C C 99 178.010 178.010 176.365 1.645 25277 7719 1 17 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.232 1.038 25277 7720 1 17 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.686 2.364 25277 7721 1 17 . 1 1 99 99 ALA H H 99 9.110 9.110 8.828 0.282 25277 7722 1 17 . 1 1 100 100 LEU N N 100 119.330 119.330 124.183 -4.853 25277 7723 1 17 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.254 0.216 25277 7724 1 17 . 1 1 100 100 LEU C C 100 174.720 174.720 177.290 -2.570 25277 7725 1 17 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.711 -2.571 25277 7726 1 17 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.654 1.976 25277 7727 1 17 . 1 1 100 100 LEU H H 100 8.950 8.950 8.393 0.557 25277 7728 1 17 . 1 1 101 101 ASN N N 101 112.600 112.600 115.955 -3.355 25277 7729 1 17 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.842 0.078 25277 7730 1 17 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.700 -1.770 25277 7731 1 17 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.886 0.714 25277 7732 1 17 . 1 1 101 101 ASN H H 101 7.550 7.550 7.595 -0.045 25277 7733 1 17 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.373 -0.183 25277 7734 1 17 . 1 1 102 102 ASP C C 102 178.770 178.770 178.392 0.378 25277 7735 1 17 . 1 1 102 102 ASP CA C 102 56.880 56.880 57.371 -0.491 25277 7736 1 17 . 1 1 102 102 ASP CB C 102 39.980 39.980 40.501 -0.521 25277 7737 1 17 . 1 1 103 103 ARG N N 103 119.370 119.370 120.907 -1.537 25277 7738 1 17 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.153 -0.323 25277 7739 1 17 . 1 1 103 103 ARG C C 103 178.550 178.550 178.484 0.066 25277 7740 1 17 . 1 1 103 103 ARG CA C 103 59.380 59.380 58.868 0.512 25277 7741 1 17 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.946 -0.446 25277 7742 1 17 . 1 1 103 103 ARG H H 103 7.970 7.970 7.898 0.072 25277 7743 1 17 . 1 1 104 104 ALA N N 104 120.110 120.110 122.078 -1.968 25277 7744 1 17 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.132 0.078 25277 7745 1 17 . 1 1 104 104 ALA C C 104 179.510 179.510 179.001 0.509 25277 7746 1 17 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.328 -0.578 25277 7747 1 17 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.355 1.315 25277 7748 1 17 . 1 1 104 104 ALA H H 104 7.610 7.610 8.536 -0.926 25277 7749 1 17 . 1 1 105 105 GLU N N 105 120.460 120.460 119.496 0.964 25277 7750 1 17 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.356 0.354 25277 7751 1 17 . 1 1 105 105 GLU C C 105 181.710 181.710 179.432 2.278 25277 7752 1 17 . 1 1 105 105 GLU CA C 105 58.680 58.680 59.053 -0.373 25277 7753 1 17 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.939 -0.449 25277 7754 1 17 . 1 1 105 105 GLU H H 105 7.750 7.750 7.798 -0.048 25277 7755 1 17 . 1 1 106 106 LYS N N 106 121.980 121.980 118.188 3.792 25277 7756 1 17 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.156 -0.136 25277 7757 1 17 . 1 1 106 106 LYS C C 106 177.890 177.890 178.034 -0.144 25277 7758 1 17 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.457 0.013 25277 7759 1 17 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.105 -0.375 25277 7760 1 17 . 1 1 106 106 LYS H H 106 8.380 8.380 8.096 0.284 25277 7761 1 17 . 1 1 107 107 ALA N N 107 119.850 119.850 121.149 -1.299 25277 7762 1 17 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.331 -0.071 25277 7763 1 17 . 1 1 107 107 ALA C C 107 177.210 177.210 177.652 -0.442 25277 7764 1 17 . 1 1 107 107 ALA CA C 107 52.270 52.270 51.892 0.378 25277 7765 1 17 . 1 1 107 107 ALA CB C 107 18.740 18.740 18.530 0.210 25277 7766 1 17 . 1 1 107 107 ALA H H 107 7.400 7.400 7.715 -0.315 25277 7767 1 17 . 1 1 108 108 GLY N N 108 104.560 104.560 106.563 -2.003 25277 7768 1 17 . 1 1 108 108 GLY C C 108 174.300 174.300 174.270 0.030 25277 7769 1 17 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.060 -0.450 25277 7770 1 17 . 1 1 108 108 GLY H H 108 7.560 7.560 7.739 -0.179 25277 7771 1 17 . 1 1 109 109 HIS N N 109 122.550 122.550 120.306 2.244 25277 7772 1 17 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.973 -0.203 25277 7773 1 17 . 1 1 109 109 HIS CA C 109 54.580 54.580 53.693 0.887 25277 7774 1 17 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.394 -0.804 25277 7775 1 17 . 1 1 109 109 HIS H H 109 7.590 7.590 7.757 -0.167 25277 7776 1 17 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.789 -0.229 25277 7777 1 17 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.161 0.569 25277 7778 1 17 . 1 1 111 111 PRO CB C 111 32.800 32.800 33.099 -0.298 25277 7779 1 17 . 1 1 112 112 ILE N N 112 119.770 119.770 119.521 0.249 25277 7780 1 17 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.492 0.368 25277 7781 1 17 . 1 1 112 112 ILE C C 112 172.800 172.800 177.529 -4.729 25277 7782 1 17 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.323 -2.133 25277 7783 1 17 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.276 3.163 25277 7784 1 17 . 1 1 112 112 ILE H H 112 7.890 7.890 8.364 -0.474 25277 7785 1 17 . 1 1 113 113 THR N N 113 113.610 113.610 116.479 -2.869 25277 7786 1 17 . 1 1 113 113 THR HA H 113 3.010 3.010 3.965 -0.955 25277 7787 1 17 . 1 1 113 113 THR CA C 113 66.860 66.860 68.078 -1.218 25277 7788 1 17 . 1 1 113 113 THR CB C 113 66.920 66.920 67.311 -0.391 25277 7789 1 17 . 1 1 113 113 THR H H 113 7.070 7.070 8.582 -1.512 25277 7790 1 17 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.371 -0.031 25277 7791 1 17 . 1 1 114 114 PRO CA C 114 66.080 66.080 64.942 1.138 25277 7792 1 17 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.518 0.562 25277 7793 1 17 . 1 1 115 115 ILE N N 115 134.770 134.770 110.092 24.678 25277 7794 1 17 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.406 0.204 25277 7795 1 17 . 1 1 115 115 ILE C C 115 174.800 174.800 175.036 -0.236 25277 7796 1 17 . 1 1 115 115 ILE CA C 115 60.000 60.000 60.078 -0.078 25277 7797 1 17 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.607 0.253 25277 7798 1 17 . 1 1 115 115 ILE H H 115 7.510 7.510 7.572 -0.062 25277 7799 1 17 . 1 1 116 116 ARG N N 116 120.890 120.890 121.382 -0.492 25277 7800 1 17 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.177 -0.207 25277 7801 1 17 . 1 1 116 116 ARG C C 116 174.910 174.910 175.981 -1.071 25277 7802 1 17 . 1 1 116 116 ARG CA C 116 57.780 57.780 56.062 1.718 25277 7803 1 17 . 1 1 116 116 ARG CB C 116 31.870 31.870 30.925 0.945 25277 7804 1 17 . 1 1 116 116 ARG H H 116 7.280 7.280 7.496 -0.216 25277 7805 1 17 . 1 1 117 117 ALA N N 117 125.400 125.400 125.634 -0.234 25277 7806 1 17 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.369 -0.139 25277 7807 1 17 . 1 1 117 117 ALA C C 117 176.290 176.290 175.847 0.443 25277 7808 1 17 . 1 1 117 117 ALA CA C 117 50.780 50.780 51.128 -0.348 25277 7809 1 17 . 1 1 117 117 ALA CB C 117 20.290 20.290 20.575 -0.284 25277 7810 1 17 . 1 1 117 117 ALA H H 117 8.150 8.150 8.319 -0.169 25277 7811 1 17 . 1 1 118 118 LYS N N 118 119.890 119.890 123.098 -3.208 25277 7812 1 17 . 1 1 118 118 LYS HA H 118 4.590 4.590 3.708 0.882 25277 7813 1 17 . 1 1 118 118 LYS C C 118 177.400 177.400 176.353 1.047 25277 7814 1 17 . 1 1 118 118 LYS CA C 118 55.670 55.670 55.102 0.568 25277 7815 1 17 . 1 1 118 118 LYS CB C 118 34.510 34.510 33.343 1.167 25277 7816 1 17 . 1 1 118 118 LYS H H 118 8.360 8.360 8.316 0.044 25277 7817 1 17 . 1 1 119 119 GLY N N 119 108.630 108.630 111.873 -3.243 25277 7818 1 17 . 1 1 119 119 GLY CA C 119 43.610 43.610 44.092 -0.482 25277 7819 1 17 . 1 1 119 119 GLY H H 119 8.320 8.320 8.073 0.247 25277 7820 1 17 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.768 0.132 25277 7821 1 17 . 1 1 124 124 TYR C C 124 177.430 177.430 176.555 0.875 25277 7822 1 17 . 1 1 124 124 TYR CA C 124 57.970 57.970 57.296 0.674 25277 7823 1 17 . 1 1 124 124 TYR CB C 124 38.650 38.650 40.514 -1.863 25277 7824 1 17 . 1 1 125 125 ILE N N 125 123.670 123.670 122.379 1.291 25277 7825 1 17 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.159 -0.319 25277 7826 1 17 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.706 0.024 25277 7827 1 17 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.353 0.157 25277 7828 1 17 . 1 1 125 125 ILE H H 125 8.340 8.340 8.347 -0.007 25277 7829 1 17 . 1 1 126 126 SER HA H 126 4.070 4.070 4.360 -0.290 25277 7830 1 17 . 1 1 126 126 SER C C 126 176.290 176.290 174.905 1.385 25277 7831 1 17 . 1 1 126 126 SER CA C 126 59.190 59.190 59.314 -0.124 25277 7832 1 17 . 1 1 126 126 SER CB C 126 63.200 63.200 63.642 -0.442 25277 7833 1 17 . 1 1 127 127 LEU N N 127 127.030 127.030 124.053 2.977 25277 7834 1 17 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.343 -0.403 25277 7835 1 17 . 1 1 127 127 LEU C C 127 176.660 176.660 178.232 -1.572 25277 7836 1 17 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.664 0.446 25277 7837 1 17 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.600 1.330 25277 7838 1 17 . 1 1 127 127 LEU H H 127 8.790 8.790 8.417 0.373 25277 7839 1 17 . 1 1 128 128 GLY N N 128 106.600 106.600 108.948 -2.348 25277 7840 1 17 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.625 0.905 25277 7841 1 17 . 1 1 128 128 GLY H H 128 8.450 8.450 8.317 0.133 25277 7842 1 17 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.079 0.151 25277 7843 1 17 . 1 1 129 129 ALA C C 129 180.410 180.410 179.387 1.023 25277 7844 1 17 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.499 0.421 25277 7845 1 17 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.320 0.810 25277 7846 1 17 . 1 1 130 130 LEU N N 130 122.550 122.550 120.606 1.944 25277 7847 1 17 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.050 -0.130 25277 7848 1 17 . 1 1 130 130 LEU C C 130 179.020 179.020 178.513 0.507 25277 7849 1 17 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.354 0.276 25277 7850 1 17 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.624 0.516 25277 7851 1 17 . 1 1 130 130 LEU H H 130 8.040 8.040 7.438 0.602 25277 7852 1 17 . 1 1 131 131 LEU N N 131 121.910 121.910 119.502 2.408 25277 7853 1 17 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.916 0.004 25277 7854 1 17 . 1 1 131 131 LEU C C 131 177.910 177.910 178.107 -0.197 25277 7855 1 17 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.228 0.342 25277 7856 1 17 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.525 -0.805 25277 7857 1 17 . 1 1 131 131 LEU H H 131 9.060 9.060 7.906 1.154 25277 7858 1 17 . 1 1 132 132 SER N N 132 115.530 115.530 113.922 1.608 25277 7859 1 17 . 1 1 132 132 SER HA H 132 3.970 3.970 4.092 -0.122 25277 7860 1 17 . 1 1 132 132 SER C C 132 177.140 177.140 176.917 0.223 25277 7861 1 17 . 1 1 132 132 SER CA C 132 62.340 62.340 62.072 0.268 25277 7862 1 17 . 1 1 132 132 SER CB C 132 62.370 62.370 62.681 -0.311 25277 7863 1 17 . 1 1 132 132 SER H H 132 8.730 8.730 8.251 0.479 25277 7864 1 17 . 1 1 133 133 THR N N 133 116.960 116.960 119.518 -2.558 25277 7865 1 17 . 1 1 133 133 THR HA H 133 3.860 3.860 4.080 -0.220 25277 7866 1 17 . 1 1 133 133 THR C C 133 175.670 175.670 176.677 -1.007 25277 7867 1 17 . 1 1 133 133 THR CA C 133 66.930 66.930 67.069 -0.139 25277 7868 1 17 . 1 1 133 133 THR CB C 133 68.880 68.880 68.564 0.316 25277 7869 1 17 . 1 1 133 133 THR H H 133 7.750 7.750 7.854 -0.104 25277 7870 1 17 . 1 1 134 134 THR N N 134 118.830 118.830 119.483 -0.653 25277 7871 1 17 . 1 1 134 134 THR HA H 134 3.780 3.780 4.067 -0.287 25277 7872 1 17 . 1 1 134 134 THR C C 134 176.750 176.750 176.276 0.474 25277 7873 1 17 . 1 1 134 134 THR CA C 134 67.650 67.650 67.553 0.097 25277 7874 1 17 . 1 1 134 134 THR CB C 134 67.560 67.560 68.492 -0.932 25277 7875 1 17 . 1 1 134 134 THR H H 134 7.570 7.570 7.663 -0.093 25277 7876 1 17 . 1 1 135 135 LEU N N 135 121.420 121.420 121.695 -0.275 25277 7877 1 17 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.936 0.554 25277 7878 1 17 . 1 1 135 135 LEU C C 135 180.050 180.050 178.936 1.114 25277 7879 1 17 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.225 -1.215 25277 7880 1 17 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.412 -0.802 25277 7881 1 17 . 1 1 135 135 LEU H H 135 8.650 8.650 8.257 0.393 25277 7882 1 17 . 1 1 136 136 ASN N N 136 117.010 117.010 117.394 -0.384 25277 7883 1 17 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.447 0.093 25277 7884 1 17 . 1 1 136 136 ASN C C 136 175.980 175.980 177.589 -1.609 25277 7885 1 17 . 1 1 136 136 ASN CA C 136 54.770 54.770 56.056 -1.286 25277 7886 1 17 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.693 -0.253 25277 7887 1 17 . 1 1 136 136 ASN H H 136 7.360 7.360 7.803 -0.443 25277 7888 1 17 . 1 1 137 137 LEU N N 137 116.940 116.940 119.489 -2.549 25277 7889 1 17 . 1 1 137 137 LEU HA H 137 4.160 4.160 3.972 0.188 25277 7890 1 17 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.703 -2.273 25277 7891 1 17 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.692 -0.122 25277 7892 1 17 . 1 1 137 137 LEU H H 137 7.810 7.810 7.555 0.255 25277 7893 1 17 . 1 1 138 138 CYS N N 138 115.430 115.430 115.870 -0.440 25277 7894 1 17 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.254 0.156 25277 7895 1 17 . 1 1 138 138 CYS CA C 138 55.480 55.480 61.433 -5.953 25277 7896 1 17 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.747 14.453 25277 7897 1 17 . 1 1 138 138 CYS H H 138 7.450 7.450 8.006 -0.556 25277 7898 1 17 . 1 1 139 139 GLY C C 139 178.800 178.800 174.169 4.631 25277 7899 1 17 . 1 1 139 139 GLY CA C 139 45.500 45.500 44.803 0.697 25277 7900 1 17 . 1 1 140 140 LYS N N 140 119.830 119.830 121.818 -1.988 25277 7901 1 17 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.625 -0.305 25277 7902 1 17 . 1 1 140 140 LYS C C 140 175.820 175.820 176.735 -0.915 25277 7903 1 17 . 1 1 140 140 LYS CA C 140 55.680 55.680 55.285 0.396 25277 7904 1 17 . 1 1 140 140 LYS CB C 140 32.800 32.800 33.235 -0.435 25277 7905 1 17 . 1 1 140 140 LYS H H 140 7.760 7.760 7.644 0.116 25277 7906 1 18 . 1 1 27 27 PRO CA C 27 63.230 63.230 62.382 0.848 25277 7907 1 18 . 1 1 27 27 PRO CB C 27 32.050 32.050 32.578 -0.528 25277 7908 1 18 . 1 1 28 28 ASP N N 28 120.030 120.030 119.700 0.330 25277 7909 1 18 . 1 1 28 28 ASP C C 28 176.130 176.130 176.604 -0.474 25277 7910 1 18 . 1 1 28 28 ASP CA C 28 54.170 54.170 54.391 -0.221 25277 7911 1 18 . 1 1 28 28 ASP CB C 28 40.860 40.860 41.167 -0.307 25277 7912 1 18 . 1 1 28 28 ASP H H 28 8.260 8.260 8.384 -0.124 25277 7913 1 18 . 1 1 29 29 LEU N N 29 123.030 123.030 125.994 -2.964 25277 7914 1 18 . 1 1 29 29 LEU C C 29 177.870 177.870 178.249 -0.379 25277 7915 1 18 . 1 1 29 29 LEU CA C 29 55.160 55.160 54.866 0.294 25277 7916 1 18 . 1 1 29 29 LEU CB C 29 42.270 42.270 42.691 -0.421 25277 7917 1 18 . 1 1 29 29 LEU H H 29 8.120 8.120 8.284 -0.164 25277 7918 1 18 . 1 1 30 30 GLY N N 30 109.350 109.350 109.169 0.181 25277 7919 1 18 . 1 1 30 30 GLY CA C 30 45.340 45.340 45.525 -0.185 25277 7920 1 18 . 1 1 30 30 GLY H H 30 8.410 8.410 8.824 -0.414 25277 7921 1 18 . 1 1 44 44 PRO CA C 44 63.590 63.590 62.537 1.053 25277 7922 1 18 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.289 -0.299 25277 7923 1 18 . 1 1 45 45 ALA N N 45 122.140 122.140 121.999 0.141 25277 7924 1 18 . 1 1 45 45 ALA CA C 45 52.670 52.670 51.322 1.348 25277 7925 1 18 . 1 1 45 45 ALA H H 45 8.350 8.350 8.051 0.299 25277 7926 1 18 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.249 0.051 25277 7927 1 18 . 1 1 49 49 PRO CA C 49 62.950 62.950 62.897 0.053 25277 7928 1 18 . 1 1 49 49 PRO CB C 49 31.990 31.990 32.086 -0.096 25277 7929 1 18 . 1 1 50 50 VAL N N 50 124.190 124.190 125.636 -1.446 25277 7930 1 18 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.303 0.017 25277 7931 1 18 . 1 1 50 50 VAL CA C 50 59.850 59.850 59.916 -0.066 25277 7932 1 18 . 1 1 50 50 VAL CB C 50 32.480 32.480 32.277 0.203 25277 7933 1 18 . 1 1 50 50 VAL H H 50 8.070 8.070 8.215 -0.145 25277 7934 1 18 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.279 0.071 25277 7935 1 18 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.242 -0.312 25277 7936 1 18 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.062 -0.082 25277 7937 1 18 . 1 1 52 52 LEU N N 52 124.500 124.500 122.586 1.914 25277 7938 1 18 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.287 0.203 25277 7939 1 18 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.756 -0.866 25277 7940 1 18 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.853 0.337 25277 7941 1 18 . 1 1 52 52 LEU H H 52 8.360 8.360 8.221 0.139 25277 7942 1 18 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.513 -0.103 25277 7943 1 18 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.391 -0.061 25277 7944 1 18 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.105 -0.115 25277 7945 1 18 . 1 1 54 54 SER N N 54 117.380 117.380 116.814 0.566 25277 7946 1 18 . 1 1 54 54 SER HA H 54 4.600 4.600 4.486 0.114 25277 7947 1 18 . 1 1 54 54 SER CA C 54 56.710 56.710 57.903 -1.193 25277 7948 1 18 . 1 1 54 54 SER CB C 54 62.500 62.500 63.315 -0.815 25277 7949 1 18 . 1 1 54 54 SER H H 54 8.400 8.400 8.299 0.101 25277 7950 1 18 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.533 0.017 25277 7951 1 18 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.410 0.130 25277 7952 1 18 . 1 1 55 55 PRO CB C 55 32.620 32.620 32.135 0.485 25277 7953 1 18 . 1 1 57 57 SER HA H 57 4.420 4.420 4.252 0.168 25277 7954 1 18 . 1 1 57 57 SER CA C 57 57.580 57.580 60.127 -2.547 25277 7955 1 18 . 1 1 57 57 SER CB C 57 63.780 63.780 63.161 0.619 25277 7956 1 18 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.294 0.696 25277 7957 1 18 . 1 1 58 58 ASN C C 58 172.230 172.230 173.806 -1.576 25277 7958 1 18 . 1 1 58 58 ASN CA C 58 53.670 53.670 54.913 -1.243 25277 7959 1 18 . 1 1 58 58 ASN CB C 58 37.850 37.850 37.157 0.693 25277 7960 1 18 . 1 1 59 59 LYS N N 59 117.660 117.660 114.531 3.129 25277 7961 1 18 . 1 1 59 59 LYS HA H 59 5.360 5.360 4.944 0.416 25277 7962 1 18 . 1 1 59 59 LYS C C 59 175.120 175.120 174.069 1.051 25277 7963 1 18 . 1 1 59 59 LYS CA C 59 54.860 54.860 55.569 -0.709 25277 7964 1 18 . 1 1 59 59 LYS CB C 59 36.450 36.450 36.474 -0.024 25277 7965 1 18 . 1 1 59 59 LYS H H 59 7.640 7.640 7.727 -0.087 25277 7966 1 18 . 1 1 60 60 GLN N N 60 120.680 120.680 118.611 2.069 25277 7967 1 18 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.678 -0.188 25277 7968 1 18 . 1 1 60 60 GLN C C 60 173.640 173.640 173.417 0.223 25277 7969 1 18 . 1 1 60 60 GLN CA C 60 55.480 55.480 54.837 0.643 25277 7970 1 18 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.210 -0.220 25277 7971 1 18 . 1 1 60 60 GLN H H 60 8.930 8.930 8.308 0.622 25277 7972 1 18 . 1 1 61 61 ASP N N 61 126.170 126.170 121.430 4.740 25277 7973 1 18 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.816 0.234 25277 7974 1 18 . 1 1 61 61 ASP C C 61 175.000 175.000 175.267 -0.267 25277 7975 1 18 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.517 0.363 25277 7976 1 18 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.374 -0.604 25277 7977 1 18 . 1 1 61 61 ASP H H 61 8.540 8.540 8.600 -0.060 25277 7978 1 18 . 1 1 62 62 ILE N N 62 121.100 121.100 125.294 -4.194 25277 7979 1 18 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.561 0.219 25277 7980 1 18 . 1 1 62 62 ILE C C 62 171.480 171.480 173.608 -2.128 25277 7981 1 18 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.295 0.795 25277 7982 1 18 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.414 0.726 25277 7983 1 18 . 1 1 62 62 ILE H H 62 8.970 8.970 8.435 0.535 25277 7984 1 18 . 1 1 63 63 SER N N 63 119.430 119.430 121.267 -1.837 25277 7985 1 18 . 1 1 63 63 SER HA H 63 4.680 4.680 4.570 0.110 25277 7986 1 18 . 1 1 63 63 SER C C 63 174.030 174.030 174.440 -0.410 25277 7987 1 18 . 1 1 63 63 SER CA C 63 56.550 56.550 56.293 0.257 25277 7988 1 18 . 1 1 63 63 SER CB C 63 67.320 67.320 65.828 1.492 25277 7989 1 18 . 1 1 63 63 SER H H 63 8.520 8.520 7.904 0.616 25277 7990 1 18 . 1 1 64 64 GLU N N 64 121.250 121.250 119.730 1.520 25277 7991 1 18 . 1 1 64 64 GLU HA H 64 2.770 2.770 2.959 -0.189 25277 7992 1 18 . 1 1 64 64 GLU C C 64 177.190 177.190 177.842 -0.652 25277 7993 1 18 . 1 1 64 64 GLU CA C 64 58.590 58.590 58.828 -0.238 25277 7994 1 18 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.632 -0.492 25277 7995 1 18 . 1 1 64 64 GLU H H 64 7.400 7.400 7.647 -0.247 25277 7996 1 18 . 1 1 65 65 ALA N N 65 119.250 119.250 122.162 -2.912 25277 7997 1 18 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.893 -0.033 25277 7998 1 18 . 1 1 65 65 ALA C C 65 179.630 179.630 179.612 0.018 25277 7999 1 18 . 1 1 65 65 ALA CA C 65 53.810 53.810 54.761 -0.951 25277 8000 1 18 . 1 1 65 65 ALA CB C 65 18.400 18.400 17.965 0.435 25277 8001 1 18 . 1 1 65 65 ALA H H 65 7.700 7.700 8.279 -0.579 25277 8002 1 18 . 1 1 66 66 ASN N N 66 112.360 112.360 116.542 -4.182 25277 8003 1 18 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.475 0.555 25277 8004 1 18 . 1 1 66 66 ASN C C 66 174.580 174.580 177.405 -2.825 25277 8005 1 18 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.745 -0.195 25277 8006 1 18 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.461 1.469 25277 8007 1 18 . 1 1 66 66 ASN H H 66 7.960 7.960 7.485 0.475 25277 8008 1 18 . 1 1 67 67 LEU N N 67 115.390 115.390 118.579 -3.189 25277 8009 1 18 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.228 0.422 25277 8010 1 18 . 1 1 67 67 LEU C C 67 176.500 176.500 176.941 -0.441 25277 8011 1 18 . 1 1 67 67 LEU CA C 67 54.350 54.350 56.096 -1.746 25277 8012 1 18 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.076 2.594 25277 8013 1 18 . 1 1 67 67 LEU H H 67 7.050 7.050 7.585 -0.535 25277 8014 1 18 . 1 1 68 68 ALA N N 68 125.680 125.680 120.458 5.222 25277 8015 1 18 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.756 0.134 25277 8016 1 18 . 1 1 68 68 ALA C C 68 177.480 177.480 178.238 -0.758 25277 8017 1 18 . 1 1 68 68 ALA CA C 68 53.550 53.550 53.358 0.191 25277 8018 1 18 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.162 -0.012 25277 8019 1 18 . 1 1 68 68 ALA H H 68 8.880 8.880 8.015 0.865 25277 8020 1 18 . 1 1 69 69 TYR N N 69 119.780 119.780 119.783 -0.003 25277 8021 1 18 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.338 0.152 25277 8022 1 18 . 1 1 69 69 TYR C C 69 175.340 175.340 177.283 -1.943 25277 8023 1 18 . 1 1 69 69 TYR CA C 69 58.640 58.640 60.647 -2.007 25277 8024 1 18 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.041 -0.761 25277 8025 1 18 . 1 1 69 69 TYR H H 69 7.420 7.420 8.459 -1.039 25277 8026 1 18 . 1 1 70 70 LEU N N 70 118.820 118.820 117.235 1.585 25277 8027 1 18 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.174 0.116 25277 8028 1 18 . 1 1 70 70 LEU C C 70 176.770 176.770 177.650 -0.880 25277 8029 1 18 . 1 1 70 70 LEU CA C 70 53.880 53.880 56.149 -2.269 25277 8030 1 18 . 1 1 70 70 LEU CB C 70 41.300 41.300 41.564 -0.264 25277 8031 1 18 . 1 1 70 70 LEU H H 70 7.690 7.690 7.544 0.146 25277 8032 1 18 . 1 1 71 71 TRP N N 71 124.110 124.110 122.652 1.458 25277 8033 1 18 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.534 0.056 25277 8034 1 18 . 1 1 71 71 TRP CA C 71 54.150 54.150 56.240 -2.090 25277 8035 1 18 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.299 -0.090 25277 8036 1 18 . 1 1 71 71 TRP H H 71 8.130 8.130 7.739 0.391 25277 8037 1 18 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.396 0.184 25277 8038 1 18 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.164 0.425 25277 8039 1 18 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.746 -1.686 25277 8040 1 18 . 1 1 73 73 LEU N N 73 118.760 118.760 117.748 1.012 25277 8041 1 18 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.575 0.825 25277 8042 1 18 . 1 1 73 73 LEU C C 73 176.620 176.620 178.299 -1.679 25277 8043 1 18 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.704 -0.654 25277 8044 1 18 . 1 1 73 73 LEU CB C 73 44.260 44.260 43.120 1.140 25277 8045 1 18 . 1 1 73 73 LEU H H 73 5.190 5.190 6.623 -1.433 25277 8046 1 18 . 1 1 74 74 THR N N 74 110.120 110.120 115.490 -5.370 25277 8047 1 18 . 1 1 74 74 THR HA H 74 4.250 4.250 4.225 0.025 25277 8048 1 18 . 1 1 74 74 THR C C 74 176.080 176.080 175.462 0.618 25277 8049 1 18 . 1 1 74 74 THR CA C 74 62.690 62.690 64.160 -1.470 25277 8050 1 18 . 1 1 74 74 THR CB C 74 67.930 67.930 69.167 -1.237 25277 8051 1 18 . 1 1 74 74 THR H H 74 9.010 9.010 8.690 0.320 25277 8052 1 18 . 1 1 75 75 VAL N N 75 113.030 113.030 119.302 -6.272 25277 8053 1 18 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.237 0.573 25277 8054 1 18 . 1 1 75 75 VAL C C 75 176.010 176.010 177.064 -1.054 25277 8055 1 18 . 1 1 75 75 VAL CA C 75 59.100 59.100 62.181 -3.081 25277 8056 1 18 . 1 1 75 75 VAL CB C 75 33.220 33.220 32.294 0.926 25277 8057 1 18 . 1 1 75 75 VAL H H 75 6.660 6.660 7.710 -1.050 25277 8058 1 18 . 1 1 76 76 ASP N N 76 119.590 119.590 123.614 -4.024 25277 8059 1 18 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.696 -0.206 25277 8060 1 18 . 1 1 76 76 ASP C C 76 175.060 175.060 176.643 -1.583 25277 8061 1 18 . 1 1 76 76 ASP CA C 76 55.110 55.110 57.099 -1.989 25277 8062 1 18 . 1 1 76 76 ASP CB C 76 41.300 41.300 41.090 0.210 25277 8063 1 18 . 1 1 76 76 ASP H H 76 8.770 8.770 9.106 -0.336 25277 8064 1 18 . 1 1 77 77 HIS N N 77 113.300 113.300 112.075 1.225 25277 8065 1 18 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.730 0.360 25277 8066 1 18 . 1 1 77 77 HIS C C 77 171.370 171.370 173.872 -2.502 25277 8067 1 18 . 1 1 77 77 HIS CA C 77 55.590 55.590 54.553 1.037 25277 8068 1 18 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.620 -2.429 25277 8069 1 18 . 1 1 77 77 HIS H H 77 7.650 7.650 7.690 -0.040 25277 8070 1 18 . 1 1 78 78 GLY N N 78 101.350 101.350 105.844 -4.494 25277 8071 1 18 . 1 1 78 78 GLY C C 78 172.110 172.110 172.244 -0.134 25277 8072 1 18 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.851 -0.041 25277 8073 1 18 . 1 1 78 78 GLY H H 78 8.450 8.450 8.805 -0.355 25277 8074 1 18 . 1 1 79 79 THR N N 79 120.230 120.230 117.139 3.091 25277 8075 1 18 . 1 1 79 79 THR HA H 79 5.110 5.110 4.897 0.213 25277 8076 1 18 . 1 1 79 79 THR C C 79 172.920 172.920 174.009 -1.089 25277 8077 1 18 . 1 1 79 79 THR CA C 79 61.480 61.480 61.667 -0.187 25277 8078 1 18 . 1 1 79 79 THR CB C 79 72.130 72.130 70.480 1.650 25277 8079 1 18 . 1 1 79 79 THR H H 79 8.080 8.080 8.443 -0.363 25277 8080 1 18 . 1 1 80 80 ILE N N 80 119.620 119.620 120.188 -0.568 25277 8081 1 18 . 1 1 80 80 ILE HA H 80 5.140 5.140 4.929 0.211 25277 8082 1 18 . 1 1 80 80 ILE C C 80 174.340 174.340 174.180 0.160 25277 8083 1 18 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.494 -0.144 25277 8084 1 18 . 1 1 80 80 ILE CB C 80 39.550 39.550 40.391 -0.841 25277 8085 1 18 . 1 1 80 80 ILE H H 80 8.970 8.970 8.712 0.258 25277 8086 1 18 . 1 1 81 81 GLU N N 81 119.960 119.960 125.532 -5.572 25277 8087 1 18 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.074 -0.074 25277 8088 1 18 . 1 1 81 81 GLU C C 81 176.130 176.130 174.515 1.615 25277 8089 1 18 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.897 -0.337 25277 8090 1 18 . 1 1 81 81 GLU CB C 81 33.390 33.390 34.455 -1.065 25277 8091 1 18 . 1 1 81 81 GLU H H 81 8.350 8.350 8.296 0.054 25277 8092 1 18 . 1 1 82 82 CYS N N 82 123.110 123.110 124.958 -1.848 25277 8093 1 18 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.028 -0.098 25277 8094 1 18 . 1 1 82 82 CYS C C 82 174.430 174.430 175.098 -0.668 25277 8095 1 18 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.148 -4.908 25277 8096 1 18 . 1 1 82 82 CYS CB C 82 43.720 43.720 26.551 17.169 25277 8097 1 18 . 1 1 82 82 CYS H H 82 8.220 8.220 8.403 -0.183 25277 8098 1 18 . 1 1 83 83 LEU N N 83 131.660 131.660 127.326 4.334 25277 8099 1 18 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.686 -0.156 25277 8100 1 18 . 1 1 83 83 LEU CA C 83 53.900 53.900 53.088 0.812 25277 8101 1 18 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.174 -1.974 25277 8102 1 18 . 1 1 83 83 LEU H H 83 8.910 8.910 8.131 0.779 25277 8103 1 18 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.260 0.110 25277 8104 1 18 . 1 1 84 84 PRO CA C 84 63.190 63.190 65.182 -1.992 25277 8105 1 18 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.784 0.146 25277 8106 1 18 . 1 1 85 85 SER N N 85 117.620 117.620 112.434 5.186 25277 8107 1 18 . 1 1 85 85 SER HA H 85 3.870 3.870 4.462 -0.592 25277 8108 1 18 . 1 1 85 85 SER C C 85 174.350 174.350 173.617 0.733 25277 8109 1 18 . 1 1 85 85 SER CA C 85 58.970 58.970 58.602 0.368 25277 8110 1 18 . 1 1 85 85 SER CB C 85 63.820 63.820 62.913 0.907 25277 8111 1 18 . 1 1 85 85 SER H H 85 7.660 7.660 8.037 -0.377 25277 8112 1 18 . 1 1 86 86 ASP N N 86 117.590 117.590 118.387 -0.797 25277 8113 1 18 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.295 -0.155 25277 8114 1 18 . 1 1 86 86 ASP C C 86 174.480 174.480 174.019 0.461 25277 8115 1 18 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.599 -0.619 25277 8116 1 18 . 1 1 86 86 ASP CB C 86 37.850 37.850 38.689 -0.839 25277 8117 1 18 . 1 1 86 86 ASP H H 86 8.490 8.490 8.343 0.147 25277 8118 1 18 . 1 1 87 87 ASN N N 87 117.160 117.160 116.005 1.155 25277 8119 1 18 . 1 1 87 87 ASN HA H 87 4.530 4.530 5.096 -0.566 25277 8120 1 18 . 1 1 87 87 ASN CA C 87 52.480 52.480 52.285 0.195 25277 8121 1 18 . 1 1 87 87 ASN CB C 87 40.040 40.040 41.881 -1.841 25277 8122 1 18 . 1 1 87 87 ASN H H 87 7.260 7.260 7.641 -0.381 25277 8123 1 18 . 1 1 88 88 ALA HA H 88 4.730 4.730 4.655 0.075 25277 8124 1 18 . 1 1 88 88 ALA C C 88 174.620 174.620 176.184 -1.564 25277 8125 1 18 . 1 1 88 88 ALA CA C 88 51.230 51.230 51.002 0.228 25277 8126 1 18 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.081 0.459 25277 8127 1 18 . 1 1 89 89 VAL N N 89 116.580 116.580 119.106 -2.526 25277 8128 1 18 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.024 0.076 25277 8129 1 18 . 1 1 89 89 VAL C C 89 172.750 172.750 173.548 -0.798 25277 8130 1 18 . 1 1 89 89 VAL CA C 89 58.980 58.980 59.469 -0.489 25277 8131 1 18 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.296 0.924 25277 8132 1 18 . 1 1 89 89 VAL H H 89 8.740 8.740 8.232 0.508 25277 8133 1 18 . 1 1 90 90 PHE N N 90 120.300 120.300 123.708 -3.408 25277 8134 1 18 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.110 0.040 25277 8135 1 18 . 1 1 90 90 PHE C C 90 172.910 172.910 173.596 -0.686 25277 8136 1 18 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.413 0.387 25277 8137 1 18 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.547 1.103 25277 8138 1 18 . 1 1 90 90 PHE H H 90 8.950 8.950 8.968 -0.018 25277 8139 1 18 . 1 1 91 91 VAL N N 91 129.020 129.020 128.124 0.896 25277 8140 1 18 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.603 -0.143 25277 8141 1 18 . 1 1 91 91 VAL C C 91 175.910 175.910 174.022 1.888 25277 8142 1 18 . 1 1 91 91 VAL CA C 91 60.780 60.780 60.520 0.260 25277 8143 1 18 . 1 1 91 91 VAL CB C 91 32.020 32.020 34.118 -2.098 25277 8144 1 18 . 1 1 91 91 VAL H H 91 9.090 9.090 8.617 0.473 25277 8145 1 18 . 1 1 92 92 ALA N N 92 129.760 129.760 129.079 0.681 25277 8146 1 18 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.764 -0.264 25277 8147 1 18 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.604 2.246 25277 8148 1 18 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.393 -1.343 25277 8149 1 18 . 1 1 92 92 ALA H H 92 8.680 8.680 8.448 0.232 25277 8150 1 18 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.070 0.090 25277 8151 1 18 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.087 0.313 25277 8152 1 18 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.614 0.326 25277 8153 1 18 . 1 1 94 94 ASP N N 94 113.220 113.220 114.957 -1.737 25277 8154 1 18 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.469 -0.049 25277 8155 1 18 . 1 1 94 94 ASP C C 94 176.980 176.980 177.481 -0.501 25277 8156 1 18 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.986 -0.456 25277 8157 1 18 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.859 -0.279 25277 8158 1 18 . 1 1 94 94 ASP H H 94 7.890 7.890 7.808 0.082 25277 8159 1 18 . 1 1 95 95 GLY N N 95 109.120 109.120 108.317 0.803 25277 8160 1 18 . 1 1 95 95 GLY C C 95 174.440 174.440 174.327 0.113 25277 8161 1 18 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.136 -0.576 25277 8162 1 18 . 1 1 95 95 GLY H H 95 8.500 8.500 8.145 0.355 25277 8163 1 18 . 1 1 96 96 THR N N 96 120.350 120.350 118.560 1.790 25277 8164 1 18 . 1 1 96 96 THR HA H 96 3.780 3.780 4.430 -0.650 25277 8165 1 18 . 1 1 96 96 THR C C 96 172.590 172.590 173.433 -0.843 25277 8166 1 18 . 1 1 96 96 THR CA C 96 64.660 64.660 61.866 2.794 25277 8167 1 18 . 1 1 96 96 THR CB C 96 68.330 68.330 69.895 -1.565 25277 8168 1 18 . 1 1 96 96 THR H H 96 8.100 8.100 8.409 -0.309 25277 8169 1 18 . 1 1 97 97 THR N N 97 122.660 122.660 121.248 1.412 25277 8170 1 18 . 1 1 97 97 THR HA H 97 4.590 4.590 4.707 -0.117 25277 8171 1 18 . 1 1 97 97 THR C C 97 173.000 173.000 173.560 -0.560 25277 8172 1 18 . 1 1 97 97 THR CA C 97 62.700 62.700 61.970 0.730 25277 8173 1 18 . 1 1 97 97 THR CB C 97 68.840 68.840 69.672 -0.832 25277 8174 1 18 . 1 1 97 97 THR H H 97 7.850 7.850 8.383 -0.533 25277 8175 1 18 . 1 1 98 98 TYR N N 98 122.890 122.890 125.186 -2.296 25277 8176 1 18 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.145 -0.205 25277 8177 1 18 . 1 1 98 98 TYR C C 98 178.970 178.970 174.643 4.327 25277 8178 1 18 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.205 0.305 25277 8179 1 18 . 1 1 98 98 TYR CB C 98 42.950 42.950 42.162 0.788 25277 8180 1 18 . 1 1 98 98 TYR H H 98 9.460 9.460 9.238 0.222 25277 8181 1 18 . 1 1 99 99 ALA N N 99 121.760 121.760 123.606 -1.846 25277 8182 1 18 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.669 -0.559 25277 8183 1 18 . 1 1 99 99 ALA C C 99 178.010 178.010 176.522 1.488 25277 8184 1 18 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.166 1.105 25277 8185 1 18 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.649 2.401 25277 8186 1 18 . 1 1 99 99 ALA H H 99 9.110 9.110 8.883 0.227 25277 8187 1 18 . 1 1 100 100 LEU N N 100 119.330 119.330 124.491 -5.161 25277 8188 1 18 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.209 0.261 25277 8189 1 18 . 1 1 100 100 LEU C C 100 174.720 174.720 177.217 -2.497 25277 8190 1 18 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.928 -2.788 25277 8191 1 18 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.593 2.037 25277 8192 1 18 . 1 1 100 100 LEU H H 100 8.950 8.950 8.433 0.517 25277 8193 1 18 . 1 1 101 101 ASN N N 101 112.600 112.600 115.628 -3.028 25277 8194 1 18 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.920 0.000 25277 8195 1 18 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.450 -1.520 25277 8196 1 18 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.695 0.905 25277 8197 1 18 . 1 1 101 101 ASN H H 101 7.550 7.550 7.739 -0.189 25277 8198 1 18 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.343 -0.153 25277 8199 1 18 . 1 1 102 102 ASP C C 102 178.770 178.770 178.443 0.327 25277 8200 1 18 . 1 1 102 102 ASP CA C 102 56.880 56.880 58.044 -1.163 25277 8201 1 18 . 1 1 102 102 ASP CB C 102 39.980 39.980 40.585 -0.605 25277 8202 1 18 . 1 1 103 103 ARG N N 103 119.370 119.370 119.768 -0.398 25277 8203 1 18 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.047 -0.217 25277 8204 1 18 . 1 1 103 103 ARG C C 103 178.550 178.550 178.425 0.125 25277 8205 1 18 . 1 1 103 103 ARG CA C 103 59.380 59.380 58.872 0.508 25277 8206 1 18 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.984 -0.484 25277 8207 1 18 . 1 1 103 103 ARG H H 103 7.970 7.970 8.245 -0.275 25277 8208 1 18 . 1 1 104 104 ALA N N 104 120.110 120.110 121.683 -1.573 25277 8209 1 18 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.114 0.096 25277 8210 1 18 . 1 1 104 104 ALA C C 104 179.510 179.510 179.207 0.303 25277 8211 1 18 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.300 -0.550 25277 8212 1 18 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.349 1.321 25277 8213 1 18 . 1 1 104 104 ALA H H 104 7.610 7.610 8.577 -0.967 25277 8214 1 18 . 1 1 105 105 GLU N N 105 120.460 120.460 119.595 0.865 25277 8215 1 18 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.317 0.393 25277 8216 1 18 . 1 1 105 105 GLU C C 105 181.710 181.710 179.312 2.398 25277 8217 1 18 . 1 1 105 105 GLU CA C 105 58.680 58.680 59.008 -0.328 25277 8218 1 18 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.695 -0.205 25277 8219 1 18 . 1 1 105 105 GLU H H 105 7.750 7.750 7.770 -0.020 25277 8220 1 18 . 1 1 106 106 LYS N N 106 121.980 121.980 119.988 1.992 25277 8221 1 18 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.100 -0.080 25277 8222 1 18 . 1 1 106 106 LYS C C 106 177.890 177.890 178.000 -0.110 25277 8223 1 18 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.638 -0.168 25277 8224 1 18 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.485 -0.755 25277 8225 1 18 . 1 1 106 106 LYS H H 106 8.380 8.380 7.989 0.391 25277 8226 1 18 . 1 1 107 107 ALA N N 107 119.850 119.850 118.910 0.940 25277 8227 1 18 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.307 -0.047 25277 8228 1 18 . 1 1 107 107 ALA C C 107 177.210 177.210 177.340 -0.130 25277 8229 1 18 . 1 1 107 107 ALA CA C 107 52.270 52.270 51.975 0.295 25277 8230 1 18 . 1 1 107 107 ALA CB C 107 18.740 18.740 18.819 -0.079 25277 8231 1 18 . 1 1 107 107 ALA H H 107 7.400 7.400 7.556 -0.156 25277 8232 1 18 . 1 1 108 108 GLY N N 108 104.560 104.560 106.449 -1.889 25277 8233 1 18 . 1 1 108 108 GLY C C 108 174.300 174.300 174.234 0.066 25277 8234 1 18 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.030 -0.420 25277 8235 1 18 . 1 1 108 108 GLY H H 108 7.560 7.560 7.780 -0.220 25277 8236 1 18 . 1 1 109 109 HIS N N 109 122.550 122.550 120.083 2.467 25277 8237 1 18 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.954 -0.184 25277 8238 1 18 . 1 1 109 109 HIS CA C 109 54.580 54.580 53.779 0.801 25277 8239 1 18 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.317 -0.727 25277 8240 1 18 . 1 1 109 109 HIS H H 109 7.590 7.590 7.757 -0.167 25277 8241 1 18 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.725 -0.165 25277 8242 1 18 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.480 0.250 25277 8243 1 18 . 1 1 111 111 PRO CB C 111 32.800 32.800 32.850 -0.050 25277 8244 1 18 . 1 1 112 112 ILE N N 112 119.770 119.770 119.162 0.608 25277 8245 1 18 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.532 0.328 25277 8246 1 18 . 1 1 112 112 ILE C C 112 172.800 172.800 177.564 -4.764 25277 8247 1 18 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.307 -2.117 25277 8248 1 18 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.236 3.204 25277 8249 1 18 . 1 1 112 112 ILE H H 112 7.890 7.890 8.207 -0.317 25277 8250 1 18 . 1 1 113 113 THR N N 113 113.610 113.610 116.498 -2.888 25277 8251 1 18 . 1 1 113 113 THR HA H 113 3.010 3.010 3.967 -0.957 25277 8252 1 18 . 1 1 113 113 THR CA C 113 66.860 66.860 67.952 -1.092 25277 8253 1 18 . 1 1 113 113 THR CB C 113 66.920 66.920 67.248 -0.328 25277 8254 1 18 . 1 1 113 113 THR H H 113 7.070 7.070 8.573 -1.503 25277 8255 1 18 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.329 0.011 25277 8256 1 18 . 1 1 114 114 PRO CA C 114 66.080 66.080 65.035 1.045 25277 8257 1 18 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.538 0.542 25277 8258 1 18 . 1 1 115 115 ILE N N 115 134.770 134.770 110.038 24.732 25277 8259 1 18 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.395 0.215 25277 8260 1 18 . 1 1 115 115 ILE C C 115 174.800 174.800 174.931 -0.131 25277 8261 1 18 . 1 1 115 115 ILE CA C 115 60.000 60.000 59.896 0.104 25277 8262 1 18 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.532 0.327 25277 8263 1 18 . 1 1 115 115 ILE H H 115 7.510 7.510 7.562 -0.052 25277 8264 1 18 . 1 1 116 116 ARG N N 116 120.890 120.890 122.257 -1.367 25277 8265 1 18 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.130 -0.160 25277 8266 1 18 . 1 1 116 116 ARG C C 116 174.910 174.910 175.289 -0.379 25277 8267 1 18 . 1 1 116 116 ARG CA C 116 57.780 57.780 56.118 1.661 25277 8268 1 18 . 1 1 116 116 ARG CB C 116 31.870 31.870 31.380 0.490 25277 8269 1 18 . 1 1 116 116 ARG H H 116 7.280 7.280 7.555 -0.275 25277 8270 1 18 . 1 1 117 117 ALA N N 117 125.400 125.400 129.016 -3.616 25277 8271 1 18 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.455 -0.225 25277 8272 1 18 . 1 1 117 117 ALA C C 117 176.290 176.290 176.434 -0.144 25277 8273 1 18 . 1 1 117 117 ALA CA C 117 50.780 50.780 51.118 -0.338 25277 8274 1 18 . 1 1 117 117 ALA CB C 117 20.290 20.290 20.951 -0.661 25277 8275 1 18 . 1 1 117 117 ALA H H 117 8.150 8.150 8.399 -0.249 25277 8276 1 18 . 1 1 118 118 LYS N N 118 119.890 119.890 120.736 -0.846 25277 8277 1 18 . 1 1 118 118 LYS HA H 118 4.590 4.590 3.643 0.947 25277 8278 1 18 . 1 1 118 118 LYS C C 118 177.400 177.400 176.576 0.824 25277 8279 1 18 . 1 1 118 118 LYS CA C 118 55.670 55.670 55.816 -0.146 25277 8280 1 18 . 1 1 118 118 LYS CB C 118 34.510 34.510 33.175 1.335 25277 8281 1 18 . 1 1 118 118 LYS H H 118 8.360 8.360 8.231 0.129 25277 8282 1 18 . 1 1 119 119 GLY N N 119 108.630 108.630 109.532 -0.902 25277 8283 1 18 . 1 1 119 119 GLY CA C 119 43.610 43.610 43.991 -0.381 25277 8284 1 18 . 1 1 119 119 GLY H H 119 8.320 8.320 7.897 0.423 25277 8285 1 18 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.716 0.184 25277 8286 1 18 . 1 1 124 124 TYR C C 124 177.430 177.430 175.901 1.529 25277 8287 1 18 . 1 1 124 124 TYR CA C 124 57.970 57.970 56.851 1.119 25277 8288 1 18 . 1 1 124 124 TYR CB C 124 38.650 38.650 41.081 -2.431 25277 8289 1 18 . 1 1 125 125 ILE N N 125 123.670 123.670 122.291 1.379 25277 8290 1 18 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.166 -0.326 25277 8291 1 18 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.303 0.427 25277 8292 1 18 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.468 0.042 25277 8293 1 18 . 1 1 125 125 ILE H H 125 8.340 8.340 8.207 0.133 25277 8294 1 18 . 1 1 126 126 SER HA H 126 4.070 4.070 4.340 -0.270 25277 8295 1 18 . 1 1 126 126 SER C C 126 176.290 176.290 175.037 1.253 25277 8296 1 18 . 1 1 126 126 SER CA C 126 59.190 59.190 59.219 -0.029 25277 8297 1 18 . 1 1 126 126 SER CB C 126 63.200 63.200 63.767 -0.567 25277 8298 1 18 . 1 1 127 127 LEU N N 127 127.030 127.030 124.178 2.852 25277 8299 1 18 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.341 -0.401 25277 8300 1 18 . 1 1 127 127 LEU C C 127 176.660 176.660 178.233 -1.573 25277 8301 1 18 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.702 0.408 25277 8302 1 18 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.563 1.367 25277 8303 1 18 . 1 1 127 127 LEU H H 127 8.790 8.790 8.416 0.374 25277 8304 1 18 . 1 1 128 128 GLY N N 128 106.600 106.600 108.964 -2.364 25277 8305 1 18 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.630 0.900 25277 8306 1 18 . 1 1 128 128 GLY H H 128 8.450 8.450 8.307 0.143 25277 8307 1 18 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.034 0.196 25277 8308 1 18 . 1 1 129 129 ALA C C 129 180.410 180.410 179.265 1.145 25277 8309 1 18 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.599 0.321 25277 8310 1 18 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.277 0.853 25277 8311 1 18 . 1 1 130 130 LEU N N 130 122.550 122.550 120.524 2.026 25277 8312 1 18 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.035 -0.115 25277 8313 1 18 . 1 1 130 130 LEU C C 130 179.020 179.020 178.506 0.514 25277 8314 1 18 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.364 0.266 25277 8315 1 18 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.587 0.553 25277 8316 1 18 . 1 1 130 130 LEU H H 130 8.040 8.040 7.428 0.612 25277 8317 1 18 . 1 1 131 131 LEU N N 131 121.910 121.910 119.489 2.421 25277 8318 1 18 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.886 0.034 25277 8319 1 18 . 1 1 131 131 LEU C C 131 177.910 177.910 178.503 -0.593 25277 8320 1 18 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.135 0.435 25277 8321 1 18 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.504 -0.784 25277 8322 1 18 . 1 1 131 131 LEU H H 131 9.060 9.060 7.945 1.115 25277 8323 1 18 . 1 1 132 132 SER N N 132 115.530 115.530 114.791 0.739 25277 8324 1 18 . 1 1 132 132 SER HA H 132 3.970 3.970 4.102 -0.132 25277 8325 1 18 . 1 1 132 132 SER C C 132 177.140 177.140 177.059 0.081 25277 8326 1 18 . 1 1 132 132 SER CA C 132 62.340 62.340 62.500 -0.160 25277 8327 1 18 . 1 1 132 132 SER CB C 132 62.370 62.370 62.698 -0.328 25277 8328 1 18 . 1 1 132 132 SER H H 132 8.730 8.730 8.152 0.578 25277 8329 1 18 . 1 1 133 133 THR N N 133 116.960 116.960 119.236 -2.276 25277 8330 1 18 . 1 1 133 133 THR HA H 133 3.860 3.860 4.014 -0.154 25277 8331 1 18 . 1 1 133 133 THR C C 133 175.670 175.670 176.775 -1.105 25277 8332 1 18 . 1 1 133 133 THR CA C 133 66.930 66.930 67.058 -0.128 25277 8333 1 18 . 1 1 133 133 THR CB C 133 68.880 68.880 68.758 0.122 25277 8334 1 18 . 1 1 133 133 THR H H 133 7.750 7.750 7.787 -0.037 25277 8335 1 18 . 1 1 134 134 THR N N 134 118.830 118.830 119.146 -0.316 25277 8336 1 18 . 1 1 134 134 THR HA H 134 3.780 3.780 3.976 -0.196 25277 8337 1 18 . 1 1 134 134 THR C C 134 176.750 176.750 176.264 0.486 25277 8338 1 18 . 1 1 134 134 THR CA C 134 67.650 67.650 67.261 0.389 25277 8339 1 18 . 1 1 134 134 THR CB C 134 67.560 67.560 68.712 -1.152 25277 8340 1 18 . 1 1 134 134 THR H H 134 7.570 7.570 7.687 -0.117 25277 8341 1 18 . 1 1 135 135 LEU N N 135 121.420 121.420 121.583 -0.163 25277 8342 1 18 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.934 0.556 25277 8343 1 18 . 1 1 135 135 LEU C C 135 180.050 180.050 178.740 1.310 25277 8344 1 18 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.194 -1.184 25277 8345 1 18 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.601 -0.991 25277 8346 1 18 . 1 1 135 135 LEU H H 135 8.650 8.650 8.231 0.419 25277 8347 1 18 . 1 1 136 136 ASN N N 136 117.010 117.010 117.224 -0.214 25277 8348 1 18 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.431 0.109 25277 8349 1 18 . 1 1 136 136 ASN C C 136 175.980 175.980 177.609 -1.629 25277 8350 1 18 . 1 1 136 136 ASN CA C 136 54.770 54.770 56.075 -1.306 25277 8351 1 18 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.702 -0.262 25277 8352 1 18 . 1 1 136 136 ASN H H 136 7.360 7.360 7.812 -0.452 25277 8353 1 18 . 1 1 137 137 LEU N N 137 116.940 116.940 119.511 -2.571 25277 8354 1 18 . 1 1 137 137 LEU HA H 137 4.160 4.160 3.947 0.213 25277 8355 1 18 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.780 -2.350 25277 8356 1 18 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.691 -0.121 25277 8357 1 18 . 1 1 137 137 LEU H H 137 7.810 7.810 7.557 0.253 25277 8358 1 18 . 1 1 138 138 CYS N N 138 115.430 115.430 115.068 0.362 25277 8359 1 18 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.193 0.217 25277 8360 1 18 . 1 1 138 138 CYS CA C 138 55.480 55.480 61.462 -5.981 25277 8361 1 18 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.349 14.851 25277 8362 1 18 . 1 1 138 138 CYS H H 138 7.450 7.450 7.938 -0.488 25277 8363 1 18 . 1 1 139 139 GLY C C 139 178.800 178.800 174.187 4.613 25277 8364 1 18 . 1 1 139 139 GLY CA C 139 45.500 45.500 45.345 0.155 25277 8365 1 18 . 1 1 140 140 LYS N N 140 119.830 119.830 121.363 -1.533 25277 8366 1 18 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.613 -0.293 25277 8367 1 18 . 1 1 140 140 LYS C C 140 175.820 175.820 175.609 0.211 25277 8368 1 18 . 1 1 140 140 LYS CA C 140 55.680 55.680 55.831 -0.151 25277 8369 1 18 . 1 1 140 140 LYS CB C 140 32.800 32.800 33.636 -0.836 25277 8370 1 18 . 1 1 140 140 LYS H H 140 7.760 7.760 7.513 0.247 25277 8371 1 19 . 1 1 27 27 PRO CA C 27 63.230 63.230 63.058 0.172 25277 8372 1 19 . 1 1 27 27 PRO CB C 27 32.050 32.050 31.635 0.415 25277 8373 1 19 . 1 1 28 28 ASP N N 28 120.030 120.030 123.390 -3.360 25277 8374 1 19 . 1 1 28 28 ASP C C 28 176.130 176.130 176.215 -0.085 25277 8375 1 19 . 1 1 28 28 ASP CA C 28 54.170 54.170 54.447 -0.278 25277 8376 1 19 . 1 1 28 28 ASP CB C 28 40.860 40.860 41.718 -0.858 25277 8377 1 19 . 1 1 28 28 ASP H H 28 8.260 8.260 8.517 -0.257 25277 8378 1 19 . 1 1 29 29 LEU N N 29 123.030 123.030 122.523 0.507 25277 8379 1 19 . 1 1 29 29 LEU C C 29 177.870 177.870 177.264 0.606 25277 8380 1 19 . 1 1 29 29 LEU CA C 29 55.160 55.160 54.426 0.734 25277 8381 1 19 . 1 1 29 29 LEU CB C 29 42.270 42.270 43.792 -1.522 25277 8382 1 19 . 1 1 29 29 LEU H H 29 8.120 8.120 8.259 -0.139 25277 8383 1 19 . 1 1 30 30 GLY N N 30 109.350 109.350 113.784 -4.434 25277 8384 1 19 . 1 1 30 30 GLY CA C 30 45.340 45.340 45.610 -0.270 25277 8385 1 19 . 1 1 30 30 GLY H H 30 8.410 8.410 8.734 -0.324 25277 8386 1 19 . 1 1 44 44 PRO CA C 44 63.590 63.590 62.320 1.270 25277 8387 1 19 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.201 -0.211 25277 8388 1 19 . 1 1 45 45 ALA N N 45 122.140 122.140 121.055 1.085 25277 8389 1 19 . 1 1 45 45 ALA CA C 45 52.670 52.670 52.017 0.653 25277 8390 1 19 . 1 1 45 45 ALA H H 45 8.350 8.350 8.036 0.314 25277 8391 1 19 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.390 -0.090 25277 8392 1 19 . 1 1 49 49 PRO CA C 49 62.950 62.950 63.249 -0.299 25277 8393 1 19 . 1 1 49 49 PRO CB C 49 31.990 31.990 32.088 -0.098 25277 8394 1 19 . 1 1 50 50 VAL N N 50 124.190 124.190 125.865 -1.675 25277 8395 1 19 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.333 -0.013 25277 8396 1 19 . 1 1 50 50 VAL CA C 50 59.850 59.850 59.669 0.181 25277 8397 1 19 . 1 1 50 50 VAL CB C 50 32.480 32.480 32.790 -0.310 25277 8398 1 19 . 1 1 50 50 VAL H H 50 8.070 8.070 8.087 -0.017 25277 8399 1 19 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.307 0.043 25277 8400 1 19 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.258 -0.328 25277 8401 1 19 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.188 -0.208 25277 8402 1 19 . 1 1 52 52 LEU N N 52 124.500 124.500 121.320 3.180 25277 8403 1 19 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.289 0.201 25277 8404 1 19 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.821 -0.931 25277 8405 1 19 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.790 0.400 25277 8406 1 19 . 1 1 52 52 LEU H H 52 8.360 8.360 8.229 0.131 25277 8407 1 19 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.601 -0.191 25277 8408 1 19 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.456 -0.126 25277 8409 1 19 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.235 -0.245 25277 8410 1 19 . 1 1 54 54 SER N N 54 117.380 117.380 116.622 0.758 25277 8411 1 19 . 1 1 54 54 SER HA H 54 4.600 4.600 4.430 0.170 25277 8412 1 19 . 1 1 54 54 SER CA C 54 56.710 56.710 57.207 -0.497 25277 8413 1 19 . 1 1 54 54 SER CB C 54 62.500 62.500 62.945 -0.445 25277 8414 1 19 . 1 1 54 54 SER H H 54 8.400 8.400 8.230 0.170 25277 8415 1 19 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.540 0.010 25277 8416 1 19 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.443 0.097 25277 8417 1 19 . 1 1 55 55 PRO CB C 55 32.620 32.620 32.431 0.189 25277 8418 1 19 . 1 1 57 57 SER HA H 57 4.420 4.420 4.229 0.191 25277 8419 1 19 . 1 1 57 57 SER CA C 57 57.580 57.580 60.248 -2.668 25277 8420 1 19 . 1 1 57 57 SER CB C 57 63.780 63.780 63.141 0.639 25277 8421 1 19 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.447 0.543 25277 8422 1 19 . 1 1 58 58 ASN C C 58 172.230 172.230 173.767 -1.537 25277 8423 1 19 . 1 1 58 58 ASN CA C 58 53.670 53.670 54.722 -1.052 25277 8424 1 19 . 1 1 58 58 ASN CB C 58 37.850 37.850 37.077 0.773 25277 8425 1 19 . 1 1 59 59 LYS N N 59 117.660 117.660 118.352 -0.692 25277 8426 1 19 . 1 1 59 59 LYS HA H 59 5.360 5.360 4.949 0.411 25277 8427 1 19 . 1 1 59 59 LYS C C 59 175.120 175.120 173.833 1.287 25277 8428 1 19 . 1 1 59 59 LYS CA C 59 54.860 54.860 56.029 -1.169 25277 8429 1 19 . 1 1 59 59 LYS CB C 59 36.450 36.450 36.529 -0.079 25277 8430 1 19 . 1 1 59 59 LYS H H 59 7.640 7.640 7.808 -0.168 25277 8431 1 19 . 1 1 60 60 GLN N N 60 120.680 120.680 122.083 -1.403 25277 8432 1 19 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.637 -0.147 25277 8433 1 19 . 1 1 60 60 GLN C C 60 173.640 173.640 173.240 0.400 25277 8434 1 19 . 1 1 60 60 GLN CA C 60 55.480 55.480 54.837 0.644 25277 8435 1 19 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.132 -0.142 25277 8436 1 19 . 1 1 60 60 GLN H H 60 8.930 8.930 8.284 0.646 25277 8437 1 19 . 1 1 61 61 ASP N N 61 126.170 126.170 122.122 4.048 25277 8438 1 19 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.829 0.221 25277 8439 1 19 . 1 1 61 61 ASP C C 61 175.000 175.000 175.195 -0.195 25277 8440 1 19 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.336 0.544 25277 8441 1 19 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.475 -0.705 25277 8442 1 19 . 1 1 61 61 ASP H H 61 8.540 8.540 8.557 -0.017 25277 8443 1 19 . 1 1 62 62 ILE N N 62 121.100 121.100 125.332 -4.232 25277 8444 1 19 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.594 0.186 25277 8445 1 19 . 1 1 62 62 ILE C C 62 171.480 171.480 173.605 -2.125 25277 8446 1 19 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.655 0.435 25277 8447 1 19 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.311 0.829 25277 8448 1 19 . 1 1 62 62 ILE H H 62 8.970 8.970 8.406 0.564 25277 8449 1 19 . 1 1 63 63 SER N N 63 119.430 119.430 121.344 -1.914 25277 8450 1 19 . 1 1 63 63 SER HA H 63 4.680 4.680 4.512 0.168 25277 8451 1 19 . 1 1 63 63 SER C C 63 174.030 174.030 174.372 -0.342 25277 8452 1 19 . 1 1 63 63 SER CA C 63 56.550 56.550 56.470 0.080 25277 8453 1 19 . 1 1 63 63 SER CB C 63 67.320 67.320 66.246 1.075 25277 8454 1 19 . 1 1 63 63 SER H H 63 8.520 8.520 7.849 0.671 25277 8455 1 19 . 1 1 64 64 GLU N N 64 121.250 121.250 120.358 0.892 25277 8456 1 19 . 1 1 64 64 GLU HA H 64 2.770 2.770 2.948 -0.178 25277 8457 1 19 . 1 1 64 64 GLU C C 64 177.190 177.190 177.781 -0.591 25277 8458 1 19 . 1 1 64 64 GLU CA C 64 58.590 58.590 58.847 -0.257 25277 8459 1 19 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.615 -0.475 25277 8460 1 19 . 1 1 64 64 GLU H H 64 7.400 7.400 7.645 -0.245 25277 8461 1 19 . 1 1 65 65 ALA N N 65 119.250 119.250 121.717 -2.467 25277 8462 1 19 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.744 0.116 25277 8463 1 19 . 1 1 65 65 ALA C C 65 179.630 179.630 179.644 -0.014 25277 8464 1 19 . 1 1 65 65 ALA CA C 65 53.810 53.810 55.051 -1.241 25277 8465 1 19 . 1 1 65 65 ALA CB C 65 18.400 18.400 18.218 0.182 25277 8466 1 19 . 1 1 65 65 ALA H H 65 7.700 7.700 8.265 -0.565 25277 8467 1 19 . 1 1 66 66 ASN N N 66 112.360 112.360 115.913 -3.553 25277 8468 1 19 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.454 0.576 25277 8469 1 19 . 1 1 66 66 ASN C C 66 174.580 174.580 176.993 -2.413 25277 8470 1 19 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.594 -0.044 25277 8471 1 19 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.560 1.370 25277 8472 1 19 . 1 1 66 66 ASN H H 66 7.960 7.960 7.454 0.506 25277 8473 1 19 . 1 1 67 67 LEU N N 67 115.390 115.390 118.492 -3.102 25277 8474 1 19 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.242 0.408 25277 8475 1 19 . 1 1 67 67 LEU C C 67 176.500 176.500 176.717 -0.217 25277 8476 1 19 . 1 1 67 67 LEU CA C 67 54.350 54.350 56.213 -1.863 25277 8477 1 19 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.312 2.358 25277 8478 1 19 . 1 1 67 67 LEU H H 67 7.050 7.050 7.499 -0.449 25277 8479 1 19 . 1 1 68 68 ALA N N 68 125.680 125.680 120.267 5.413 25277 8480 1 19 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.744 0.146 25277 8481 1 19 . 1 1 68 68 ALA C C 68 177.480 177.480 178.296 -0.816 25277 8482 1 19 . 1 1 68 68 ALA CA C 68 53.550 53.550 53.360 0.190 25277 8483 1 19 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.185 -0.035 25277 8484 1 19 . 1 1 68 68 ALA H H 68 8.880 8.880 8.002 0.878 25277 8485 1 19 . 1 1 69 69 TYR N N 69 119.780 119.780 119.456 0.324 25277 8486 1 19 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.316 0.174 25277 8487 1 19 . 1 1 69 69 TYR C C 69 175.340 175.340 177.220 -1.880 25277 8488 1 19 . 1 1 69 69 TYR CA C 69 58.640 58.640 60.671 -2.031 25277 8489 1 19 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.038 -0.758 25277 8490 1 19 . 1 1 69 69 TYR H H 69 7.420 7.420 8.524 -1.104 25277 8491 1 19 . 1 1 70 70 LEU N N 70 118.820 118.820 116.963 1.857 25277 8492 1 19 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.168 0.122 25277 8493 1 19 . 1 1 70 70 LEU C C 70 176.770 176.770 177.321 -0.551 25277 8494 1 19 . 1 1 70 70 LEU CA C 70 53.880 53.880 56.242 -2.362 25277 8495 1 19 . 1 1 70 70 LEU CB C 70 41.300 41.300 41.824 -0.524 25277 8496 1 19 . 1 1 70 70 LEU H H 70 7.690 7.690 7.528 0.162 25277 8497 1 19 . 1 1 71 71 TRP N N 71 124.110 124.110 122.192 1.918 25277 8498 1 19 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.523 0.067 25277 8499 1 19 . 1 1 71 71 TRP CA C 71 54.150 54.150 56.142 -1.992 25277 8500 1 19 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.612 -0.402 25277 8501 1 19 . 1 1 71 71 TRP H H 71 8.130 8.130 7.720 0.410 25277 8502 1 19 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.378 0.202 25277 8503 1 19 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.228 0.362 25277 8504 1 19 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.719 -1.659 25277 8505 1 19 . 1 1 73 73 LEU N N 73 118.760 118.760 117.398 1.362 25277 8506 1 19 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.679 0.721 25277 8507 1 19 . 1 1 73 73 LEU C C 73 176.620 176.620 178.140 -1.520 25277 8508 1 19 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.269 -0.219 25277 8509 1 19 . 1 1 73 73 LEU CB C 73 44.260 44.260 43.392 0.868 25277 8510 1 19 . 1 1 73 73 LEU H H 73 5.190 5.190 6.496 -1.306 25277 8511 1 19 . 1 1 74 74 THR N N 74 110.120 110.120 115.091 -4.971 25277 8512 1 19 . 1 1 74 74 THR HA H 74 4.250 4.250 4.207 0.043 25277 8513 1 19 . 1 1 74 74 THR C C 74 176.080 176.080 175.701 0.379 25277 8514 1 19 . 1 1 74 74 THR CA C 74 62.690 62.690 64.397 -1.707 25277 8515 1 19 . 1 1 74 74 THR CB C 74 67.930 67.930 69.309 -1.379 25277 8516 1 19 . 1 1 74 74 THR H H 74 9.010 9.010 8.543 0.467 25277 8517 1 19 . 1 1 75 75 VAL N N 75 113.030 113.030 118.024 -4.994 25277 8518 1 19 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.170 0.640 25277 8519 1 19 . 1 1 75 75 VAL C C 75 176.010 176.010 176.914 -0.904 25277 8520 1 19 . 1 1 75 75 VAL CA C 75 59.100 59.100 62.160 -3.060 25277 8521 1 19 . 1 1 75 75 VAL CB C 75 33.220 33.220 32.581 0.639 25277 8522 1 19 . 1 1 75 75 VAL H H 75 6.660 6.660 7.717 -1.057 25277 8523 1 19 . 1 1 76 76 ASP N N 76 119.590 119.590 123.615 -4.025 25277 8524 1 19 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.689 -0.199 25277 8525 1 19 . 1 1 76 76 ASP C C 76 175.060 175.060 176.279 -1.219 25277 8526 1 19 . 1 1 76 76 ASP CA C 76 55.110 55.110 57.053 -1.943 25277 8527 1 19 . 1 1 76 76 ASP CB C 76 41.300 41.300 41.037 0.263 25277 8528 1 19 . 1 1 76 76 ASP H H 76 8.770 8.770 9.086 -0.316 25277 8529 1 19 . 1 1 77 77 HIS N N 77 113.300 113.300 111.977 1.323 25277 8530 1 19 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.683 0.407 25277 8531 1 19 . 1 1 77 77 HIS C C 77 171.370 171.370 173.826 -2.456 25277 8532 1 19 . 1 1 77 77 HIS CA C 77 55.590 55.590 54.530 1.060 25277 8533 1 19 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.574 -2.384 25277 8534 1 19 . 1 1 77 77 HIS H H 77 7.650 7.650 7.665 -0.015 25277 8535 1 19 . 1 1 78 78 GLY N N 78 101.350 101.350 105.316 -3.966 25277 8536 1 19 . 1 1 78 78 GLY C C 78 172.110 172.110 172.388 -0.278 25277 8537 1 19 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.809 0.001 25277 8538 1 19 . 1 1 78 78 GLY H H 78 8.450 8.450 8.689 -0.239 25277 8539 1 19 . 1 1 79 79 THR N N 79 120.230 120.230 117.009 3.221 25277 8540 1 19 . 1 1 79 79 THR HA H 79 5.110 5.110 4.894 0.216 25277 8541 1 19 . 1 1 79 79 THR C C 79 172.920 172.920 173.768 -0.848 25277 8542 1 19 . 1 1 79 79 THR CA C 79 61.480 61.480 62.032 -0.552 25277 8543 1 19 . 1 1 79 79 THR CB C 79 72.130 72.130 70.828 1.302 25277 8544 1 19 . 1 1 79 79 THR H H 79 8.080 8.080 8.489 -0.409 25277 8545 1 19 . 1 1 80 80 ILE N N 80 119.620 119.620 121.068 -1.448 25277 8546 1 19 . 1 1 80 80 ILE HA H 80 5.140 5.140 5.076 0.064 25277 8547 1 19 . 1 1 80 80 ILE C C 80 174.340 174.340 174.185 0.155 25277 8548 1 19 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.459 -0.109 25277 8549 1 19 . 1 1 80 80 ILE CB C 80 39.550 39.550 39.847 -0.297 25277 8550 1 19 . 1 1 80 80 ILE H H 80 8.970 8.970 8.650 0.320 25277 8551 1 19 . 1 1 81 81 GLU N N 81 119.960 119.960 124.406 -4.446 25277 8552 1 19 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.090 -0.090 25277 8553 1 19 . 1 1 81 81 GLU C C 81 176.130 176.130 174.890 1.240 25277 8554 1 19 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.711 -0.151 25277 8555 1 19 . 1 1 81 81 GLU CB C 81 33.390 33.390 34.695 -1.305 25277 8556 1 19 . 1 1 81 81 GLU H H 81 8.350 8.350 8.303 0.047 25277 8557 1 19 . 1 1 82 82 CYS N N 82 123.110 123.110 122.419 0.691 25277 8558 1 19 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.093 -0.163 25277 8559 1 19 . 1 1 82 82 CYS C C 82 174.430 174.430 174.979 -0.549 25277 8560 1 19 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.208 -4.968 25277 8561 1 19 . 1 1 82 82 CYS CB C 82 43.720 43.720 26.892 16.828 25277 8562 1 19 . 1 1 82 82 CYS H H 82 8.220 8.220 8.388 -0.168 25277 8563 1 19 . 1 1 83 83 LEU N N 83 131.660 131.660 127.625 4.035 25277 8564 1 19 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.723 -0.193 25277 8565 1 19 . 1 1 83 83 LEU CA C 83 53.900 53.900 53.143 0.757 25277 8566 1 19 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.332 -2.132 25277 8567 1 19 . 1 1 83 83 LEU H H 83 8.910 8.910 8.374 0.536 25277 8568 1 19 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.251 0.119 25277 8569 1 19 . 1 1 84 84 PRO CA C 84 63.190 63.190 65.239 -2.049 25277 8570 1 19 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.758 0.172 25277 8571 1 19 . 1 1 85 85 SER N N 85 117.620 117.620 112.759 4.861 25277 8572 1 19 . 1 1 85 85 SER HA H 85 3.870 3.870 4.425 -0.555 25277 8573 1 19 . 1 1 85 85 SER C C 85 174.350 174.350 174.348 0.002 25277 8574 1 19 . 1 1 85 85 SER CA C 85 58.970 58.970 58.615 0.354 25277 8575 1 19 . 1 1 85 85 SER CB C 85 63.820 63.820 63.139 0.681 25277 8576 1 19 . 1 1 85 85 SER H H 85 7.660 7.660 7.962 -0.302 25277 8577 1 19 . 1 1 86 86 ASP N N 86 117.590 117.590 119.514 -1.924 25277 8578 1 19 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.359 -0.219 25277 8579 1 19 . 1 1 86 86 ASP C C 86 174.480 174.480 173.765 0.715 25277 8580 1 19 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.393 -0.413 25277 8581 1 19 . 1 1 86 86 ASP CB C 86 37.850 37.850 39.472 -1.622 25277 8582 1 19 . 1 1 86 86 ASP H H 86 8.490 8.490 8.294 0.196 25277 8583 1 19 . 1 1 87 87 ASN N N 87 117.160 117.160 117.260 -0.100 25277 8584 1 19 . 1 1 87 87 ASN HA H 87 4.530 4.530 5.068 -0.538 25277 8585 1 19 . 1 1 87 87 ASN CA C 87 52.480 52.480 52.288 0.192 25277 8586 1 19 . 1 1 87 87 ASN CB C 87 40.040 40.040 41.429 -1.389 25277 8587 1 19 . 1 1 87 87 ASN H H 87 7.260 7.260 7.609 -0.349 25277 8588 1 19 . 1 1 88 88 ALA HA H 88 4.730 4.730 5.050 -0.320 25277 8589 1 19 . 1 1 88 88 ALA C C 88 174.620 174.620 176.281 -1.661 25277 8590 1 19 . 1 1 88 88 ALA CA C 88 51.230 51.230 50.763 0.467 25277 8591 1 19 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.294 0.246 25277 8592 1 19 . 1 1 89 89 VAL N N 89 116.580 116.580 117.868 -1.288 25277 8593 1 19 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.135 -0.035 25277 8594 1 19 . 1 1 89 89 VAL C C 89 172.750 172.750 173.520 -0.770 25277 8595 1 19 . 1 1 89 89 VAL CA C 89 58.980 58.980 59.429 -0.449 25277 8596 1 19 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.442 0.778 25277 8597 1 19 . 1 1 89 89 VAL H H 89 8.740 8.740 8.334 0.406 25277 8598 1 19 . 1 1 90 90 PHE N N 90 120.300 120.300 123.587 -3.287 25277 8599 1 19 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.073 0.077 25277 8600 1 19 . 1 1 90 90 PHE C C 90 172.910 172.910 173.597 -0.687 25277 8601 1 19 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.615 0.185 25277 8602 1 19 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.011 1.639 25277 8603 1 19 . 1 1 90 90 PHE H H 90 8.950 8.950 9.101 -0.151 25277 8604 1 19 . 1 1 91 91 VAL N N 91 129.020 129.020 128.566 0.454 25277 8605 1 19 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.607 -0.147 25277 8606 1 19 . 1 1 91 91 VAL C C 91 175.910 175.910 174.002 1.908 25277 8607 1 19 . 1 1 91 91 VAL CA C 91 60.780 60.780 60.687 0.093 25277 8608 1 19 . 1 1 91 91 VAL CB C 91 32.020 32.020 33.969 -1.949 25277 8609 1 19 . 1 1 91 91 VAL H H 91 9.090 9.090 8.636 0.454 25277 8610 1 19 . 1 1 92 92 ALA N N 92 129.760 129.760 129.299 0.461 25277 8611 1 19 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.756 -0.256 25277 8612 1 19 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.595 2.255 25277 8613 1 19 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.433 -1.383 25277 8614 1 19 . 1 1 92 92 ALA H H 92 8.680 8.680 8.440 0.240 25277 8615 1 19 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.065 0.095 25277 8616 1 19 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.096 0.304 25277 8617 1 19 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.609 0.331 25277 8618 1 19 . 1 1 94 94 ASP N N 94 113.220 113.220 114.974 -1.754 25277 8619 1 19 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.462 -0.042 25277 8620 1 19 . 1 1 94 94 ASP C C 94 176.980 176.980 177.479 -0.499 25277 8621 1 19 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.984 -0.454 25277 8622 1 19 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.859 -0.279 25277 8623 1 19 . 1 1 94 94 ASP H H 94 7.890 7.890 7.801 0.089 25277 8624 1 19 . 1 1 95 95 GLY N N 95 109.120 109.120 108.696 0.424 25277 8625 1 19 . 1 1 95 95 GLY C C 95 174.440 174.440 174.227 0.213 25277 8626 1 19 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.125 -0.565 25277 8627 1 19 . 1 1 95 95 GLY H H 95 8.500 8.500 8.173 0.327 25277 8628 1 19 . 1 1 96 96 THR N N 96 120.350 120.350 118.278 2.072 25277 8629 1 19 . 1 1 96 96 THR HA H 96 3.780 3.780 4.322 -0.542 25277 8630 1 19 . 1 1 96 96 THR C C 96 172.590 172.590 173.200 -0.610 25277 8631 1 19 . 1 1 96 96 THR CA C 96 64.660 64.660 61.903 2.757 25277 8632 1 19 . 1 1 96 96 THR CB C 96 68.330 68.330 70.152 -1.822 25277 8633 1 19 . 1 1 96 96 THR H H 96 8.100 8.100 8.419 -0.319 25277 8634 1 19 . 1 1 97 97 THR N N 97 122.660 122.660 121.187 1.473 25277 8635 1 19 . 1 1 97 97 THR HA H 97 4.590 4.590 4.804 -0.214 25277 8636 1 19 . 1 1 97 97 THR C C 97 173.000 173.000 173.305 -0.305 25277 8637 1 19 . 1 1 97 97 THR CA C 97 62.700 62.700 61.959 0.741 25277 8638 1 19 . 1 1 97 97 THR CB C 97 68.840 68.840 69.714 -0.874 25277 8639 1 19 . 1 1 97 97 THR H H 97 7.850 7.850 8.327 -0.477 25277 8640 1 19 . 1 1 98 98 TYR N N 98 122.890 122.890 124.895 -2.005 25277 8641 1 19 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.092 -0.152 25277 8642 1 19 . 1 1 98 98 TYR C C 98 178.970 178.970 174.938 4.032 25277 8643 1 19 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.118 0.392 25277 8644 1 19 . 1 1 98 98 TYR CB C 98 42.950 42.950 41.874 1.076 25277 8645 1 19 . 1 1 98 98 TYR H H 98 9.460 9.460 9.169 0.291 25277 8646 1 19 . 1 1 99 99 ALA N N 99 121.760 121.760 123.787 -2.027 25277 8647 1 19 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.673 -0.563 25277 8648 1 19 . 1 1 99 99 ALA C C 99 178.010 178.010 176.254 1.756 25277 8649 1 19 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.237 1.033 25277 8650 1 19 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.716 2.334 25277 8651 1 19 . 1 1 99 99 ALA H H 99 9.110 9.110 8.947 0.163 25277 8652 1 19 . 1 1 100 100 LEU N N 100 119.330 119.330 124.449 -5.119 25277 8653 1 19 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.247 0.223 25277 8654 1 19 . 1 1 100 100 LEU C C 100 174.720 174.720 177.304 -2.584 25277 8655 1 19 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.495 -2.355 25277 8656 1 19 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.695 1.935 25277 8657 1 19 . 1 1 100 100 LEU H H 100 8.950 8.950 8.293 0.657 25277 8658 1 19 . 1 1 101 101 ASN N N 101 112.600 112.600 115.564 -2.964 25277 8659 1 19 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.806 0.114 25277 8660 1 19 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.287 -1.357 25277 8661 1 19 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.381 1.219 25277 8662 1 19 . 1 1 101 101 ASN H H 101 7.550 7.550 7.619 -0.069 25277 8663 1 19 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.383 -0.193 25277 8664 1 19 . 1 1 102 102 ASP C C 102 178.770 178.770 178.317 0.453 25277 8665 1 19 . 1 1 102 102 ASP CA C 102 56.880 56.880 57.817 -0.937 25277 8666 1 19 . 1 1 102 102 ASP CB C 102 39.980 39.980 40.567 -0.587 25277 8667 1 19 . 1 1 103 103 ARG N N 103 119.370 119.370 119.972 -0.602 25277 8668 1 19 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.124 -0.294 25277 8669 1 19 . 1 1 103 103 ARG C C 103 178.550 178.550 178.372 0.178 25277 8670 1 19 . 1 1 103 103 ARG CA C 103 59.380 59.380 59.094 0.286 25277 8671 1 19 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.867 -0.367 25277 8672 1 19 . 1 1 103 103 ARG H H 103 7.970 7.970 8.071 -0.101 25277 8673 1 19 . 1 1 104 104 ALA N N 104 120.110 120.110 122.198 -2.088 25277 8674 1 19 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.084 0.126 25277 8675 1 19 . 1 1 104 104 ALA C C 104 179.510 179.510 179.445 0.065 25277 8676 1 19 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.273 -0.523 25277 8677 1 19 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.400 1.270 25277 8678 1 19 . 1 1 104 104 ALA H H 104 7.610 7.610 8.508 -0.898 25277 8679 1 19 . 1 1 105 105 GLU N N 105 120.460 120.460 118.643 1.817 25277 8680 1 19 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.061 0.649 25277 8681 1 19 . 1 1 105 105 GLU C C 105 181.710 181.710 179.654 2.056 25277 8682 1 19 . 1 1 105 105 GLU CA C 105 58.680 58.680 58.882 -0.202 25277 8683 1 19 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.569 -0.079 25277 8684 1 19 . 1 1 105 105 GLU H H 105 7.750 7.750 7.778 -0.028 25277 8685 1 19 . 1 1 106 106 LYS N N 106 121.980 121.980 120.753 1.227 25277 8686 1 19 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.080 -0.060 25277 8687 1 19 . 1 1 106 106 LYS C C 106 177.890 177.890 178.013 -0.123 25277 8688 1 19 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.705 -0.234 25277 8689 1 19 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.421 -0.691 25277 8690 1 19 . 1 1 106 106 LYS H H 106 8.380 8.380 7.967 0.413 25277 8691 1 19 . 1 1 107 107 ALA N N 107 119.850 119.850 118.974 0.876 25277 8692 1 19 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.246 0.014 25277 8693 1 19 . 1 1 107 107 ALA C C 107 177.210 177.210 177.537 -0.327 25277 8694 1 19 . 1 1 107 107 ALA CA C 107 52.270 52.270 52.131 0.139 25277 8695 1 19 . 1 1 107 107 ALA CB C 107 18.740 18.740 18.877 -0.137 25277 8696 1 19 . 1 1 107 107 ALA H H 107 7.400 7.400 7.608 -0.208 25277 8697 1 19 . 1 1 108 108 GLY N N 108 104.560 104.560 106.015 -1.455 25277 8698 1 19 . 1 1 108 108 GLY C C 108 174.300 174.300 174.523 -0.223 25277 8699 1 19 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.029 -0.419 25277 8700 1 19 . 1 1 108 108 GLY H H 108 7.560 7.560 7.793 -0.233 25277 8701 1 19 . 1 1 109 109 HIS N N 109 122.550 122.550 121.019 1.531 25277 8702 1 19 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.918 -0.148 25277 8703 1 19 . 1 1 109 109 HIS CA C 109 54.580 54.580 53.960 0.620 25277 8704 1 19 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.376 -0.786 25277 8705 1 19 . 1 1 109 109 HIS H H 109 7.590 7.590 7.651 -0.061 25277 8706 1 19 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.674 -0.114 25277 8707 1 19 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.163 0.567 25277 8708 1 19 . 1 1 111 111 PRO CB C 111 32.800 32.800 33.068 -0.268 25277 8709 1 19 . 1 1 112 112 ILE N N 112 119.770 119.770 120.175 -0.405 25277 8710 1 19 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.384 0.476 25277 8711 1 19 . 1 1 112 112 ILE C C 112 172.800 172.800 177.450 -4.650 25277 8712 1 19 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.653 -2.463 25277 8713 1 19 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.645 2.795 25277 8714 1 19 . 1 1 112 112 ILE H H 112 7.890 7.890 8.599 -0.709 25277 8715 1 19 . 1 1 113 113 THR N N 113 113.610 113.610 115.503 -1.893 25277 8716 1 19 . 1 1 113 113 THR HA H 113 3.010 3.010 3.949 -0.939 25277 8717 1 19 . 1 1 113 113 THR CA C 113 66.860 66.860 67.820 -0.960 25277 8718 1 19 . 1 1 113 113 THR CB C 113 66.920 66.920 67.373 -0.453 25277 8719 1 19 . 1 1 113 113 THR H H 113 7.070 7.070 8.468 -1.398 25277 8720 1 19 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.302 0.038 25277 8721 1 19 . 1 1 114 114 PRO CA C 114 66.080 66.080 65.066 1.014 25277 8722 1 19 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.410 0.670 25277 8723 1 19 . 1 1 115 115 ILE N N 115 134.770 134.770 109.634 25.136 25277 8724 1 19 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.486 0.124 25277 8725 1 19 . 1 1 115 115 ILE C C 115 174.800 174.800 174.917 -0.117 25277 8726 1 19 . 1 1 115 115 ILE CA C 115 60.000 60.000 59.992 0.008 25277 8727 1 19 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.968 -0.108 25277 8728 1 19 . 1 1 115 115 ILE H H 115 7.510 7.510 7.659 -0.149 25277 8729 1 19 . 1 1 116 116 ARG N N 116 120.890 120.890 123.740 -2.850 25277 8730 1 19 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.294 -0.324 25277 8731 1 19 . 1 1 116 116 ARG C C 116 174.910 174.910 175.345 -0.435 25277 8732 1 19 . 1 1 116 116 ARG CA C 116 57.780 57.780 55.298 2.482 25277 8733 1 19 . 1 1 116 116 ARG CB C 116 31.870 31.870 30.625 1.245 25277 8734 1 19 . 1 1 116 116 ARG H H 116 7.280 7.280 7.602 -0.322 25277 8735 1 19 . 1 1 117 117 ALA N N 117 125.400 125.400 126.640 -1.240 25277 8736 1 19 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.614 -0.384 25277 8737 1 19 . 1 1 117 117 ALA C C 117 176.290 176.290 176.123 0.167 25277 8738 1 19 . 1 1 117 117 ALA CA C 117 50.780 50.780 50.611 0.168 25277 8739 1 19 . 1 1 117 117 ALA CB C 117 20.290 20.290 21.569 -1.279 25277 8740 1 19 . 1 1 117 117 ALA H H 117 8.150 8.150 8.449 -0.299 25277 8741 1 19 . 1 1 118 118 LYS N N 118 119.890 119.890 120.678 -0.788 25277 8742 1 19 . 1 1 118 118 LYS HA H 118 4.590 4.590 3.442 1.148 25277 8743 1 19 . 1 1 118 118 LYS C C 118 177.400 177.400 175.677 1.723 25277 8744 1 19 . 1 1 118 118 LYS CA C 118 55.670 55.670 55.359 0.311 25277 8745 1 19 . 1 1 118 118 LYS CB C 118 34.510 34.510 32.305 2.205 25277 8746 1 19 . 1 1 118 118 LYS H H 118 8.360 8.360 8.228 0.132 25277 8747 1 19 . 1 1 119 119 GLY N N 119 108.630 108.630 110.688 -2.058 25277 8748 1 19 . 1 1 119 119 GLY CA C 119 43.610 43.610 43.710 -0.100 25277 8749 1 19 . 1 1 119 119 GLY H H 119 8.320 8.320 7.828 0.492 25277 8750 1 19 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.696 0.204 25277 8751 1 19 . 1 1 124 124 TYR C C 124 177.430 177.430 176.249 1.181 25277 8752 1 19 . 1 1 124 124 TYR CA C 124 57.970 57.970 57.099 0.871 25277 8753 1 19 . 1 1 124 124 TYR CB C 124 38.650 38.650 40.874 -2.224 25277 8754 1 19 . 1 1 125 125 ILE N N 125 123.670 123.670 122.174 1.496 25277 8755 1 19 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.085 -0.245 25277 8756 1 19 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.774 -0.044 25277 8757 1 19 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.310 0.200 25277 8758 1 19 . 1 1 125 125 ILE H H 125 8.340 8.340 8.203 0.137 25277 8759 1 19 . 1 1 126 126 SER HA H 126 4.070 4.070 4.434 -0.364 25277 8760 1 19 . 1 1 126 126 SER C C 126 176.290 176.290 175.120 1.170 25277 8761 1 19 . 1 1 126 126 SER CA C 126 59.190 59.190 58.713 0.477 25277 8762 1 19 . 1 1 126 126 SER CB C 126 63.200 63.200 63.731 -0.531 25277 8763 1 19 . 1 1 127 127 LEU N N 127 127.030 127.030 124.995 2.035 25277 8764 1 19 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.331 -0.391 25277 8765 1 19 . 1 1 127 127 LEU C C 127 176.660 176.660 178.250 -1.590 25277 8766 1 19 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.523 0.587 25277 8767 1 19 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.559 1.371 25277 8768 1 19 . 1 1 127 127 LEU H H 127 8.790 8.790 8.544 0.246 25277 8769 1 19 . 1 1 128 128 GLY N N 128 106.600 106.600 108.918 -2.318 25277 8770 1 19 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.534 0.996 25277 8771 1 19 . 1 1 128 128 GLY H H 128 8.450 8.450 8.320 0.130 25277 8772 1 19 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.076 0.154 25277 8773 1 19 . 1 1 129 129 ALA C C 129 180.410 180.410 179.331 1.079 25277 8774 1 19 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.479 0.441 25277 8775 1 19 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.316 0.814 25277 8776 1 19 . 1 1 130 130 LEU N N 130 122.550 122.550 120.605 1.945 25277 8777 1 19 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.047 -0.127 25277 8778 1 19 . 1 1 130 130 LEU C C 130 179.020 179.020 178.490 0.530 25277 8779 1 19 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.347 0.283 25277 8780 1 19 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.635 0.505 25277 8781 1 19 . 1 1 130 130 LEU H H 130 8.040 8.040 7.418 0.622 25277 8782 1 19 . 1 1 131 131 LEU N N 131 121.910 121.910 119.511 2.399 25277 8783 1 19 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.912 0.008 25277 8784 1 19 . 1 1 131 131 LEU C C 131 177.910 177.910 178.120 -0.210 25277 8785 1 19 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.294 0.276 25277 8786 1 19 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.496 -0.776 25277 8787 1 19 . 1 1 131 131 LEU H H 131 9.060 9.060 7.852 1.208 25277 8788 1 19 . 1 1 132 132 SER N N 132 115.530 115.530 114.254 1.276 25277 8789 1 19 . 1 1 132 132 SER HA H 132 3.970 3.970 4.102 -0.132 25277 8790 1 19 . 1 1 132 132 SER C C 132 177.140 177.140 176.777 0.363 25277 8791 1 19 . 1 1 132 132 SER CA C 132 62.340 62.340 62.228 0.112 25277 8792 1 19 . 1 1 132 132 SER CB C 132 62.370 62.370 62.448 -0.078 25277 8793 1 19 . 1 1 132 132 SER H H 132 8.730 8.730 8.071 0.659 25277 8794 1 19 . 1 1 133 133 THR N N 133 116.960 116.960 118.850 -1.890 25277 8795 1 19 . 1 1 133 133 THR HA H 133 3.860 3.860 4.101 -0.241 25277 8796 1 19 . 1 1 133 133 THR C C 133 175.670 175.670 176.900 -1.230 25277 8797 1 19 . 1 1 133 133 THR CA C 133 66.930 66.930 66.750 0.180 25277 8798 1 19 . 1 1 133 133 THR CB C 133 68.880 68.880 68.447 0.433 25277 8799 1 19 . 1 1 133 133 THR H H 133 7.750 7.750 7.856 -0.106 25277 8800 1 19 . 1 1 134 134 THR N N 134 118.830 118.830 119.003 -0.173 25277 8801 1 19 . 1 1 134 134 THR HA H 134 3.780 3.780 4.092 -0.312 25277 8802 1 19 . 1 1 134 134 THR C C 134 176.750 176.750 176.457 0.293 25277 8803 1 19 . 1 1 134 134 THR CA C 134 67.650 67.650 66.826 0.824 25277 8804 1 19 . 1 1 134 134 THR CB C 134 67.560 67.560 68.447 -0.887 25277 8805 1 19 . 1 1 134 134 THR H H 134 7.570 7.570 7.760 -0.190 25277 8806 1 19 . 1 1 135 135 LEU N N 135 121.420 121.420 121.881 -0.461 25277 8807 1 19 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.935 0.555 25277 8808 1 19 . 1 1 135 135 LEU C C 135 180.050 180.050 178.980 1.070 25277 8809 1 19 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.267 -1.257 25277 8810 1 19 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.404 -0.794 25277 8811 1 19 . 1 1 135 135 LEU H H 135 8.650 8.650 8.225 0.425 25277 8812 1 19 . 1 1 136 136 ASN N N 136 117.010 117.010 117.475 -0.465 25277 8813 1 19 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.470 0.070 25277 8814 1 19 . 1 1 136 136 ASN C C 136 175.980 175.980 177.839 -1.859 25277 8815 1 19 . 1 1 136 136 ASN CA C 136 54.770 54.770 55.684 -0.914 25277 8816 1 19 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.292 0.148 25277 8817 1 19 . 1 1 136 136 ASN H H 136 7.360 7.360 7.868 -0.508 25277 8818 1 19 . 1 1 137 137 LEU N N 137 116.940 116.940 120.694 -3.754 25277 8819 1 19 . 1 1 137 137 LEU HA H 137 4.160 4.160 3.987 0.173 25277 8820 1 19 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.746 -2.316 25277 8821 1 19 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.551 0.019 25277 8822 1 19 . 1 1 137 137 LEU H H 137 7.810 7.810 7.612 0.198 25277 8823 1 19 . 1 1 138 138 CYS N N 138 115.430 115.430 114.818 0.612 25277 8824 1 19 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.223 0.187 25277 8825 1 19 . 1 1 138 138 CYS CA C 138 55.480 55.480 61.290 -5.810 25277 8826 1 19 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.447 14.754 25277 8827 1 19 . 1 1 138 138 CYS H H 138 7.450 7.450 7.896 -0.446 25277 8828 1 19 . 1 1 139 139 GLY C C 139 178.800 178.800 174.289 4.511 25277 8829 1 19 . 1 1 139 139 GLY CA C 139 45.500 45.500 45.152 0.348 25277 8830 1 19 . 1 1 140 140 LYS N N 140 119.830 119.830 121.839 -2.009 25277 8831 1 19 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.768 -0.448 25277 8832 1 19 . 1 1 140 140 LYS C C 140 175.820 175.820 175.939 -0.119 25277 8833 1 19 . 1 1 140 140 LYS CA C 140 55.680 55.680 54.896 0.784 25277 8834 1 19 . 1 1 140 140 LYS CB C 140 32.800 32.800 33.477 -0.677 25277 8835 1 19 . 1 1 140 140 LYS H H 140 7.760 7.760 7.534 0.226 25277 8836 1 20 . 1 1 27 27 PRO CA C 27 63.230 63.230 63.136 0.094 25277 8837 1 20 . 1 1 27 27 PRO CB C 27 32.050 32.050 31.220 0.830 25277 8838 1 20 . 1 1 28 28 ASP N N 28 120.030 120.030 123.677 -3.647 25277 8839 1 20 . 1 1 28 28 ASP C C 28 176.130 176.130 175.069 1.061 25277 8840 1 20 . 1 1 28 28 ASP CA C 28 54.170 54.170 53.197 0.973 25277 8841 1 20 . 1 1 28 28 ASP CB C 28 40.860 40.860 41.771 -0.911 25277 8842 1 20 . 1 1 28 28 ASP H H 28 8.260 8.260 8.285 -0.025 25277 8843 1 20 . 1 1 29 29 LEU N N 29 123.030 123.030 120.886 2.144 25277 8844 1 20 . 1 1 29 29 LEU C C 29 177.870 177.870 177.642 0.228 25277 8845 1 20 . 1 1 29 29 LEU CA C 29 55.160 55.160 54.426 0.734 25277 8846 1 20 . 1 1 29 29 LEU CB C 29 42.270 42.270 42.907 -0.637 25277 8847 1 20 . 1 1 29 29 LEU H H 29 8.120 8.120 8.298 -0.178 25277 8848 1 20 . 1 1 30 30 GLY N N 30 109.350 109.350 110.242 -0.892 25277 8849 1 20 . 1 1 30 30 GLY CA C 30 45.340 45.340 45.063 0.277 25277 8850 1 20 . 1 1 30 30 GLY H H 30 8.410 8.410 8.525 -0.115 25277 8851 1 20 . 1 1 44 44 PRO CA C 44 63.590 63.590 62.970 0.620 25277 8852 1 20 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.340 -0.350 25277 8853 1 20 . 1 1 45 45 ALA N N 45 122.140 122.140 121.657 0.483 25277 8854 1 20 . 1 1 45 45 ALA CA C 45 52.670 52.670 51.663 1.007 25277 8855 1 20 . 1 1 45 45 ALA H H 45 8.350 8.350 8.216 0.134 25277 8856 1 20 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.362 -0.062 25277 8857 1 20 . 1 1 49 49 PRO CA C 49 62.950 62.950 63.273 -0.323 25277 8858 1 20 . 1 1 49 49 PRO CB C 49 31.990 31.990 31.961 0.029 25277 8859 1 20 . 1 1 50 50 VAL N N 50 124.190 124.190 125.708 -1.518 25277 8860 1 20 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.298 0.022 25277 8861 1 20 . 1 1 50 50 VAL CA C 50 59.850 59.850 59.505 0.345 25277 8862 1 20 . 1 1 50 50 VAL CB C 50 32.480 32.480 32.234 0.246 25277 8863 1 20 . 1 1 50 50 VAL H H 50 8.070 8.070 7.899 0.171 25277 8864 1 20 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.304 0.046 25277 8865 1 20 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.400 -0.470 25277 8866 1 20 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.099 -0.118 25277 8867 1 20 . 1 1 52 52 LEU N N 52 124.500 124.500 122.438 2.062 25277 8868 1 20 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.276 0.214 25277 8869 1 20 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.780 -0.890 25277 8870 1 20 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.805 0.385 25277 8871 1 20 . 1 1 52 52 LEU H H 52 8.360 8.360 8.221 0.139 25277 8872 1 20 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.581 -0.171 25277 8873 1 20 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.330 0.001 25277 8874 1 20 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.340 -0.350 25277 8875 1 20 . 1 1 54 54 SER N N 54 117.380 117.380 116.767 0.613 25277 8876 1 20 . 1 1 54 54 SER HA H 54 4.600 4.600 4.397 0.203 25277 8877 1 20 . 1 1 54 54 SER CA C 54 56.710 56.710 57.199 -0.489 25277 8878 1 20 . 1 1 54 54 SER CB C 54 62.500 62.500 62.785 -0.285 25277 8879 1 20 . 1 1 54 54 SER H H 54 8.400 8.400 8.243 0.157 25277 8880 1 20 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.530 0.020 25277 8881 1 20 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.468 0.072 25277 8882 1 20 . 1 1 55 55 PRO CB C 55 32.620 32.620 32.199 0.421 25277 8883 1 20 . 1 1 57 57 SER HA H 57 4.420 4.420 4.276 0.144 25277 8884 1 20 . 1 1 57 57 SER CA C 57 57.580 57.580 60.078 -2.498 25277 8885 1 20 . 1 1 57 57 SER CB C 57 63.780 63.780 63.139 0.641 25277 8886 1 20 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.265 0.725 25277 8887 1 20 . 1 1 58 58 ASN C C 58 172.230 172.230 173.640 -1.410 25277 8888 1 20 . 1 1 58 58 ASN CA C 58 53.670 53.670 54.745 -1.075 25277 8889 1 20 . 1 1 58 58 ASN CB C 58 37.850 37.850 37.697 0.153 25277 8890 1 20 . 1 1 59 59 LYS N N 59 117.660 117.660 117.785 -0.125 25277 8891 1 20 . 1 1 59 59 LYS HA H 59 5.360 5.360 5.035 0.325 25277 8892 1 20 . 1 1 59 59 LYS C C 59 175.120 175.120 173.822 1.298 25277 8893 1 20 . 1 1 59 59 LYS CA C 59 54.860 54.860 55.928 -1.068 25277 8894 1 20 . 1 1 59 59 LYS CB C 59 36.450 36.450 36.643 -0.193 25277 8895 1 20 . 1 1 59 59 LYS H H 59 7.640 7.640 7.772 -0.132 25277 8896 1 20 . 1 1 60 60 GLN N N 60 120.680 120.680 121.281 -0.601 25277 8897 1 20 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.665 -0.175 25277 8898 1 20 . 1 1 60 60 GLN C C 60 173.640 173.640 173.340 0.300 25277 8899 1 20 . 1 1 60 60 GLN CA C 60 55.480 55.480 54.602 0.877 25277 8900 1 20 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.161 -0.171 25277 8901 1 20 . 1 1 60 60 GLN H H 60 8.930 8.930 8.409 0.521 25277 8902 1 20 . 1 1 61 61 ASP N N 61 126.170 126.170 121.341 4.829 25277 8903 1 20 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.855 0.195 25277 8904 1 20 . 1 1 61 61 ASP C C 61 175.000 175.000 175.205 -0.205 25277 8905 1 20 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.314 0.566 25277 8906 1 20 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.573 -0.803 25277 8907 1 20 . 1 1 61 61 ASP H H 61 8.540 8.540 8.592 -0.052 25277 8908 1 20 . 1 1 62 62 ILE N N 62 121.100 121.100 125.431 -4.331 25277 8909 1 20 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.537 0.243 25277 8910 1 20 . 1 1 62 62 ILE C C 62 171.480 171.480 173.546 -2.066 25277 8911 1 20 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.481 0.609 25277 8912 1 20 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.332 0.808 25277 8913 1 20 . 1 1 62 62 ILE H H 62 8.970 8.970 8.371 0.599 25277 8914 1 20 . 1 1 63 63 SER N N 63 119.430 119.430 121.981 -2.551 25277 8915 1 20 . 1 1 63 63 SER HA H 63 4.680 4.680 4.575 0.105 25277 8916 1 20 . 1 1 63 63 SER C C 63 174.030 174.030 174.585 -0.555 25277 8917 1 20 . 1 1 63 63 SER CA C 63 56.550 56.550 56.123 0.427 25277 8918 1 20 . 1 1 63 63 SER CB C 63 67.320 67.320 65.906 1.414 25277 8919 1 20 . 1 1 63 63 SER H H 63 8.520 8.520 8.122 0.398 25277 8920 1 20 . 1 1 64 64 GLU N N 64 121.250 121.250 119.587 1.663 25277 8921 1 20 . 1 1 64 64 GLU HA H 64 2.770 2.770 3.017 -0.247 25277 8922 1 20 . 1 1 64 64 GLU C C 64 177.190 177.190 177.939 -0.749 25277 8923 1 20 . 1 1 64 64 GLU CA C 64 58.590 58.590 58.847 -0.257 25277 8924 1 20 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.642 -0.502 25277 8925 1 20 . 1 1 64 64 GLU H H 64 7.400 7.400 7.626 -0.226 25277 8926 1 20 . 1 1 65 65 ALA N N 65 119.250 119.250 121.480 -2.230 25277 8927 1 20 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.839 0.021 25277 8928 1 20 . 1 1 65 65 ALA C C 65 179.630 179.630 179.328 0.302 25277 8929 1 20 . 1 1 65 65 ALA CA C 65 53.810 53.810 55.048 -1.238 25277 8930 1 20 . 1 1 65 65 ALA CB C 65 18.400 18.400 18.206 0.194 25277 8931 1 20 . 1 1 65 65 ALA H H 65 7.700 7.700 8.303 -0.603 25277 8932 1 20 . 1 1 66 66 ASN N N 66 112.360 112.360 115.217 -2.857 25277 8933 1 20 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.599 0.431 25277 8934 1 20 . 1 1 66 66 ASN C C 66 174.580 174.580 176.786 -2.206 25277 8935 1 20 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.751 -0.201 25277 8936 1 20 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.738 1.192 25277 8937 1 20 . 1 1 66 66 ASN H H 66 7.960 7.960 7.313 0.647 25277 8938 1 20 . 1 1 67 67 LEU N N 67 115.390 115.390 117.674 -2.284 25277 8939 1 20 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.465 0.185 25277 8940 1 20 . 1 1 67 67 LEU C C 67 176.500 176.500 176.364 0.136 25277 8941 1 20 . 1 1 67 67 LEU CA C 67 54.350 54.350 55.119 -0.769 25277 8942 1 20 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.148 2.522 25277 8943 1 20 . 1 1 67 67 LEU H H 67 7.050 7.050 7.518 -0.468 25277 8944 1 20 . 1 1 68 68 ALA N N 68 125.680 125.680 121.692 3.988 25277 8945 1 20 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.926 -0.036 25277 8946 1 20 . 1 1 68 68 ALA C C 68 177.480 177.480 177.471 0.009 25277 8947 1 20 . 1 1 68 68 ALA CA C 68 53.550 53.550 54.060 -0.511 25277 8948 1 20 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.419 -0.269 25277 8949 1 20 . 1 1 68 68 ALA H H 68 8.880 8.880 7.941 0.939 25277 8950 1 20 . 1 1 69 69 TYR N N 69 119.780 119.780 121.454 -1.674 25277 8951 1 20 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.269 0.221 25277 8952 1 20 . 1 1 69 69 TYR C C 69 175.340 175.340 176.685 -1.345 25277 8953 1 20 . 1 1 69 69 TYR CA C 69 58.640 58.640 61.041 -2.401 25277 8954 1 20 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.323 -1.043 25277 8955 1 20 . 1 1 69 69 TYR H H 69 7.420 7.420 8.581 -1.161 25277 8956 1 20 . 1 1 70 70 LEU N N 70 118.820 118.820 117.047 1.773 25277 8957 1 20 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.114 0.176 25277 8958 1 20 . 1 1 70 70 LEU C C 70 176.770 176.770 177.419 -0.649 25277 8959 1 20 . 1 1 70 70 LEU CA C 70 53.880 53.880 55.801 -1.921 25277 8960 1 20 . 1 1 70 70 LEU CB C 70 41.300 41.300 41.669 -0.369 25277 8961 1 20 . 1 1 70 70 LEU H H 70 7.690 7.690 7.556 0.134 25277 8962 1 20 . 1 1 71 71 TRP N N 71 124.110 124.110 122.449 1.661 25277 8963 1 20 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.511 0.079 25277 8964 1 20 . 1 1 71 71 TRP CA C 71 54.150 54.150 55.955 -1.805 25277 8965 1 20 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.309 -0.099 25277 8966 1 20 . 1 1 71 71 TRP H H 71 8.130 8.130 7.538 0.592 25277 8967 1 20 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.274 0.306 25277 8968 1 20 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.127 0.463 25277 8969 1 20 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.721 -1.661 25277 8970 1 20 . 1 1 73 73 LEU N N 73 118.760 118.760 117.741 1.019 25277 8971 1 20 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.576 0.824 25277 8972 1 20 . 1 1 73 73 LEU C C 73 176.620 176.620 178.329 -1.709 25277 8973 1 20 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.671 -0.621 25277 8974 1 20 . 1 1 73 73 LEU CB C 73 44.260 44.260 42.966 1.294 25277 8975 1 20 . 1 1 73 73 LEU H H 73 5.190 5.190 6.604 -1.414 25277 8976 1 20 . 1 1 74 74 THR N N 74 110.120 110.120 115.387 -5.267 25277 8977 1 20 . 1 1 74 74 THR HA H 74 4.250 4.250 4.192 0.058 25277 8978 1 20 . 1 1 74 74 THR C C 74 176.080 176.080 175.494 0.586 25277 8979 1 20 . 1 1 74 74 THR CA C 74 62.690 62.690 64.150 -1.460 25277 8980 1 20 . 1 1 74 74 THR CB C 74 67.930 67.930 69.166 -1.236 25277 8981 1 20 . 1 1 74 74 THR H H 74 9.010 9.010 8.585 0.425 25277 8982 1 20 . 1 1 75 75 VAL N N 75 113.030 113.030 118.695 -5.665 25277 8983 1 20 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.214 0.596 25277 8984 1 20 . 1 1 75 75 VAL C C 75 176.010 176.010 177.231 -1.221 25277 8985 1 20 . 1 1 75 75 VAL CA C 75 59.100 59.100 61.283 -2.183 25277 8986 1 20 . 1 1 75 75 VAL CB C 75 33.220 33.220 32.732 0.488 25277 8987 1 20 . 1 1 75 75 VAL H H 75 6.660 6.660 7.603 -0.943 25277 8988 1 20 . 1 1 76 76 ASP N N 76 119.590 119.590 121.432 -1.842 25277 8989 1 20 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.511 -0.021 25277 8990 1 20 . 1 1 76 76 ASP C C 76 175.060 175.060 175.974 -0.914 25277 8991 1 20 . 1 1 76 76 ASP CA C 76 55.110 55.110 56.665 -1.555 25277 8992 1 20 . 1 1 76 76 ASP CB C 76 41.300 41.300 40.860 0.440 25277 8993 1 20 . 1 1 76 76 ASP H H 76 8.770 8.770 8.982 -0.212 25277 8994 1 20 . 1 1 77 77 HIS N N 77 113.300 113.300 113.644 -0.344 25277 8995 1 20 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.734 0.356 25277 8996 1 20 . 1 1 77 77 HIS C C 77 171.370 171.370 173.708 -2.338 25277 8997 1 20 . 1 1 77 77 HIS CA C 77 55.590 55.590 55.009 0.581 25277 8998 1 20 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.785 -2.595 25277 8999 1 20 . 1 1 77 77 HIS H H 77 7.650 7.650 7.599 0.051 25277 9000 1 20 . 1 1 78 78 GLY N N 78 101.350 101.350 105.787 -4.437 25277 9001 1 20 . 1 1 78 78 GLY C C 78 172.110 172.110 172.104 0.006 25277 9002 1 20 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.835 -0.025 25277 9003 1 20 . 1 1 78 78 GLY H H 78 8.450 8.450 8.863 -0.413 25277 9004 1 20 . 1 1 79 79 THR N N 79 120.230 120.230 117.378 2.852 25277 9005 1 20 . 1 1 79 79 THR HA H 79 5.110 5.110 4.907 0.203 25277 9006 1 20 . 1 1 79 79 THR C C 79 172.920 172.920 173.842 -0.922 25277 9007 1 20 . 1 1 79 79 THR CA C 79 61.480 61.480 61.773 -0.293 25277 9008 1 20 . 1 1 79 79 THR CB C 79 72.130 72.130 70.919 1.211 25277 9009 1 20 . 1 1 79 79 THR H H 79 8.080 8.080 8.525 -0.445 25277 9010 1 20 . 1 1 80 80 ILE N N 80 119.620 119.620 120.590 -0.970 25277 9011 1 20 . 1 1 80 80 ILE HA H 80 5.140 5.140 4.973 0.167 25277 9012 1 20 . 1 1 80 80 ILE C C 80 174.340 174.340 173.971 0.369 25277 9013 1 20 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.296 0.054 25277 9014 1 20 . 1 1 80 80 ILE CB C 80 39.550 39.550 40.370 -0.820 25277 9015 1 20 . 1 1 80 80 ILE H H 80 8.970 8.970 8.738 0.232 25277 9016 1 20 . 1 1 81 81 GLU N N 81 119.960 119.960 125.423 -5.463 25277 9017 1 20 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.108 -0.108 25277 9018 1 20 . 1 1 81 81 GLU C C 81 176.130 176.130 174.489 1.641 25277 9019 1 20 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.740 -0.180 25277 9020 1 20 . 1 1 81 81 GLU CB C 81 33.390 33.390 34.524 -1.134 25277 9021 1 20 . 1 1 81 81 GLU H H 81 8.350 8.350 8.327 0.023 25277 9022 1 20 . 1 1 82 82 CYS N N 82 123.110 123.110 124.475 -1.365 25277 9023 1 20 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.165 -0.235 25277 9024 1 20 . 1 1 82 82 CYS C C 82 174.430 174.430 175.044 -0.614 25277 9025 1 20 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.163 -4.923 25277 9026 1 20 . 1 1 82 82 CYS CB C 82 43.720 43.720 26.936 16.784 25277 9027 1 20 . 1 1 82 82 CYS H H 82 8.220 8.220 8.399 -0.179 25277 9028 1 20 . 1 1 83 83 LEU N N 83 131.660 131.660 127.392 4.268 25277 9029 1 20 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.695 -0.165 25277 9030 1 20 . 1 1 83 83 LEU CA C 83 53.900 53.900 53.308 0.592 25277 9031 1 20 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.540 -2.340 25277 9032 1 20 . 1 1 83 83 LEU H H 83 8.910 8.910 8.227 0.683 25277 9033 1 20 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.230 0.140 25277 9034 1 20 . 1 1 84 84 PRO CA C 84 63.190 63.190 65.273 -2.083 25277 9035 1 20 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.821 0.109 25277 9036 1 20 . 1 1 85 85 SER N N 85 117.620 117.620 111.777 5.843 25277 9037 1 20 . 1 1 85 85 SER HA H 85 3.870 3.870 4.341 -0.471 25277 9038 1 20 . 1 1 85 85 SER C C 85 174.350 174.350 174.548 -0.198 25277 9039 1 20 . 1 1 85 85 SER CA C 85 58.970 58.970 58.131 0.839 25277 9040 1 20 . 1 1 85 85 SER CB C 85 63.820 63.820 62.965 0.855 25277 9041 1 20 . 1 1 85 85 SER H H 85 7.660 7.660 7.940 -0.280 25277 9042 1 20 . 1 1 86 86 ASP N N 86 117.590 117.590 117.952 -0.362 25277 9043 1 20 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.305 -0.165 25277 9044 1 20 . 1 1 86 86 ASP C C 86 174.480 174.480 174.303 0.177 25277 9045 1 20 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.714 -0.734 25277 9046 1 20 . 1 1 86 86 ASP CB C 86 37.850 37.850 38.639 -0.789 25277 9047 1 20 . 1 1 86 86 ASP H H 86 8.490 8.490 8.375 0.115 25277 9048 1 20 . 1 1 87 87 ASN N N 87 117.160 117.160 116.854 0.306 25277 9049 1 20 . 1 1 87 87 ASN HA H 87 4.530 4.530 5.034 -0.504 25277 9050 1 20 . 1 1 87 87 ASN CA C 87 52.480 52.480 51.721 0.759 25277 9051 1 20 . 1 1 87 87 ASN CB C 87 40.040 40.040 41.158 -1.118 25277 9052 1 20 . 1 1 87 87 ASN H H 87 7.260 7.260 7.880 -0.620 25277 9053 1 20 . 1 1 88 88 ALA HA H 88 4.730 4.730 4.730 0.000 25277 9054 1 20 . 1 1 88 88 ALA C C 88 174.620 174.620 176.241 -1.621 25277 9055 1 20 . 1 1 88 88 ALA CA C 88 51.230 51.230 51.004 0.226 25277 9056 1 20 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.163 0.377 25277 9057 1 20 . 1 1 89 89 VAL N N 89 116.580 116.580 117.923 -1.343 25277 9058 1 20 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.153 -0.053 25277 9059 1 20 . 1 1 89 89 VAL C C 89 172.750 172.750 173.544 -0.794 25277 9060 1 20 . 1 1 89 89 VAL CA C 89 58.980 58.980 59.457 -0.477 25277 9061 1 20 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.408 0.812 25277 9062 1 20 . 1 1 89 89 VAL H H 89 8.740 8.740 8.332 0.408 25277 9063 1 20 . 1 1 90 90 PHE N N 90 120.300 120.300 123.763 -3.463 25277 9064 1 20 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.072 0.078 25277 9065 1 20 . 1 1 90 90 PHE C C 90 172.910 172.910 173.673 -0.763 25277 9066 1 20 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.656 0.144 25277 9067 1 20 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.096 1.554 25277 9068 1 20 . 1 1 90 90 PHE H H 90 8.950 8.950 9.084 -0.134 25277 9069 1 20 . 1 1 91 91 VAL N N 91 129.020 129.020 127.866 1.154 25277 9070 1 20 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.681 -0.221 25277 9071 1 20 . 1 1 91 91 VAL C C 91 175.910 175.910 174.010 1.900 25277 9072 1 20 . 1 1 91 91 VAL CA C 91 60.780 60.780 60.641 0.139 25277 9073 1 20 . 1 1 91 91 VAL CB C 91 32.020 32.020 33.824 -1.804 25277 9074 1 20 . 1 1 91 91 VAL H H 91 9.090 9.090 8.669 0.421 25277 9075 1 20 . 1 1 92 92 ALA N N 92 129.760 129.760 129.998 -0.238 25277 9076 1 20 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.744 -0.244 25277 9077 1 20 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.792 2.058 25277 9078 1 20 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.580 -1.530 25277 9079 1 20 . 1 1 92 92 ALA H H 92 8.680 8.680 8.444 0.236 25277 9080 1 20 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.074 0.086 25277 9081 1 20 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.180 0.220 25277 9082 1 20 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.308 0.632 25277 9083 1 20 . 1 1 94 94 ASP N N 94 113.220 113.220 115.291 -2.071 25277 9084 1 20 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.461 -0.041 25277 9085 1 20 . 1 1 94 94 ASP C C 94 176.980 176.980 177.762 -0.782 25277 9086 1 20 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.684 -0.154 25277 9087 1 20 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.399 0.181 25277 9088 1 20 . 1 1 94 94 ASP H H 94 7.890 7.890 8.071 -0.181 25277 9089 1 20 . 1 1 95 95 GLY N N 95 109.120 109.120 109.149 -0.029 25277 9090 1 20 . 1 1 95 95 GLY C C 95 174.440 174.440 174.575 -0.135 25277 9091 1 20 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.187 -0.627 25277 9092 1 20 . 1 1 95 95 GLY H H 95 8.500 8.500 8.100 0.400 25277 9093 1 20 . 1 1 96 96 THR N N 96 120.350 120.350 118.181 2.169 25277 9094 1 20 . 1 1 96 96 THR HA H 96 3.780 3.780 4.365 -0.585 25277 9095 1 20 . 1 1 96 96 THR C C 96 172.590 172.590 173.404 -0.814 25277 9096 1 20 . 1 1 96 96 THR CA C 96 64.660 64.660 62.505 2.155 25277 9097 1 20 . 1 1 96 96 THR CB C 96 68.330 68.330 70.082 -1.752 25277 9098 1 20 . 1 1 96 96 THR H H 96 8.100 8.100 8.496 -0.396 25277 9099 1 20 . 1 1 97 97 THR N N 97 122.660 122.660 121.626 1.034 25277 9100 1 20 . 1 1 97 97 THR HA H 97 4.590 4.590 4.727 -0.137 25277 9101 1 20 . 1 1 97 97 THR C C 97 173.000 173.000 173.081 -0.081 25277 9102 1 20 . 1 1 97 97 THR CA C 97 62.700 62.700 61.624 1.075 25277 9103 1 20 . 1 1 97 97 THR CB C 97 68.840 68.840 69.806 -0.966 25277 9104 1 20 . 1 1 97 97 THR H H 97 7.850 7.850 8.332 -0.482 25277 9105 1 20 . 1 1 98 98 TYR N N 98 122.890 122.890 124.562 -1.672 25277 9106 1 20 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.077 -0.137 25277 9107 1 20 . 1 1 98 98 TYR C C 98 178.970 178.970 174.918 4.052 25277 9108 1 20 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.235 0.275 25277 9109 1 20 . 1 1 98 98 TYR CB C 98 42.950 42.950 41.930 1.020 25277 9110 1 20 . 1 1 98 98 TYR H H 98 9.460 9.460 9.129 0.331 25277 9111 1 20 . 1 1 99 99 ALA N N 99 121.760 121.760 123.652 -1.892 25277 9112 1 20 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.691 -0.581 25277 9113 1 20 . 1 1 99 99 ALA C C 99 178.010 178.010 176.275 1.735 25277 9114 1 20 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.261 1.008 25277 9115 1 20 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.694 2.356 25277 9116 1 20 . 1 1 99 99 ALA H H 99 9.110 9.110 8.915 0.195 25277 9117 1 20 . 1 1 100 100 LEU N N 100 119.330 119.330 124.588 -5.258 25277 9118 1 20 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.245 0.225 25277 9119 1 20 . 1 1 100 100 LEU C C 100 174.720 174.720 177.318 -2.598 25277 9120 1 20 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.505 -2.365 25277 9121 1 20 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.680 1.950 25277 9122 1 20 . 1 1 100 100 LEU H H 100 8.950 8.950 8.300 0.650 25277 9123 1 20 . 1 1 101 101 ASN N N 101 112.600 112.600 115.651 -3.051 25277 9124 1 20 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.797 0.123 25277 9125 1 20 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.373 -1.443 25277 9126 1 20 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.503 1.097 25277 9127 1 20 . 1 1 101 101 ASN H H 101 7.550 7.550 7.571 -0.021 25277 9128 1 20 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.344 -0.154 25277 9129 1 20 . 1 1 102 102 ASP C C 102 178.770 178.770 178.134 0.636 25277 9130 1 20 . 1 1 102 102 ASP CA C 102 56.880 56.880 57.438 -0.558 25277 9131 1 20 . 1 1 102 102 ASP CB C 102 39.980 39.980 40.488 -0.508 25277 9132 1 20 . 1 1 103 103 ARG N N 103 119.370 119.370 120.911 -1.541 25277 9133 1 20 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.123 -0.293 25277 9134 1 20 . 1 1 103 103 ARG C C 103 178.550 178.550 178.435 0.115 25277 9135 1 20 . 1 1 103 103 ARG CA C 103 59.380 59.380 58.873 0.507 25277 9136 1 20 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.892 -0.392 25277 9137 1 20 . 1 1 103 103 ARG H H 103 7.970 7.970 7.905 0.065 25277 9138 1 20 . 1 1 104 104 ALA N N 104 120.110 120.110 122.117 -2.007 25277 9139 1 20 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.072 0.138 25277 9140 1 20 . 1 1 104 104 ALA C C 104 179.510 179.510 179.407 0.103 25277 9141 1 20 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.251 -0.501 25277 9142 1 20 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.395 1.275 25277 9143 1 20 . 1 1 104 104 ALA H H 104 7.610 7.610 8.512 -0.902 25277 9144 1 20 . 1 1 105 105 GLU N N 105 120.460 120.460 118.375 2.085 25277 9145 1 20 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.091 0.619 25277 9146 1 20 . 1 1 105 105 GLU C C 105 181.710 181.710 179.869 1.841 25277 9147 1 20 . 1 1 105 105 GLU CA C 105 58.680 58.680 58.911 -0.231 25277 9148 1 20 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.524 -0.035 25277 9149 1 20 . 1 1 105 105 GLU H H 105 7.750 7.750 7.745 0.005 25277 9150 1 20 . 1 1 106 106 LYS N N 106 121.980 121.980 119.304 2.676 25277 9151 1 20 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.074 -0.054 25277 9152 1 20 . 1 1 106 106 LYS C C 106 177.890 177.890 178.312 -0.422 25277 9153 1 20 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.475 -0.005 25277 9154 1 20 . 1 1 106 106 LYS CB C 106 31.730 31.730 31.647 0.083 25277 9155 1 20 . 1 1 106 106 LYS H H 106 8.380 8.380 7.933 0.447 25277 9156 1 20 . 1 1 107 107 ALA N N 107 119.850 119.850 119.280 0.570 25277 9157 1 20 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.233 0.027 25277 9158 1 20 . 1 1 107 107 ALA C C 107 177.210 177.210 177.733 -0.523 25277 9159 1 20 . 1 1 107 107 ALA CA C 107 52.270 52.270 51.993 0.277 25277 9160 1 20 . 1 1 107 107 ALA CB C 107 18.740 18.740 18.583 0.157 25277 9161 1 20 . 1 1 107 107 ALA H H 107 7.400 7.400 7.621 -0.221 25277 9162 1 20 . 1 1 108 108 GLY N N 108 104.560 104.560 105.844 -1.284 25277 9163 1 20 . 1 1 108 108 GLY C C 108 174.300 174.300 174.553 -0.253 25277 9164 1 20 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.023 -0.413 25277 9165 1 20 . 1 1 108 108 GLY H H 108 7.560 7.560 7.780 -0.220 25277 9166 1 20 . 1 1 109 109 HIS N N 109 122.550 122.550 121.084 1.466 25277 9167 1 20 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.905 -0.135 25277 9168 1 20 . 1 1 109 109 HIS CA C 109 54.580 54.580 53.838 0.742 25277 9169 1 20 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.255 -0.665 25277 9170 1 20 . 1 1 109 109 HIS H H 109 7.590 7.590 7.640 -0.050 25277 9171 1 20 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.672 -0.112 25277 9172 1 20 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.203 0.527 25277 9173 1 20 . 1 1 111 111 PRO CB C 111 32.800 32.800 33.057 -0.257 25277 9174 1 20 . 1 1 112 112 ILE N N 112 119.770 119.770 120.776 -1.006 25277 9175 1 20 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.358 0.502 25277 9176 1 20 . 1 1 112 112 ILE C C 112 172.800 172.800 177.500 -4.700 25277 9177 1 20 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.500 -2.310 25277 9178 1 20 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.388 3.052 25277 9179 1 20 . 1 1 112 112 ILE H H 112 7.890 7.890 8.615 -0.725 25277 9180 1 20 . 1 1 113 113 THR N N 113 113.610 113.610 116.077 -2.467 25277 9181 1 20 . 1 1 113 113 THR HA H 113 3.010 3.010 3.995 -0.985 25277 9182 1 20 . 1 1 113 113 THR CA C 113 66.860 66.860 67.847 -0.987 25277 9183 1 20 . 1 1 113 113 THR CB C 113 66.920 66.920 67.258 -0.338 25277 9184 1 20 . 1 1 113 113 THR H H 113 7.070 7.070 8.527 -1.457 25277 9185 1 20 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.332 0.008 25277 9186 1 20 . 1 1 114 114 PRO CA C 114 66.080 66.080 65.118 0.962 25277 9187 1 20 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.479 0.601 25277 9188 1 20 . 1 1 115 115 ILE N N 115 134.770 134.770 109.779 24.991 25277 9189 1 20 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.390 0.220 25277 9190 1 20 . 1 1 115 115 ILE C C 115 174.800 174.800 174.940 -0.140 25277 9191 1 20 . 1 1 115 115 ILE CA C 115 60.000 60.000 59.994 0.006 25277 9192 1 20 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.685 0.175 25277 9193 1 20 . 1 1 115 115 ILE H H 115 7.510 7.510 7.649 -0.139 25277 9194 1 20 . 1 1 116 116 ARG N N 116 120.890 120.890 122.141 -1.251 25277 9195 1 20 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.122 -0.152 25277 9196 1 20 . 1 1 116 116 ARG C C 116 174.910 174.910 175.787 -0.877 25277 9197 1 20 . 1 1 116 116 ARG CA C 116 57.780 57.780 55.883 1.897 25277 9198 1 20 . 1 1 116 116 ARG CB C 116 31.870 31.870 31.387 0.483 25277 9199 1 20 . 1 1 116 116 ARG H H 116 7.280 7.280 7.528 -0.248 25277 9200 1 20 . 1 1 117 117 ALA N N 117 125.400 125.400 128.077 -2.677 25277 9201 1 20 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.334 -0.104 25277 9202 1 20 . 1 1 117 117 ALA C C 117 176.290 176.290 175.762 0.528 25277 9203 1 20 . 1 1 117 117 ALA CA C 117 50.780 50.780 51.181 -0.401 25277 9204 1 20 . 1 1 117 117 ALA CB C 117 20.290 20.290 20.729 -0.439 25277 9205 1 20 . 1 1 117 117 ALA H H 117 8.150 8.150 8.365 -0.215 25277 9206 1 20 . 1 1 118 118 LYS N N 118 119.890 119.890 122.465 -2.575 25277 9207 1 20 . 1 1 118 118 LYS HA H 118 4.590 4.590 3.681 0.909 25277 9208 1 20 . 1 1 118 118 LYS C C 118 177.400 177.400 176.423 0.977 25277 9209 1 20 . 1 1 118 118 LYS CA C 118 55.670 55.670 55.160 0.510 25277 9210 1 20 . 1 1 118 118 LYS CB C 118 34.510 34.510 33.418 1.092 25277 9211 1 20 . 1 1 118 118 LYS H H 118 8.360 8.360 8.273 0.087 25277 9212 1 20 . 1 1 119 119 GLY N N 119 108.630 108.630 111.938 -3.308 25277 9213 1 20 . 1 1 119 119 GLY CA C 119 43.610 43.610 43.419 0.191 25277 9214 1 20 . 1 1 119 119 GLY H H 119 8.320 8.320 7.952 0.368 25277 9215 1 20 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.746 0.154 25277 9216 1 20 . 1 1 124 124 TYR C C 124 177.430 177.430 176.467 0.963 25277 9217 1 20 . 1 1 124 124 TYR CA C 124 57.970 57.970 57.264 0.706 25277 9218 1 20 . 1 1 124 124 TYR CB C 124 38.650 38.650 40.581 -1.931 25277 9219 1 20 . 1 1 125 125 ILE N N 125 123.670 123.670 122.651 1.019 25277 9220 1 20 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.150 -0.310 25277 9221 1 20 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.407 0.323 25277 9222 1 20 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.258 0.252 25277 9223 1 20 . 1 1 125 125 ILE H H 125 8.340 8.340 8.024 0.316 25277 9224 1 20 . 1 1 126 126 SER HA H 126 4.070 4.070 4.383 -0.313 25277 9225 1 20 . 1 1 126 126 SER C C 126 176.290 176.290 174.991 1.299 25277 9226 1 20 . 1 1 126 126 SER CA C 126 59.190 59.190 59.070 0.120 25277 9227 1 20 . 1 1 126 126 SER CB C 126 63.200 63.200 63.829 -0.629 25277 9228 1 20 . 1 1 127 127 LEU N N 127 127.030 127.030 124.179 2.851 25277 9229 1 20 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.362 -0.422 25277 9230 1 20 . 1 1 127 127 LEU C C 127 176.660 176.660 178.198 -1.538 25277 9231 1 20 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.646 0.464 25277 9232 1 20 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.603 1.327 25277 9233 1 20 . 1 1 127 127 LEU H H 127 8.790 8.790 8.390 0.400 25277 9234 1 20 . 1 1 128 128 GLY N N 128 106.600 106.600 108.939 -2.339 25277 9235 1 20 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.629 0.901 25277 9236 1 20 . 1 1 128 128 GLY H H 128 8.450 8.450 8.293 0.157 25277 9237 1 20 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.041 0.189 25277 9238 1 20 . 1 1 129 129 ALA C C 129 180.410 180.410 179.228 1.182 25277 9239 1 20 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.566 0.354 25277 9240 1 20 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.302 0.828 25277 9241 1 20 . 1 1 130 130 LEU N N 130 122.550 122.550 120.601 1.949 25277 9242 1 20 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.048 -0.128 25277 9243 1 20 . 1 1 130 130 LEU C C 130 179.020 179.020 178.491 0.529 25277 9244 1 20 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.380 0.250 25277 9245 1 20 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.632 0.508 25277 9246 1 20 . 1 1 130 130 LEU H H 130 8.040 8.040 7.435 0.605 25277 9247 1 20 . 1 1 131 131 LEU N N 131 121.910 121.910 119.755 2.155 25277 9248 1 20 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.891 0.029 25277 9249 1 20 . 1 1 131 131 LEU C C 131 177.910 177.910 178.248 -0.338 25277 9250 1 20 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.216 0.354 25277 9251 1 20 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.533 -0.813 25277 9252 1 20 . 1 1 131 131 LEU H H 131 9.060 9.060 7.830 1.230 25277 9253 1 20 . 1 1 132 132 SER N N 132 115.530 115.530 114.733 0.797 25277 9254 1 20 . 1 1 132 132 SER HA H 132 3.970 3.970 4.098 -0.128 25277 9255 1 20 . 1 1 132 132 SER C C 132 177.140 177.140 176.873 0.267 25277 9256 1 20 . 1 1 132 132 SER CA C 132 62.340 62.340 62.219 0.120 25277 9257 1 20 . 1 1 132 132 SER CB C 132 62.370 62.370 62.803 -0.433 25277 9258 1 20 . 1 1 132 132 SER H H 132 8.730 8.730 8.151 0.579 25277 9259 1 20 . 1 1 133 133 THR N N 133 116.960 116.960 118.157 -1.197 25277 9260 1 20 . 1 1 133 133 THR HA H 133 3.860 3.860 4.087 -0.227 25277 9261 1 20 . 1 1 133 133 THR C C 133 175.670 175.670 176.844 -1.174 25277 9262 1 20 . 1 1 133 133 THR CA C 133 66.930 66.930 66.755 0.175 25277 9263 1 20 . 1 1 133 133 THR CB C 133 68.880 68.880 68.524 0.356 25277 9264 1 20 . 1 1 133 133 THR H H 133 7.750 7.750 7.811 -0.061 25277 9265 1 20 . 1 1 134 134 THR N N 134 118.830 118.830 118.962 -0.132 25277 9266 1 20 . 1 1 134 134 THR HA H 134 3.780 3.780 4.096 -0.316 25277 9267 1 20 . 1 1 134 134 THR C C 134 176.750 176.750 176.471 0.279 25277 9268 1 20 . 1 1 134 134 THR CA C 134 67.650 67.650 66.852 0.798 25277 9269 1 20 . 1 1 134 134 THR CB C 134 67.560 67.560 68.477 -0.917 25277 9270 1 20 . 1 1 134 134 THR H H 134 7.570 7.570 7.758 -0.188 25277 9271 1 20 . 1 1 135 135 LEU N N 135 121.420 121.420 121.882 -0.462 25277 9272 1 20 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.959 0.531 25277 9273 1 20 . 1 1 135 135 LEU C C 135 180.050 180.050 178.840 1.210 25277 9274 1 20 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.169 -1.159 25277 9275 1 20 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.239 -0.629 25277 9276 1 20 . 1 1 135 135 LEU H H 135 8.650 8.650 8.256 0.394 25277 9277 1 20 . 1 1 136 136 ASN N N 136 117.010 117.010 118.057 -1.047 25277 9278 1 20 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.443 0.097 25277 9279 1 20 . 1 1 136 136 ASN C C 136 175.980 175.980 178.250 -2.270 25277 9280 1 20 . 1 1 136 136 ASN CA C 136 54.770 54.770 56.453 -1.683 25277 9281 1 20 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.811 -0.371 25277 9282 1 20 . 1 1 136 136 ASN H H 136 7.360 7.360 7.764 -0.404 25277 9283 1 20 . 1 1 137 137 LEU N N 137 116.940 116.940 120.938 -3.998 25277 9284 1 20 . 1 1 137 137 LEU HA H 137 4.160 4.160 4.027 0.133 25277 9285 1 20 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.545 -2.115 25277 9286 1 20 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.691 -0.121 25277 9287 1 20 . 1 1 137 137 LEU H H 137 7.810 7.810 7.637 0.173 25277 9288 1 20 . 1 1 138 138 CYS N N 138 115.430 115.430 115.080 0.350 25277 9289 1 20 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.244 0.166 25277 9290 1 20 . 1 1 138 138 CYS CA C 138 55.480 55.480 60.923 -5.443 25277 9291 1 20 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.439 14.761 25277 9292 1 20 . 1 1 138 138 CYS H H 138 7.450 7.450 7.801 -0.351 25277 9293 1 20 . 1 1 139 139 GLY C C 139 178.800 178.800 173.758 5.042 25277 9294 1 20 . 1 1 139 139 GLY CA C 139 45.500 45.500 44.724 0.776 25277 9295 1 20 . 1 1 140 140 LYS N N 140 119.830 119.830 121.255 -1.425 25277 9296 1 20 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.129 0.191 25277 9297 1 20 . 1 1 140 140 LYS C C 140 175.820 175.820 176.386 -0.566 25277 9298 1 20 . 1 1 140 140 LYS CA C 140 55.680 55.680 57.268 -1.588 25277 9299 1 20 . 1 1 140 140 LYS CB C 140 32.800 32.800 32.416 0.384 25277 9300 1 20 . 1 1 140 140 LYS H H 140 7.760 7.760 7.516 0.244 25277 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 73 3.905 0.244 3.924 25277 2 1 1 "Average Difference" HA 90 0.321 -0.032 0.321 25277 3 1 1 "Average Difference" C 63 1.473 0.115 1.480 25277 4 1 1 "Average Difference" CA 92 1.322 0.288 1.298 25277 5 1 1 "Average Difference" CB 84 2.672 -0.391 2.659 25277 6 1 1 "Average Difference" HN 73 0.481 -0.013 0.484 25277 7 1 2 "Average Difference" N 73 3.869 0.052 3.896 25277 8 1 2 "Average Difference" HA 90 0.318 -0.023 0.319 25277 9 1 2 "Average Difference" C 63 1.507 0.167 1.510 25277 10 1 2 "Average Difference" CA 92 1.341 0.265 1.322 25277 11 1 2 "Average Difference" CB 84 2.645 -0.342 2.638 25277 12 1 2 "Average Difference" HN 73 0.477 0.002 0.480 25277 13 1 3 "Average Difference" N 73 3.897 0.179 3.920 25277 14 1 3 "Average Difference" HA 90 0.321 -0.031 0.321 25277 15 1 3 "Average Difference" C 63 1.518 0.158 1.522 25277 16 1 3 "Average Difference" CA 92 1.325 0.310 1.295 25277 17 1 3 "Average Difference" CB 84 2.704 -0.350 2.697 25277 18 1 3 "Average Difference" HN 73 0.495 0.004 0.498 25277 19 1 4 "Average Difference" N 73 3.923 0.017 3.950 25277 20 1 4 "Average Difference" HA 90 0.315 -0.020 0.316 25277 21 1 4 "Average Difference" C 63 1.475 0.187 1.475 25277 22 1 4 "Average Difference" CA 92 1.326 0.314 1.295 25277 23 1 4 "Average Difference" CB 84 2.668 -0.330 2.663 25277 24 1 4 "Average Difference" HN 73 0.487 0.000 0.491 25277 25 1 5 "Average Difference" N 73 3.943 0.118 3.968 25277 26 1 5 "Average Difference" HA 90 0.323 -0.030 0.323 25277 27 1 5 "Average Difference" C 63 1.489 0.183 1.490 25277 28 1 5 "Average Difference" CA 92 1.332 0.293 1.307 25277 29 1 5 "Average Difference" CB 84 2.634 -0.364 2.624 25277 30 1 5 "Average Difference" HN 73 0.481 0.011 0.485 25277 31 1 6 "Average Difference" N 73 3.889 0.019 3.915 25277 32 1 6 "Average Difference" HA 90 0.317 -0.027 0.318 25277 33 1 6 "Average Difference" C 63 1.475 0.164 1.477 25277 34 1 6 "Average Difference" CA 92 1.298 0.304 1.269 25277 35 1 6 "Average Difference" CB 84 2.628 -0.339 2.622 25277 36 1 6 "Average Difference" HN 73 0.484 0.008 0.487 25277 37 1 7 "Average Difference" N 73 3.884 0.044 3.911 25277 38 1 7 "Average Difference" HA 90 0.320 -0.029 0.320 25277 39 1 7 "Average Difference" C 63 1.463 0.168 1.465 25277 40 1 7 "Average Difference" CA 92 1.286 0.255 1.268 25277 41 1 7 "Average Difference" CB 84 2.631 -0.357 2.622 25277 42 1 7 "Average Difference" HN 73 0.495 0.007 0.498 25277 43 1 8 "Average Difference" N 73 3.863 0.138 3.887 25277 44 1 8 "Average Difference" HA 90 0.318 -0.030 0.318 25277 45 1 8 "Average Difference" C 63 1.460 0.141 1.465 25277 46 1 8 "Average Difference" CA 92 1.327 0.293 1.301 25277 47 1 8 "Average Difference" CB 84 2.643 -0.310 2.641 25277 48 1 8 "Average Difference" HN 73 0.479 0.006 0.483 25277 49 1 9 "Average Difference" N 73 3.818 -0.025 3.844 25277 50 1 9 "Average Difference" HA 90 0.307 -0.022 0.308 25277 51 1 9 "Average Difference" C 63 1.486 0.180 1.487 25277 52 1 9 "Average Difference" CA 92 1.330 0.315 1.299 25277 53 1 9 "Average Difference" CB 84 2.666 -0.348 2.659 25277 54 1 9 "Average Difference" HN 73 0.478 0.009 0.481 25277 55 1 10 "Average Difference" N 73 3.895 0.112 3.920 25277 56 1 10 "Average Difference" HA 90 0.313 -0.030 0.313 25277 57 1 10 "Average Difference" C 63 1.457 0.197 1.455 25277 58 1 10 "Average Difference" CA 92 1.316 0.310 1.287 25277 59 1 10 "Average Difference" CB 84 2.683 -0.337 2.678 25277 60 1 10 "Average Difference" HN 73 0.493 0.004 0.496 25277 61 1 11 "Average Difference" N 73 3.898 0.262 3.917 25277 62 1 11 "Average Difference" HA 90 0.322 -0.031 0.322 25277 63 1 11 "Average Difference" C 63 1.496 0.161 1.499 25277 64 1 11 "Average Difference" CA 92 1.356 0.312 1.327 25277 65 1 11 "Average Difference" CB 84 2.641 -0.384 2.628 25277 66 1 11 "Average Difference" HN 73 0.493 0.001 0.496 25277 67 1 12 "Average Difference" N 73 3.794 0.009 3.820 25277 68 1 12 "Average Difference" HA 90 0.317 -0.024 0.318 25277 69 1 12 "Average Difference" C 63 1.476 0.213 1.472 25277 70 1 12 "Average Difference" CA 92 1.309 0.296 1.283 25277 71 1 12 "Average Difference" CB 84 2.630 -0.366 2.620 25277 72 1 12 "Average Difference" HN 73 0.486 0.014 0.490 25277 73 1 13 "Average Difference" N 73 3.807 0.088 3.832 25277 74 1 13 "Average Difference" HA 90 0.319 -0.010 0.321 25277 75 1 13 "Average Difference" C 63 1.481 0.139 1.486 25277 76 1 13 "Average Difference" CA 92 1.351 0.306 1.323 25277 77 1 13 "Average Difference" CB 84 2.623 -0.373 2.612 25277 78 1 13 "Average Difference" HN 73 0.485 0.008 0.489 25277 79 1 14 "Average Difference" N 73 3.718 0.078 3.743 25277 80 1 14 "Average Difference" HA 90 0.321 -0.023 0.322 25277 81 1 14 "Average Difference" C 63 1.463 0.152 1.467 25277 82 1 14 "Average Difference" CA 92 1.302 0.298 1.274 25277 83 1 14 "Average Difference" CB 84 2.642 -0.343 2.635 25277 84 1 14 "Average Difference" HN 73 0.497 -0.008 0.500 25277 85 1 15 "Average Difference" N 73 3.896 0.207 3.918 25277 86 1 15 "Average Difference" HA 90 0.314 -0.035 0.314 25277 87 1 15 "Average Difference" C 63 1.472 0.160 1.475 25277 88 1 15 "Average Difference" CA 92 1.330 0.278 1.307 25277 89 1 15 "Average Difference" CB 84 2.675 -0.359 2.667 25277 90 1 15 "Average Difference" HN 73 0.492 -0.007 0.496 25277 91 1 16 "Average Difference" N 73 3.888 0.202 3.910 25277 92 1 16 "Average Difference" HA 90 0.319 -0.033 0.319 25277 93 1 16 "Average Difference" C 63 1.472 0.199 1.470 25277 94 1 16 "Average Difference" CA 92 1.327 0.354 1.286 25277 95 1 16 "Average Difference" CB 84 2.720 -0.369 2.711 25277 96 1 16 "Average Difference" HN 73 0.497 0.013 0.500 25277 97 1 17 "Average Difference" N 73 3.891 0.242 3.911 25277 98 1 17 "Average Difference" HA 90 0.323 -0.016 0.325 25277 99 1 17 "Average Difference" C 63 1.467 0.181 1.468 25277 100 1 17 "Average Difference" CA 92 1.335 0.286 1.311 25277 101 1 17 "Average Difference" CB 84 2.611 -0.378 2.599 25277 102 1 17 "Average Difference" HN 73 0.476 0.017 0.479 25277 103 1 18 "Average Difference" N 73 3.899 0.093 3.925 25277 104 1 18 "Average Difference" HA 90 0.321 -0.032 0.322 25277 105 1 18 "Average Difference" C 63 1.497 0.184 1.498 25277 106 1 18 "Average Difference" CA 92 1.345 0.325 1.312 25277 107 1 18 "Average Difference" CB 84 2.694 -0.365 2.686 25277 108 1 18 "Average Difference" HN 73 0.486 0.015 0.490 25277 109 1 19 "Average Difference" N 73 3.863 0.204 3.885 25277 110 1 19 "Average Difference" HA 90 0.336 -0.023 0.337 25277 111 1 19 "Average Difference" C 63 1.442 0.143 1.447 25277 112 1 19 "Average Difference" CA 92 1.343 0.285 1.320 25277 113 1 19 "Average Difference" CB 84 2.666 -0.342 2.660 25277 114 1 19 "Average Difference" HN 73 0.486 0.008 0.489 25277 115 1 20 "Average Difference" N 73 3.866 0.238 3.886 25277 116 1 20 "Average Difference" HA 90 0.320 -0.032 0.321 25277 117 1 20 "Average Difference" C 63 1.472 0.138 1.477 25277 118 1 20 "Average Difference" CA 92 1.268 0.264 1.247 25277 119 1 20 "Average Difference" CB 84 2.646 -0.393 2.633 25277 120 1 20 "Average Difference" HN 73 0.494 0.003 0.497 25277 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 25277 _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 27 27 PRO CA C 27 63.230 63.230 62.638 0.592 25277 2 1 . 1 1 27 27 PRO CB C 27 32.050 32.050 32.112 -0.062 25277 3 1 . 1 1 28 28 ASP N N 28 120.030 120.030 120.761 -0.731 25277 4 1 . 1 1 28 28 ASP C C 28 176.130 176.130 175.939 0.191 25277 5 1 . 1 1 28 28 ASP CA C 28 54.170 54.170 53.973 0.197 25277 6 1 . 1 1 28 28 ASP CB C 28 40.860 40.860 41.393 -0.533 25277 7 1 . 1 1 28 28 ASP H H 28 8.260 8.260 8.335 -0.075 25277 8 1 . 1 1 29 29 LEU N N 29 123.030 123.030 122.021 1.009 25277 9 1 . 1 1 29 29 LEU C C 29 177.870 177.870 177.425 0.445 25277 10 1 . 1 1 29 29 LEU CA C 29 55.160 55.160 54.718 0.442 25277 11 1 . 1 1 29 29 LEU CB C 29 42.270 42.270 42.857 -0.587 25277 12 1 . 1 1 29 29 LEU H H 29 8.120 8.120 8.237 -0.117 25277 13 1 . 1 1 30 30 GLY N N 30 109.350 109.350 110.942 -1.592 25277 14 1 . 1 1 30 30 GLY CA C 30 45.340 45.340 44.934 0.406 25277 15 1 . 1 1 30 30 GLY H H 30 8.410 8.410 8.424 -0.014 25277 16 1 . 1 1 44 44 PRO CA C 44 63.590 63.590 62.646 0.944 25277 17 1 . 1 1 44 44 PRO CB C 44 31.990 31.990 32.217 -0.227 25277 18 1 . 1 1 45 45 ALA N N 45 122.140 122.140 122.343 -0.203 25277 19 1 . 1 1 45 45 ALA CA C 45 52.670 52.670 51.992 0.678 25277 20 1 . 1 1 45 45 ALA H H 45 8.350 8.350 8.008 0.342 25277 21 1 . 1 1 49 49 PRO HA H 49 4.300 4.300 4.316 -0.016 25277 22 1 . 1 1 49 49 PRO CA C 49 62.950 62.950 63.090 -0.140 25277 23 1 . 1 1 49 49 PRO CB C 49 31.990 31.990 32.096 -0.106 25277 24 1 . 1 1 50 50 VAL N N 50 124.190 124.190 124.444 -0.254 25277 25 1 . 1 1 50 50 VAL HA H 50 4.320 4.320 4.322 -0.002 25277 26 1 . 1 1 50 50 VAL CA C 50 59.850 59.850 59.642 0.208 25277 27 1 . 1 1 50 50 VAL CB C 50 32.480 32.480 32.229 0.251 25277 28 1 . 1 1 50 50 VAL H H 50 8.070 8.070 8.137 -0.067 25277 29 1 . 1 1 51 51 PRO HA H 51 4.350 4.350 4.299 0.051 25277 30 1 . 1 1 51 51 PRO CA C 51 62.930 62.930 63.233 -0.303 25277 31 1 . 1 1 51 51 PRO CB C 51 31.980 31.980 32.134 -0.154 25277 32 1 . 1 1 52 52 LEU N N 52 124.500 124.500 121.929 2.571 25277 33 1 . 1 1 52 52 LEU HA H 52 4.490 4.490 4.277 0.213 25277 34 1 . 1 1 52 52 LEU CA C 52 52.890 52.890 53.783 -0.893 25277 35 1 . 1 1 52 52 LEU CB C 52 42.190 42.190 41.651 0.539 25277 36 1 . 1 1 52 52 LEU H H 52 8.360 8.360 8.203 0.157 25277 37 1 . 1 1 53 53 PRO HA H 53 4.410 4.410 4.526 -0.116 25277 38 1 . 1 1 53 53 PRO CA C 53 62.330 62.330 62.435 -0.105 25277 39 1 . 1 1 53 53 PRO CB C 53 31.990 31.990 32.246 -0.256 25277 40 1 . 1 1 54 54 SER N N 54 117.380 117.380 116.884 0.496 25277 41 1 . 1 1 54 54 SER HA H 54 4.600 4.600 4.410 0.190 25277 42 1 . 1 1 54 54 SER CA C 54 56.710 56.710 57.640 -0.930 25277 43 1 . 1 1 54 54 SER CB C 54 62.500 62.500 63.047 -0.547 25277 44 1 . 1 1 54 54 SER H H 54 8.400 8.400 8.286 0.114 25277 45 1 . 1 1 55 55 PRO HA H 55 4.550 4.550 4.552 -0.002 25277 46 1 . 1 1 55 55 PRO CA C 55 62.540 62.540 62.513 0.027 25277 47 1 . 1 1 55 55 PRO CB C 55 32.620 32.620 32.161 0.459 25277 48 1 . 1 1 57 57 SER HA H 57 4.420 4.420 4.272 0.148 25277 49 1 . 1 1 57 57 SER CA C 57 57.580 57.580 60.271 -2.691 25277 50 1 . 1 1 57 57 SER CB C 57 63.780 63.780 63.184 0.596 25277 51 1 . 1 1 58 58 ASN HA H 58 4.990 4.990 4.335 0.655 25277 52 1 . 1 1 58 58 ASN C C 58 172.230 172.230 173.815 -1.585 25277 53 1 . 1 1 58 58 ASN CA C 58 53.670 53.670 54.850 -1.180 25277 54 1 . 1 1 58 58 ASN CB C 58 37.850 37.850 37.403 0.447 25277 55 1 . 1 1 59 59 LYS N N 59 117.660 117.660 117.067 0.593 25277 56 1 . 1 1 59 59 LYS HA H 59 5.360 5.360 5.000 0.360 25277 57 1 . 1 1 59 59 LYS C C 59 175.120 175.120 174.122 0.998 25277 58 1 . 1 1 59 59 LYS CA C 59 54.860 54.860 55.748 -0.888 25277 59 1 . 1 1 59 59 LYS CB C 59 36.450 36.450 36.681 -0.231 25277 60 1 . 1 1 59 59 LYS H H 59 7.640 7.640 7.754 -0.114 25277 61 1 . 1 1 60 60 GLN N N 60 120.680 120.680 120.097 0.583 25277 62 1 . 1 1 60 60 GLN HA H 60 4.490 4.490 4.655 -0.165 25277 63 1 . 1 1 60 60 GLN C C 60 173.640 173.640 173.312 0.328 25277 64 1 . 1 1 60 60 GLN CA C 60 55.480 55.480 54.812 0.668 25277 65 1 . 1 1 60 60 GLN CB C 60 33.990 33.990 34.175 -0.185 25277 66 1 . 1 1 60 60 GLN H H 60 8.930 8.930 8.382 0.548 25277 67 1 . 1 1 61 61 ASP N N 61 126.170 126.170 121.614 4.556 25277 68 1 . 1 1 61 61 ASP HA H 61 5.050 5.050 4.843 0.207 25277 69 1 . 1 1 61 61 ASP C C 61 175.000 175.000 175.192 -0.193 25277 70 1 . 1 1 61 61 ASP CA C 61 54.880 54.880 54.332 0.548 25277 71 1 . 1 1 61 61 ASP CB C 61 40.770 40.770 41.522 -0.752 25277 72 1 . 1 1 61 61 ASP H H 61 8.540 8.540 8.574 -0.034 25277 73 1 . 1 1 62 62 ILE N N 62 121.100 121.100 125.264 -4.164 25277 74 1 . 1 1 62 62 ILE HA H 62 4.780 4.780 4.557 0.223 25277 75 1 . 1 1 62 62 ILE C C 62 171.480 171.480 173.631 -2.151 25277 76 1 . 1 1 62 62 ILE CA C 62 60.090 60.090 59.511 0.579 25277 77 1 . 1 1 62 62 ILE CB C 62 43.140 43.140 42.361 0.779 25277 78 1 . 1 1 62 62 ILE H H 62 8.970 8.970 8.403 0.567 25277 79 1 . 1 1 63 63 SER N N 63 119.430 119.430 121.301 -1.871 25277 80 1 . 1 1 63 63 SER HA H 63 4.680 4.680 4.531 0.149 25277 81 1 . 1 1 63 63 SER C C 63 174.030 174.030 174.460 -0.430 25277 82 1 . 1 1 63 63 SER CA C 63 56.550 56.550 56.497 0.053 25277 83 1 . 1 1 63 63 SER CB C 63 67.320 67.320 66.114 1.206 25277 84 1 . 1 1 63 63 SER H H 63 8.520 8.520 8.084 0.436 25277 85 1 . 1 1 64 64 GLU N N 64 121.250 121.250 119.921 1.329 25277 86 1 . 1 1 64 64 GLU HA H 64 2.770 2.770 2.967 -0.197 25277 87 1 . 1 1 64 64 GLU C C 64 177.190 177.190 177.881 -0.691 25277 88 1 . 1 1 64 64 GLU CA C 64 58.590 58.590 58.892 -0.302 25277 89 1 . 1 1 64 64 GLU CB C 64 28.140 28.140 28.628 -0.488 25277 90 1 . 1 1 64 64 GLU H H 64 7.400 7.400 7.642 -0.242 25277 91 1 . 1 1 65 65 ALA N N 65 119.250 119.250 121.866 -2.616 25277 92 1 . 1 1 65 65 ALA HA H 65 3.860 3.860 3.862 -0.002 25277 93 1 . 1 1 65 65 ALA C C 65 179.630 179.630 179.487 0.143 25277 94 1 . 1 1 65 65 ALA CA C 65 53.810 53.810 54.850 -1.040 25277 95 1 . 1 1 65 65 ALA CB C 65 18.400 18.400 18.066 0.334 25277 96 1 . 1 1 65 65 ALA H H 65 7.700 7.700 8.250 -0.551 25277 97 1 . 1 1 66 66 ASN N N 66 112.360 112.360 115.916 -3.556 25277 98 1 . 1 1 66 66 ASN HA H 66 5.030 5.030 4.488 0.542 25277 99 1 . 1 1 66 66 ASN C C 66 174.580 174.580 177.057 -2.477 25277 100 1 . 1 1 66 66 ASN CA C 66 55.550 55.550 55.663 -0.113 25277 101 1 . 1 1 66 66 ASN CB C 66 39.930 39.930 38.560 1.370 25277 102 1 . 1 1 66 66 ASN H H 66 7.960 7.960 7.431 0.529 25277 103 1 . 1 1 67 67 LEU N N 67 115.390 115.390 118.372 -2.982 25277 104 1 . 1 1 67 67 LEU HA H 67 4.650 4.650 4.301 0.349 25277 105 1 . 1 1 67 67 LEU C C 67 176.500 176.500 176.649 -0.149 25277 106 1 . 1 1 67 67 LEU CA C 67 54.350 54.350 55.752 -1.402 25277 107 1 . 1 1 67 67 LEU CB C 67 44.670 44.670 42.162 2.508 25277 108 1 . 1 1 67 67 LEU H H 67 7.050 7.050 7.532 -0.482 25277 109 1 . 1 1 68 68 ALA N N 68 125.680 125.680 120.773 4.907 25277 110 1 . 1 1 68 68 ALA HA H 68 3.890 3.890 3.786 0.104 25277 111 1 . 1 1 68 68 ALA C C 68 177.480 177.480 178.037 -0.557 25277 112 1 . 1 1 68 68 ALA CA C 68 53.550 53.550 53.529 0.021 25277 113 1 . 1 1 68 68 ALA CB C 68 17.150 17.150 17.230 -0.080 25277 114 1 . 1 1 68 68 ALA H H 68 8.880 8.880 7.983 0.897 25277 115 1 . 1 1 69 69 TYR N N 69 119.780 119.780 120.050 -0.270 25277 116 1 . 1 1 69 69 TYR HA H 69 4.490 4.490 4.300 0.190 25277 117 1 . 1 1 69 69 TYR C C 69 175.340 175.340 177.172 -1.832 25277 118 1 . 1 1 69 69 TYR CA C 69 58.640 58.640 60.803 -2.163 25277 119 1 . 1 1 69 69 TYR CB C 69 37.280 37.280 38.120 -0.840 25277 120 1 . 1 1 69 69 TYR H H 69 7.420 7.420 8.520 -1.100 25277 121 1 . 1 1 70 70 LEU N N 70 118.820 118.820 117.277 1.543 25277 122 1 . 1 1 70 70 LEU HA H 70 4.290 4.290 4.144 0.146 25277 123 1 . 1 1 70 70 LEU C C 70 176.770 176.770 177.393 -0.623 25277 124 1 . 1 1 70 70 LEU CA C 70 53.880 53.880 55.931 -2.051 25277 125 1 . 1 1 70 70 LEU CB C 70 41.300 41.300 41.806 -0.506 25277 126 1 . 1 1 70 70 LEU H H 70 7.690 7.690 7.510 0.180 25277 127 1 . 1 1 71 71 TRP N N 71 124.110 124.110 122.350 1.760 25277 128 1 . 1 1 71 71 TRP HA H 71 4.590 4.590 4.530 0.060 25277 129 1 . 1 1 71 71 TRP CA C 71 54.150 54.150 56.086 -1.936 25277 130 1 . 1 1 71 71 TRP CB C 71 30.210 30.210 30.329 -0.119 25277 131 1 . 1 1 71 71 TRP H H 71 8.130 8.130 7.684 0.446 25277 132 1 . 1 1 72 72 PRO HA H 72 4.580 4.580 4.358 0.222 25277 133 1 . 1 1 72 72 PRO CA C 72 63.590 63.590 63.166 0.424 25277 134 1 . 1 1 72 72 PRO CB C 72 31.060 31.060 32.741 -1.681 25277 135 1 . 1 1 73 73 LEU N N 73 118.760 118.760 117.790 0.970 25277 136 1 . 1 1 73 73 LEU HA H 73 5.400 5.400 4.575 0.825 25277 137 1 . 1 1 73 73 LEU C C 73 176.620 176.620 178.262 -1.642 25277 138 1 . 1 1 73 73 LEU CA C 73 53.050 53.050 53.676 -0.626 25277 139 1 . 1 1 73 73 LEU CB C 73 44.260 44.260 43.007 1.253 25277 140 1 . 1 1 73 73 LEU H H 73 5.190 5.190 6.586 -1.396 25277 141 1 . 1 1 74 74 THR N N 74 110.120 110.120 115.214 -5.094 25277 142 1 . 1 1 74 74 THR HA H 74 4.250 4.250 4.208 0.042 25277 143 1 . 1 1 74 74 THR C C 74 176.080 176.080 175.589 0.491 25277 144 1 . 1 1 74 74 THR CA C 74 62.690 62.690 64.160 -1.470 25277 145 1 . 1 1 74 74 THR CB C 74 67.930 67.930 69.216 -1.287 25277 146 1 . 1 1 74 74 THR H H 74 9.010 9.010 8.609 0.401 25277 147 1 . 1 1 75 75 VAL N N 75 113.030 113.030 118.623 -5.593 25277 148 1 . 1 1 75 75 VAL HA H 75 4.810 4.810 4.206 0.604 25277 149 1 . 1 1 75 75 VAL C C 75 176.010 176.010 177.144 -1.134 25277 150 1 . 1 1 75 75 VAL CA C 75 59.100 59.100 62.283 -3.183 25277 151 1 . 1 1 75 75 VAL CB C 75 33.220 33.220 32.621 0.599 25277 152 1 . 1 1 75 75 VAL H H 75 6.660 6.660 7.633 -0.973 25277 153 1 . 1 1 76 76 ASP N N 76 119.590 119.590 123.471 -3.881 25277 154 1 . 1 1 76 76 ASP HA H 76 4.490 4.490 4.653 -0.163 25277 155 1 . 1 1 76 76 ASP C C 76 175.060 175.060 176.172 -1.112 25277 156 1 . 1 1 76 76 ASP CA C 76 55.110 55.110 57.006 -1.896 25277 157 1 . 1 1 76 76 ASP CB C 76 41.300 41.300 41.054 0.246 25277 158 1 . 1 1 76 76 ASP H H 76 8.770 8.770 9.048 -0.278 25277 159 1 . 1 1 77 77 HIS N N 77 113.300 113.300 112.336 0.964 25277 160 1 . 1 1 77 77 HIS HA H 77 5.090 5.090 4.715 0.374 25277 161 1 . 1 1 77 77 HIS C C 77 171.370 171.370 173.825 -2.455 25277 162 1 . 1 1 77 77 HIS CA C 77 55.590 55.590 54.640 0.950 25277 163 1 . 1 1 77 77 HIS CB C 77 30.190 30.190 32.622 -2.432 25277 164 1 . 1 1 77 77 HIS H H 77 7.650 7.650 7.656 -0.006 25277 165 1 . 1 1 78 78 GLY N N 78 101.350 101.350 105.568 -4.218 25277 166 1 . 1 1 78 78 GLY C C 78 172.110 172.110 172.280 -0.170 25277 167 1 . 1 1 78 78 GLY CA C 78 45.810 45.810 45.828 -0.018 25277 168 1 . 1 1 78 78 GLY H H 78 8.450 8.450 8.755 -0.305 25277 169 1 . 1 1 79 79 THR N N 79 120.230 120.230 117.116 3.114 25277 170 1 . 1 1 79 79 THR HA H 79 5.110 5.110 4.899 0.212 25277 171 1 . 1 1 79 79 THR C C 79 172.920 172.920 173.850 -0.930 25277 172 1 . 1 1 79 79 THR CA C 79 61.480 61.480 61.864 -0.384 25277 173 1 . 1 1 79 79 THR CB C 79 72.130 72.130 70.745 1.385 25277 174 1 . 1 1 79 79 THR H H 79 8.080 8.080 8.487 -0.407 25277 175 1 . 1 1 80 80 ILE N N 80 119.620 119.620 120.560 -0.940 25277 176 1 . 1 1 80 80 ILE HA H 80 5.140 5.140 4.971 0.169 25277 177 1 . 1 1 80 80 ILE C C 80 174.340 174.340 174.117 0.223 25277 178 1 . 1 1 80 80 ILE CA C 80 59.350 59.350 59.404 -0.054 25277 179 1 . 1 1 80 80 ILE CB C 80 39.550 39.550 40.266 -0.716 25277 180 1 . 1 1 80 80 ILE H H 80 8.970 8.970 8.701 0.269 25277 181 1 . 1 1 81 81 GLU N N 81 119.960 119.960 124.647 -4.687 25277 182 1 . 1 1 81 81 GLU HA H 81 5.000 5.000 5.113 -0.113 25277 183 1 . 1 1 81 81 GLU C C 81 176.130 176.130 174.683 1.447 25277 184 1 . 1 1 81 81 GLU CA C 81 54.560 54.560 54.751 -0.191 25277 185 1 . 1 1 81 81 GLU CB C 81 33.390 33.390 34.521 -1.131 25277 186 1 . 1 1 81 81 GLU H H 81 8.350 8.350 8.303 0.047 25277 187 1 . 1 1 82 82 CYS N N 82 123.110 123.110 123.491 -0.381 25277 188 1 . 1 1 82 82 CYS HA H 82 4.930 4.930 5.109 -0.179 25277 189 1 . 1 1 82 82 CYS C C 82 174.430 174.430 174.987 -0.557 25277 190 1 . 1 1 82 82 CYS CA C 82 54.240 54.240 59.156 -4.916 25277 191 1 . 1 1 82 82 CYS CB C 82 43.720 43.720 26.854 16.867 25277 192 1 . 1 1 82 82 CYS H H 82 8.220 8.220 8.405 -0.185 25277 193 1 . 1 1 83 83 LEU N N 83 131.660 131.660 127.164 4.496 25277 194 1 . 1 1 83 83 LEU HA H 83 4.530 4.530 4.707 -0.176 25277 195 1 . 1 1 83 83 LEU CA C 83 53.900 53.900 53.047 0.853 25277 196 1 . 1 1 83 83 LEU CB C 83 40.200 40.200 42.436 -2.236 25277 197 1 . 1 1 83 83 LEU H H 83 8.910 8.910 8.179 0.731 25277 198 1 . 1 1 84 84 PRO HA H 84 4.370 4.370 4.244 0.126 25277 199 1 . 1 1 84 84 PRO CA C 84 63.190 63.190 65.101 -1.911 25277 200 1 . 1 1 84 84 PRO CB C 84 31.930 31.930 31.749 0.181 25277 201 1 . 1 1 85 85 SER N N 85 117.620 117.620 112.859 4.761 25277 202 1 . 1 1 85 85 SER HA H 85 3.870 3.870 4.390 -0.520 25277 203 1 . 1 1 85 85 SER C C 85 174.350 174.350 174.308 0.042 25277 204 1 . 1 1 85 85 SER CA C 85 58.970 58.970 58.495 0.475 25277 205 1 . 1 1 85 85 SER CB C 85 63.820 63.820 63.025 0.795 25277 206 1 . 1 1 85 85 SER H H 85 7.660 7.660 8.068 -0.408 25277 207 1 . 1 1 86 86 ASP N N 86 117.590 117.590 118.588 -0.998 25277 208 1 . 1 1 86 86 ASP HA H 86 4.140 4.140 4.325 -0.185 25277 209 1 . 1 1 86 86 ASP C C 86 174.480 174.480 174.079 0.401 25277 210 1 . 1 1 86 86 ASP CA C 86 54.980 54.980 55.605 -0.625 25277 211 1 . 1 1 86 86 ASP CB C 86 37.850 37.850 38.907 -1.057 25277 212 1 . 1 1 86 86 ASP H H 86 8.490 8.490 8.331 0.159 25277 213 1 . 1 1 87 87 ASN N N 87 117.160 117.160 116.184 0.976 25277 214 1 . 1 1 87 87 ASN HA H 87 4.530 4.530 5.052 -0.522 25277 215 1 . 1 1 87 87 ASN CA C 87 52.480 52.480 51.965 0.515 25277 216 1 . 1 1 87 87 ASN CB C 87 40.040 40.040 41.250 -1.210 25277 217 1 . 1 1 87 87 ASN H H 87 7.260 7.260 7.682 -0.422 25277 218 1 . 1 1 88 88 ALA HA H 88 4.730 4.730 4.784 -0.054 25277 219 1 . 1 1 88 88 ALA C C 88 174.620 174.620 176.268 -1.648 25277 220 1 . 1 1 88 88 ALA CA C 88 51.230 51.230 50.855 0.375 25277 221 1 . 1 1 88 88 ALA CB C 88 20.540 20.540 20.211 0.329 25277 222 1 . 1 1 89 89 VAL N N 89 116.580 116.580 118.037 -1.457 25277 223 1 . 1 1 89 89 VAL HA H 89 5.100 5.100 5.078 0.022 25277 224 1 . 1 1 89 89 VAL C C 89 172.750 172.750 173.538 -0.788 25277 225 1 . 1 1 89 89 VAL CA C 89 58.980 58.980 59.427 -0.447 25277 226 1 . 1 1 89 89 VAL CB C 89 36.220 36.220 35.428 0.793 25277 227 1 . 1 1 89 89 VAL H H 89 8.740 8.740 8.295 0.445 25277 228 1 . 1 1 90 90 PHE N N 90 120.300 120.300 123.644 -3.344 25277 229 1 . 1 1 90 90 PHE HA H 90 5.150 5.150 5.101 0.049 25277 230 1 . 1 1 90 90 PHE C C 90 172.910 172.910 173.636 -0.726 25277 231 1 . 1 1 90 90 PHE CA C 90 55.800 55.800 55.559 0.241 25277 232 1 . 1 1 90 90 PHE CB C 90 43.650 43.650 42.316 1.334 25277 233 1 . 1 1 90 90 PHE H H 90 8.950 8.950 9.046 -0.097 25277 234 1 . 1 1 91 91 VAL N N 91 129.020 129.020 128.085 0.935 25277 235 1 . 1 1 91 91 VAL HA H 91 4.460 4.460 4.646 -0.185 25277 236 1 . 1 1 91 91 VAL C C 91 175.910 175.910 174.045 1.865 25277 237 1 . 1 1 91 91 VAL CA C 91 60.780 60.780 60.309 0.471 25277 238 1 . 1 1 91 91 VAL CB C 91 32.020 32.020 33.816 -1.796 25277 239 1 . 1 1 91 91 VAL H H 91 9.090 9.090 8.664 0.426 25277 240 1 . 1 1 92 92 ALA N N 92 129.760 129.760 129.545 0.215 25277 241 1 . 1 1 92 92 ALA HA H 92 4.500 4.500 4.751 -0.251 25277 242 1 . 1 1 92 92 ALA CA C 92 50.850 50.850 48.680 2.170 25277 243 1 . 1 1 92 92 ALA CB C 92 18.050 18.050 19.494 -1.444 25277 244 1 . 1 1 92 92 ALA H H 92 8.680 8.680 8.442 0.238 25277 245 1 . 1 1 93 93 PRO HA H 93 4.160 4.160 4.067 0.093 25277 246 1 . 1 1 93 93 PRO CA C 93 65.400 65.400 65.114 0.286 25277 247 1 . 1 1 93 93 PRO CB C 93 31.940 31.940 31.512 0.428 25277 248 1 . 1 1 94 94 ASP N N 94 113.220 113.220 115.133 -1.913 25277 249 1 . 1 1 94 94 ASP HA H 94 4.420 4.420 4.460 -0.040 25277 250 1 . 1 1 94 94 ASP C C 94 176.980 176.980 177.530 -0.550 25277 251 1 . 1 1 94 94 ASP CA C 94 53.530 53.530 53.931 -0.401 25277 252 1 . 1 1 94 94 ASP CB C 94 39.580 39.580 39.773 -0.193 25277 253 1 . 1 1 94 94 ASP H H 94 7.890 7.890 7.874 0.016 25277 254 1 . 1 1 95 95 GLY N N 95 109.120 109.120 108.621 0.499 25277 255 1 . 1 1 95 95 GLY C C 95 174.440 174.440 174.358 0.082 25277 256 1 . 1 1 95 95 GLY CA C 95 44.560 44.560 45.125 -0.564 25277 257 1 . 1 1 95 95 GLY H H 95 8.500 8.500 8.156 0.344 25277 258 1 . 1 1 96 96 THR N N 96 120.350 120.350 118.293 2.057 25277 259 1 . 1 1 96 96 THR HA H 96 3.780 3.780 4.404 -0.624 25277 260 1 . 1 1 96 96 THR C C 96 172.590 172.590 173.355 -0.765 25277 261 1 . 1 1 96 96 THR CA C 96 64.660 64.660 62.060 2.600 25277 262 1 . 1 1 96 96 THR CB C 96 68.330 68.330 70.088 -1.758 25277 263 1 . 1 1 96 96 THR H H 96 8.100 8.100 8.441 -0.341 25277 264 1 . 1 1 97 97 THR N N 97 122.660 122.660 121.313 1.347 25277 265 1 . 1 1 97 97 THR HA H 97 4.590 4.590 4.747 -0.157 25277 266 1 . 1 1 97 97 THR C C 97 173.000 173.000 173.455 -0.455 25277 267 1 . 1 1 97 97 THR CA C 97 62.700 62.700 61.933 0.767 25277 268 1 . 1 1 97 97 THR CB C 97 68.840 68.840 69.824 -0.984 25277 269 1 . 1 1 97 97 THR H H 97 7.850 7.850 8.375 -0.525 25277 270 1 . 1 1 98 98 TYR N N 98 122.890 122.890 125.226 -2.336 25277 271 1 . 1 1 98 98 TYR HA H 98 4.940 4.940 5.186 -0.246 25277 272 1 . 1 1 98 98 TYR C C 98 178.970 178.970 174.792 4.178 25277 273 1 . 1 1 98 98 TYR CA C 98 56.510 56.510 56.175 0.335 25277 274 1 . 1 1 98 98 TYR CB C 98 42.950 42.950 42.020 0.930 25277 275 1 . 1 1 98 98 TYR H H 98 9.460 9.460 9.209 0.251 25277 276 1 . 1 1 99 99 ALA N N 99 121.760 121.760 123.713 -1.953 25277 277 1 . 1 1 99 99 ALA HA H 99 4.110 4.110 4.656 -0.546 25277 278 1 . 1 1 99 99 ALA C C 99 178.010 178.010 176.399 1.611 25277 279 1 . 1 1 99 99 ALA CA C 99 52.270 52.270 51.200 1.070 25277 280 1 . 1 1 99 99 ALA CB C 99 22.050 22.050 19.678 2.372 25277 281 1 . 1 1 99 99 ALA H H 99 9.110 9.110 8.874 0.236 25277 282 1 . 1 1 100 100 LEU N N 100 119.330 119.330 124.484 -5.154 25277 283 1 . 1 1 100 100 LEU HA H 100 4.470 4.470 4.240 0.230 25277 284 1 . 1 1 100 100 LEU C C 100 174.720 174.720 177.277 -2.557 25277 285 1 . 1 1 100 100 LEU CA C 100 54.140 54.140 56.639 -2.499 25277 286 1 . 1 1 100 100 LEU CB C 100 44.630 44.630 42.661 1.969 25277 287 1 . 1 1 100 100 LEU H H 100 8.950 8.950 8.332 0.618 25277 288 1 . 1 1 101 101 ASN N N 101 112.600 112.600 115.772 -3.172 25277 289 1 . 1 1 101 101 ASN HA H 101 4.920 4.920 4.848 0.073 25277 290 1 . 1 1 101 101 ASN CA C 101 49.930 49.930 51.421 -1.491 25277 291 1 . 1 1 101 101 ASN CB C 101 40.600 40.600 39.679 0.921 25277 292 1 . 1 1 101 101 ASN H H 101 7.550 7.550 7.643 -0.093 25277 293 1 . 1 1 102 102 ASP HA H 102 4.190 4.190 4.352 -0.162 25277 294 1 . 1 1 102 102 ASP C C 102 178.770 178.770 178.155 0.615 25277 295 1 . 1 1 102 102 ASP CA C 102 56.880 56.880 57.657 -0.777 25277 296 1 . 1 1 102 102 ASP CB C 102 39.980 39.980 40.790 -0.810 25277 297 1 . 1 1 103 103 ARG N N 103 119.370 119.370 119.851 -0.481 25277 298 1 . 1 1 103 103 ARG HA H 103 3.830 3.830 4.091 -0.261 25277 299 1 . 1 1 103 103 ARG C C 103 178.550 178.550 178.411 0.139 25277 300 1 . 1 1 103 103 ARG CA C 103 59.380 59.380 59.007 0.373 25277 301 1 . 1 1 103 103 ARG CB C 103 29.500 29.500 29.926 -0.426 25277 302 1 . 1 1 103 103 ARG H H 103 7.970 7.970 8.084 -0.114 25277 303 1 . 1 1 104 104 ALA N N 104 120.110 120.110 122.030 -1.920 25277 304 1 . 1 1 104 104 ALA HA H 104 4.210 4.210 4.087 0.123 25277 305 1 . 1 1 104 104 ALA C C 104 179.510 179.510 179.417 0.093 25277 306 1 . 1 1 104 104 ALA CA C 104 54.750 54.750 55.303 -0.553 25277 307 1 . 1 1 104 104 ALA CB C 104 19.670 19.670 18.339 1.331 25277 308 1 . 1 1 104 104 ALA H H 104 7.610 7.610 8.519 -0.909 25277 309 1 . 1 1 105 105 GLU N N 105 120.460 120.460 118.753 1.707 25277 310 1 . 1 1 105 105 GLU HA H 105 4.710 4.710 4.199 0.511 25277 311 1 . 1 1 105 105 GLU C C 105 181.710 181.710 179.660 2.050 25277 312 1 . 1 1 105 105 GLU CA C 105 58.680 58.680 58.873 -0.193 25277 313 1 . 1 1 105 105 GLU CB C 105 29.490 29.490 29.529 -0.039 25277 314 1 . 1 1 105 105 GLU H H 105 7.750 7.750 7.792 -0.042 25277 315 1 . 1 1 106 106 LYS N N 106 121.980 121.980 120.270 1.710 25277 316 1 . 1 1 106 106 LYS HA H 106 4.020 4.020 4.093 -0.073 25277 317 1 . 1 1 106 106 LYS C C 106 177.890 177.890 178.164 -0.274 25277 318 1 . 1 1 106 106 LYS CA C 106 58.470 58.470 58.631 -0.161 25277 319 1 . 1 1 106 106 LYS CB C 106 31.730 31.730 32.290 -0.560 25277 320 1 . 1 1 106 106 LYS H H 106 8.380 8.380 7.978 0.402 25277 321 1 . 1 1 107 107 ALA N N 107 119.850 119.850 119.151 0.699 25277 322 1 . 1 1 107 107 ALA HA H 107 4.260 4.260 4.290 -0.030 25277 323 1 . 1 1 107 107 ALA C C 107 177.210 177.210 177.600 -0.389 25277 324 1 . 1 1 107 107 ALA CA C 107 52.270 52.270 52.094 0.176 25277 325 1 . 1 1 107 107 ALA CB C 107 18.740 18.740 18.834 -0.094 25277 326 1 . 1 1 107 107 ALA H H 107 7.400 7.400 7.630 -0.230 25277 327 1 . 1 1 108 108 GLY N N 108 104.560 104.560 106.093 -1.533 25277 328 1 . 1 1 108 108 GLY C C 108 174.300 174.300 174.431 -0.131 25277 329 1 . 1 1 108 108 GLY CA C 108 44.610 44.610 45.028 -0.418 25277 330 1 . 1 1 108 108 GLY H H 108 7.560 7.560 7.801 -0.240 25277 331 1 . 1 1 109 109 HIS N N 109 122.550 122.550 120.701 1.849 25277 332 1 . 1 1 109 109 HIS HA H 109 4.770 4.770 4.927 -0.157 25277 333 1 . 1 1 109 109 HIS CA C 109 54.580 54.580 54.164 0.416 25277 334 1 . 1 1 109 109 HIS CB C 109 29.590 29.590 30.546 -0.956 25277 335 1 . 1 1 109 109 HIS H H 109 7.590 7.590 7.704 -0.114 25277 336 1 . 1 1 111 111 PRO HA H 111 4.560 4.560 4.766 -0.206 25277 337 1 . 1 1 111 111 PRO CA C 111 62.730 62.730 62.214 0.516 25277 338 1 . 1 1 111 111 PRO CB C 111 32.800 32.800 33.075 -0.275 25277 339 1 . 1 1 112 112 ILE N N 112 119.770 119.770 119.730 0.040 25277 340 1 . 1 1 112 112 ILE HA H 112 3.860 3.860 3.430 0.430 25277 341 1 . 1 1 112 112 ILE C C 112 172.800 172.800 177.511 -4.711 25277 342 1 . 1 1 112 112 ILE CA C 112 61.190 61.190 63.384 -2.194 25277 343 1 . 1 1 112 112 ILE CB C 112 40.440 40.440 37.343 3.097 25277 344 1 . 1 1 112 112 ILE H H 112 7.890 7.890 8.460 -0.570 25277 345 1 . 1 1 113 113 THR N N 113 113.610 113.610 116.161 -2.551 25277 346 1 . 1 1 113 113 THR HA H 113 3.010 3.010 3.974 -0.964 25277 347 1 . 1 1 113 113 THR CA C 113 66.860 66.860 68.014 -1.154 25277 348 1 . 1 1 113 113 THR CB C 113 66.920 66.920 67.374 -0.454 25277 349 1 . 1 1 113 113 THR H H 113 7.070 7.070 8.534 -1.464 25277 350 1 . 1 1 114 114 PRO HA H 114 4.340 4.340 4.337 0.003 25277 351 1 . 1 1 114 114 PRO CA C 114 66.080 66.080 65.061 1.019 25277 352 1 . 1 1 114 114 PRO CB C 114 32.080 32.080 31.518 0.562 25277 353 1 . 1 1 115 115 ILE N N 115 134.770 134.770 109.964 24.806 25277 354 1 . 1 1 115 115 ILE HA H 115 4.610 4.610 4.411 0.199 25277 355 1 . 1 1 115 115 ILE C C 115 174.800 174.800 174.916 -0.116 25277 356 1 . 1 1 115 115 ILE CA C 115 60.000 60.000 59.927 0.073 25277 357 1 . 1 1 115 115 ILE CB C 115 37.860 37.860 37.602 0.258 25277 358 1 . 1 1 115 115 ILE H H 115 7.510 7.510 7.590 -0.080 25277 359 1 . 1 1 116 116 ARG N N 116 120.890 120.890 122.150 -1.260 25277 360 1 . 1 1 116 116 ARG HA H 116 3.970 3.970 4.157 -0.187 25277 361 1 . 1 1 116 116 ARG C C 116 174.910 174.910 175.720 -0.810 25277 362 1 . 1 1 116 116 ARG CA C 116 57.780 57.780 55.830 1.950 25277 363 1 . 1 1 116 116 ARG CB C 116 31.870 31.870 31.233 0.637 25277 364 1 . 1 1 116 116 ARG H H 116 7.280 7.280 7.535 -0.255 25277 365 1 . 1 1 117 117 ALA N N 117 125.400 125.400 127.682 -2.282 25277 366 1 . 1 1 117 117 ALA HA H 117 4.230 4.230 4.393 -0.163 25277 367 1 . 1 1 117 117 ALA C C 117 176.290 176.290 176.003 0.287 25277 368 1 . 1 1 117 117 ALA CA C 117 50.780 50.780 51.170 -0.391 25277 369 1 . 1 1 117 117 ALA CB C 117 20.290 20.290 20.710 -0.420 25277 370 1 . 1 1 117 117 ALA H H 117 8.150 8.150 8.396 -0.246 25277 371 1 . 1 1 118 118 LYS N N 118 119.890 119.890 122.213 -2.323 25277 372 1 . 1 1 118 118 LYS HA H 118 4.590 4.590 3.828 0.762 25277 373 1 . 1 1 118 118 LYS C C 118 177.400 177.400 176.254 1.146 25277 374 1 . 1 1 118 118 LYS CA C 118 55.670 55.670 55.226 0.444 25277 375 1 . 1 1 118 118 LYS CB C 118 34.510 34.510 33.340 1.169 25277 376 1 . 1 1 118 118 LYS H H 118 8.360 8.360 8.257 0.103 25277 377 1 . 1 1 119 119 GLY N N 119 108.630 108.630 111.216 -2.587 25277 378 1 . 1 1 119 119 GLY CA C 119 43.610 43.610 43.916 -0.306 25277 379 1 . 1 1 119 119 GLY H H 119 8.320 8.320 8.030 0.290 25277 380 1 . 1 1 124 124 TYR HA H 124 4.900 4.900 4.739 0.161 25277 381 1 . 1 1 124 124 TYR C C 124 177.430 177.430 176.282 1.148 25277 382 1 . 1 1 124 124 TYR CA C 124 57.970 57.970 57.150 0.820 25277 383 1 . 1 1 124 124 TYR CB C 124 38.650 38.650 40.643 -1.993 25277 384 1 . 1 1 125 125 ILE N N 125 123.670 123.670 122.966 0.704 25277 385 1 . 1 1 125 125 ILE HA H 125 3.840 3.840 4.136 -0.295 25277 386 1 . 1 1 125 125 ILE CA C 125 61.730 61.730 61.532 0.198 25277 387 1 . 1 1 125 125 ILE CB C 125 38.510 38.510 38.375 0.135 25277 388 1 . 1 1 125 125 ILE H H 125 8.340 8.340 8.100 0.240 25277 389 1 . 1 1 126 126 SER HA H 126 4.070 4.070 4.368 -0.298 25277 390 1 . 1 1 126 126 SER C C 126 176.290 176.290 174.992 1.298 25277 391 1 . 1 1 126 126 SER CA C 126 59.190 59.190 59.064 0.126 25277 392 1 . 1 1 126 126 SER CB C 126 63.200 63.200 63.736 -0.536 25277 393 1 . 1 1 127 127 LEU N N 127 127.030 127.030 124.304 2.726 25277 394 1 . 1 1 127 127 LEU HA H 127 3.940 3.940 4.341 -0.401 25277 395 1 . 1 1 127 127 LEU C C 127 176.660 176.660 178.240 -1.580 25277 396 1 . 1 1 127 127 LEU CA C 127 55.110 55.110 54.619 0.490 25277 397 1 . 1 1 127 127 LEU CB C 127 42.930 42.930 41.653 1.277 25277 398 1 . 1 1 127 127 LEU H H 127 8.790 8.790 8.378 0.412 25277 399 1 . 1 1 128 128 GLY N N 128 106.600 106.600 108.916 -2.316 25277 400 1 . 1 1 128 128 GLY CA C 128 48.530 48.530 47.613 0.917 25277 401 1 . 1 1 128 128 GLY H H 128 8.450 8.450 8.306 0.144 25277 402 1 . 1 1 129 129 ALA HA H 129 4.230 4.230 4.057 0.173 25277 403 1 . 1 1 129 129 ALA C C 129 180.410 180.410 179.280 1.130 25277 404 1 . 1 1 129 129 ALA CA C 129 54.920 54.920 54.580 0.340 25277 405 1 . 1 1 129 129 ALA CB C 129 19.130 19.130 18.295 0.835 25277 406 1 . 1 1 130 130 LEU N N 130 122.550 122.550 120.581 1.969 25277 407 1 . 1 1 130 130 LEU HA H 130 3.920 3.920 4.043 -0.123 25277 408 1 . 1 1 130 130 LEU C C 130 179.020 179.020 178.488 0.532 25277 409 1 . 1 1 130 130 LEU CA C 130 57.630 57.630 57.393 0.237 25277 410 1 . 1 1 130 130 LEU CB C 130 42.140 42.140 41.623 0.517 25277 411 1 . 1 1 130 130 LEU H H 130 8.040 8.040 7.442 0.599 25277 412 1 . 1 1 131 131 LEU N N 131 121.910 121.910 119.465 2.445 25277 413 1 . 1 1 131 131 LEU HA H 131 3.920 3.920 3.884 0.036 25277 414 1 . 1 1 131 131 LEU C C 131 177.910 177.910 178.371 -0.461 25277 415 1 . 1 1 131 131 LEU CA C 131 58.570 58.570 58.149 0.421 25277 416 1 . 1 1 131 131 LEU CB C 131 40.720 40.720 41.495 -0.775 25277 417 1 . 1 1 131 131 LEU H H 131 9.060 9.060 7.864 1.196 25277 418 1 . 1 1 132 132 SER N N 132 115.530 115.530 114.602 0.928 25277 419 1 . 1 1 132 132 SER HA H 132 3.970 3.970 4.084 -0.114 25277 420 1 . 1 1 132 132 SER C C 132 177.140 177.140 176.770 0.370 25277 421 1 . 1 1 132 132 SER CA C 132 62.340 62.340 62.204 0.135 25277 422 1 . 1 1 132 132 SER CB C 132 62.370 62.370 62.808 -0.438 25277 423 1 . 1 1 132 132 SER H H 132 8.730 8.730 8.157 0.573 25277 424 1 . 1 1 133 133 THR N N 133 116.960 116.960 118.774 -1.814 25277 425 1 . 1 1 133 133 THR HA H 133 3.860 3.860 4.049 -0.189 25277 426 1 . 1 1 133 133 THR C C 133 175.670 175.670 176.628 -0.958 25277 427 1 . 1 1 133 133 THR CA C 133 66.930 66.930 67.119 -0.190 25277 428 1 . 1 1 133 133 THR CB C 133 68.880 68.880 68.611 0.269 25277 429 1 . 1 1 133 133 THR H H 133 7.750 7.750 7.809 -0.059 25277 430 1 . 1 1 134 134 THR N N 134 118.830 118.830 119.167 -0.337 25277 431 1 . 1 1 134 134 THR HA H 134 3.780 3.780 4.042 -0.262 25277 432 1 . 1 1 134 134 THR C C 134 176.750 176.750 176.308 0.442 25277 433 1 . 1 1 134 134 THR CA C 134 67.650 67.650 67.191 0.459 25277 434 1 . 1 1 134 134 THR CB C 134 67.560 67.560 68.535 -0.975 25277 435 1 . 1 1 134 134 THR H H 134 7.570 7.570 7.713 -0.143 25277 436 1 . 1 1 135 135 LEU N N 135 121.420 121.420 121.771 -0.351 25277 437 1 . 1 1 135 135 LEU HA H 135 4.490 4.490 3.927 0.563 25277 438 1 . 1 1 135 135 LEU C C 135 180.050 180.050 178.809 1.241 25277 439 1 . 1 1 135 135 LEU CA C 135 57.010 57.010 58.225 -1.215 25277 440 1 . 1 1 135 135 LEU CB C 135 40.610 40.610 41.430 -0.820 25277 441 1 . 1 1 135 135 LEU H H 135 8.650 8.650 8.237 0.413 25277 442 1 . 1 1 136 136 ASN N N 136 117.010 117.010 117.503 -0.493 25277 443 1 . 1 1 136 136 ASN HA H 136 4.540 4.540 4.443 0.097 25277 444 1 . 1 1 136 136 ASN C C 136 175.980 175.980 177.815 -1.835 25277 445 1 . 1 1 136 136 ASN CA C 136 54.770 54.770 55.968 -1.198 25277 446 1 . 1 1 136 136 ASN CB C 136 38.440 38.440 38.492 -0.052 25277 447 1 . 1 1 136 136 ASN H H 136 7.360 7.360 7.807 -0.447 25277 448 1 . 1 1 137 137 LEU N N 137 116.940 116.940 120.277 -3.337 25277 449 1 . 1 1 137 137 LEU HA H 137 4.160 4.160 3.993 0.167 25277 450 1 . 1 1 137 137 LEU CA C 137 55.430 55.430 57.678 -2.248 25277 451 1 . 1 1 137 137 LEU CB C 137 41.570 41.570 41.654 -0.084 25277 452 1 . 1 1 137 137 LEU H H 137 7.810 7.810 7.583 0.227 25277 453 1 . 1 1 138 138 CYS N N 138 115.430 115.430 114.931 0.499 25277 454 1 . 1 1 138 138 CYS HA H 138 4.410 4.410 4.222 0.188 25277 455 1 . 1 1 138 138 CYS CA C 138 55.480 55.480 61.097 -5.616 25277 456 1 . 1 1 138 138 CYS CB C 138 41.200 41.200 26.470 14.730 25277 457 1 . 1 1 138 138 CYS H H 138 7.450 7.450 7.904 -0.454 25277 458 1 . 1 1 139 139 GLY C C 139 178.800 178.800 174.058 4.742 25277 459 1 . 1 1 139 139 GLY CA C 139 45.500 45.500 45.073 0.427 25277 460 1 . 1 1 140 140 LYS N N 140 119.830 119.830 121.845 -2.015 25277 461 1 . 1 1 140 140 LYS HA H 140 4.320 4.320 4.458 -0.138 25277 462 1 . 1 1 140 140 LYS C C 140 175.820 175.820 176.548 -0.728 25277 463 1 . 1 1 140 140 LYS CA C 140 55.680 55.680 56.050 -0.370 25277 464 1 . 1 1 140 140 LYS CB C 140 32.800 32.800 33.207 -0.407 25277 465 1 . 1 1 140 140 LYS H H 140 7.760 7.760 7.525 0.235 25277 stop_ save_