data_25155 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25155 _Entry.PDB_ID 2MTB 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 25155 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 ASN N N 2 122.966 122.966 118.644 4.322 25155 2 1 1 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.223 -0.048 25155 3 1 1 . 1 1 2 2 ASN C C 2 175.200 175.200 173.328 1.872 25155 4 1 1 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.381 0.539 25155 5 1 1 . 1 1 2 2 ASN CB C 2 40.000 40.000 41.571 -1.571 25155 6 1 1 . 1 1 2 2 ASN H H 2 9.392 9.392 8.132 1.260 25155 7 1 1 . 1 1 3 3 MET N N 3 120.660 120.660 117.201 3.459 25155 8 1 1 . 1 1 3 3 MET HA H 3 5.565 5.565 5.133 0.432 25155 9 1 1 . 1 1 3 3 MET C C 3 174.200 174.200 175.342 -1.142 25155 10 1 1 . 1 1 3 3 MET CA C 3 54.550 54.550 54.654 -0.104 25155 11 1 1 . 1 1 3 3 MET CB C 3 34.100 34.100 36.194 -2.094 25155 12 1 1 . 1 1 3 3 MET H H 3 8.745 8.745 8.966 -0.221 25155 13 1 1 . 1 1 4 4 GLY N N 4 115.792 115.792 109.970 5.822 25155 14 1 1 . 1 1 4 4 GLY C C 4 170.444 170.444 171.824 -1.380 25155 15 1 1 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.098 -0.211 25155 16 1 1 . 1 1 4 4 GLY H H 4 8.989 8.989 9.052 -0.063 25155 17 1 1 . 1 1 5 5 LEU N N 5 131.175 131.175 125.043 6.132 25155 18 1 1 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.351 0.971 25155 19 1 1 . 1 1 5 5 LEU C C 5 175.700 175.700 174.720 0.980 25155 20 1 1 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.657 -0.337 25155 21 1 1 . 1 1 5 5 LEU CB C 5 44.700 44.700 43.824 0.876 25155 22 1 1 . 1 1 5 5 LEU H H 5 8.917 8.917 7.994 0.923 25155 23 1 1 . 1 1 6 6 PHE N N 6 125.990 125.990 125.239 0.751 25155 24 1 1 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.726 0.012 25155 25 1 1 . 1 1 6 6 PHE C C 6 174.358 174.358 173.405 0.953 25155 26 1 1 . 1 1 6 6 PHE CA C 6 55.480 55.480 55.108 0.371 25155 27 1 1 . 1 1 6 6 PHE CB C 6 41.050 41.050 42.027 -0.977 25155 28 1 1 . 1 1 6 6 PHE H H 6 9.225 9.225 9.403 -0.178 25155 29 1 1 . 1 1 7 7 TYR N N 7 118.040 118.040 117.889 0.151 25155 30 1 1 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.472 0.457 25155 31 1 1 . 1 1 7 7 TYR C C 7 171.690 171.690 174.193 -2.503 25155 32 1 1 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.077 -0.617 25155 33 1 1 . 1 1 7 7 TYR CB C 7 40.800 40.800 40.605 0.195 25155 34 1 1 . 1 1 7 7 TYR H H 7 8.235 8.235 7.916 0.319 25155 35 1 1 . 1 1 8 8 GLY N N 8 106.640 106.640 107.258 -0.618 25155 36 1 1 . 1 1 8 8 GLY C C 8 171.682 171.682 175.086 -3.404 25155 37 1 1 . 1 1 8 8 GLY CA C 8 44.050 44.050 44.346 -0.296 25155 38 1 1 . 1 1 8 8 GLY H H 8 6.996 6.996 8.797 -1.801 25155 39 1 1 . 1 1 9 9 SER N N 9 118.164 118.164 122.368 -4.204 25155 40 1 1 . 1 1 9 9 SER C C 9 174.560 174.560 175.321 -0.761 25155 41 1 1 . 1 1 9 9 SER CA C 9 57.140 57.140 61.014 -3.874 25155 42 1 1 . 1 1 9 9 SER H H 9 9.680 9.680 8.751 0.929 25155 43 1 1 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.770 -0.140 25155 44 1 1 . 1 1 17 17 ALA C C 17 177.740 177.740 178.627 -0.887 25155 45 1 1 . 1 1 17 17 ALA CA C 17 54.900 54.900 55.087 -0.186 25155 46 1 1 . 1 1 17 17 ALA CB C 17 17.790 17.790 18.131 -0.341 25155 47 1 1 . 1 1 17 17 ALA H H 17 8.055 8.055 7.949 0.106 25155 48 1 1 . 1 1 18 18 ALA N N 18 120.026 120.026 120.920 -0.894 25155 49 1 1 . 1 1 18 18 ALA HA H 18 3.713 3.713 3.900 -0.187 25155 50 1 1 . 1 1 18 18 ALA C C 18 179.040 179.040 179.736 -0.696 25155 51 1 1 . 1 1 18 18 ALA CA C 18 54.860 54.860 54.982 -0.122 25155 52 1 1 . 1 1 18 18 ALA CB C 18 18.200 18.200 17.954 0.246 25155 53 1 1 . 1 1 18 18 ALA H H 18 7.015 7.015 8.077 -1.062 25155 54 1 1 . 1 1 19 19 GLU N N 19 116.656 116.656 118.365 -1.709 25155 55 1 1 . 1 1 19 19 GLU HA H 19 3.580 3.580 3.933 -0.353 25155 56 1 1 . 1 1 19 19 GLU C C 19 178.487 178.487 179.402 -0.915 25155 57 1 1 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.790 -0.120 25155 58 1 1 . 1 1 19 19 GLU CB C 19 29.400 29.400 29.429 -0.029 25155 59 1 1 . 1 1 20 20 LYS N N 20 120.100 120.100 119.458 0.642 25155 60 1 1 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.109 0.237 25155 61 1 1 . 1 1 20 20 LYS C C 20 175.330 175.330 179.114 -3.784 25155 62 1 1 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.114 -2.014 25155 63 1 1 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.614 0.386 25155 64 1 1 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.661 -0.196 25155 65 1 1 . 1 1 21 21 ILE C C 21 177.680 177.680 177.971 -0.291 25155 66 1 1 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.798 -0.158 25155 67 1 1 . 1 1 21 21 ILE CB C 21 38.030 38.030 37.883 0.147 25155 68 1 1 . 1 1 21 21 ILE H H 21 8.220 8.220 8.669 -0.449 25155 69 1 1 . 1 1 22 22 ARG N N 22 119.433 119.433 119.657 -0.224 25155 70 1 1 . 1 1 22 22 ARG HA H 22 3.550 3.550 3.943 -0.393 25155 71 1 1 . 1 1 22 22 ARG C C 22 177.268 177.268 178.285 -1.017 25155 72 1 1 . 1 1 22 22 ARG CA C 22 59.760 59.760 59.638 0.122 25155 73 1 1 . 1 1 22 22 ARG CB C 22 28.900 28.900 29.809 -0.909 25155 74 1 1 . 1 1 23 23 ASP N N 23 118.945 118.945 119.735 -0.790 25155 75 1 1 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.455 -0.113 25155 76 1 1 . 1 1 23 23 ASP C C 23 178.470 178.470 178.836 -0.366 25155 77 1 1 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.240 0.210 25155 78 1 1 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.892 -0.523 25155 79 1 1 . 1 1 24 24 ILE N N 24 121.200 121.200 119.273 1.927 25155 80 1 1 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.828 -0.094 25155 81 1 1 . 1 1 24 24 ILE C C 24 178.297 178.297 177.918 0.379 25155 82 1 1 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.707 -0.207 25155 83 1 1 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.512 0.228 25155 84 1 1 . 1 1 24 24 ILE H H 24 8.160 8.160 8.090 0.070 25155 85 1 1 . 1 1 25 25 ILE N N 25 121.166 121.166 117.763 3.403 25155 86 1 1 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.910 -0.267 25155 87 1 1 . 1 1 25 25 ILE C C 25 176.825 176.825 176.665 0.160 25155 88 1 1 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.169 2.721 25155 89 1 1 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.853 -1.103 25155 90 1 1 . 1 1 25 25 ILE H H 25 8.480 8.480 8.076 0.404 25155 91 1 1 . 1 1 26 26 GLY N N 26 109.050 109.050 104.853 4.197 25155 92 1 1 . 1 1 26 26 GLY C C 26 173.800 173.800 172.578 1.222 25155 93 1 1 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.495 -0.095 25155 94 1 1 . 1 1 26 26 GLY H H 26 7.945 7.945 7.706 0.239 25155 95 1 1 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.477 -0.114 25155 96 1 1 . 1 1 27 27 PRO C C 27 177.157 177.157 176.997 0.160 25155 97 1 1 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.751 0.779 25155 98 1 1 . 1 1 27 27 PRO CB C 27 32.000 32.000 32.180 -0.180 25155 99 1 1 . 1 1 28 28 GLU N N 28 116.510 116.510 116.923 -0.413 25155 100 1 1 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.229 0.031 25155 101 1 1 . 1 1 28 28 GLU C C 28 177.000 177.000 177.053 -0.053 25155 102 1 1 . 1 1 28 28 GLU CA C 28 57.680 57.680 58.009 -0.329 25155 103 1 1 . 1 1 28 28 GLU CB C 28 28.620 28.620 29.240 -0.620 25155 104 1 1 . 1 1 29 29 LEU N N 29 120.334 120.334 112.308 8.026 25155 105 1 1 . 1 1 29 29 LEU HA H 29 4.650 4.650 4.765 -0.115 25155 106 1 1 . 1 1 29 29 LEU C C 29 175.676 175.676 175.076 0.600 25155 107 1 1 . 1 1 29 29 LEU CA C 29 55.924 55.924 54.956 0.968 25155 108 1 1 . 1 1 29 29 LEU CB C 29 44.880 44.880 44.199 0.681 25155 109 1 1 . 1 1 29 29 LEU H H 29 7.924 7.924 7.580 0.344 25155 110 1 1 . 1 1 30 30 VAL N N 30 118.900 118.900 120.739 -1.839 25155 111 1 1 . 1 1 30 30 VAL HA H 30 4.639 4.639 5.007 -0.368 25155 112 1 1 . 1 1 30 30 VAL C C 30 174.368 174.368 175.801 -1.433 25155 113 1 1 . 1 1 30 30 VAL CA C 30 61.110 61.110 60.555 0.555 25155 114 1 1 . 1 1 30 30 VAL CB C 30 34.500 34.500 34.137 0.363 25155 115 1 1 . 1 1 30 30 VAL H H 30 7.486 7.486 7.557 -0.071 25155 116 1 1 . 1 1 31 31 THR N N 31 124.000 124.000 120.458 3.542 25155 117 1 1 . 1 1 31 31 THR HA H 31 4.331 4.331 4.729 -0.398 25155 118 1 1 . 1 1 31 31 THR C C 31 172.670 172.670 172.919 -0.249 25155 119 1 1 . 1 1 31 31 THR CA C 31 61.784 61.784 61.227 0.557 25155 120 1 1 . 1 1 31 31 THR CB C 31 70.483 70.483 71.402 -0.919 25155 121 1 1 . 1 1 31 31 THR H H 31 7.947 7.947 8.757 -0.810 25155 122 1 1 . 1 1 32 32 LEU N N 32 127.408 127.408 125.473 1.935 25155 123 1 1 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.331 0.306 25155 124 1 1 . 1 1 32 32 LEU C C 32 176.425 176.425 176.488 -0.063 25155 125 1 1 . 1 1 32 32 LEU CA C 32 54.760 54.760 55.141 -0.381 25155 126 1 1 . 1 1 32 32 LEU CB C 32 43.809 43.809 42.735 1.074 25155 127 1 1 . 1 1 32 32 LEU H H 32 8.614 8.614 8.568 0.046 25155 128 1 1 . 1 1 33 33 HIS N N 33 120.230 120.230 122.870 -2.640 25155 129 1 1 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.695 -0.275 25155 130 1 1 . 1 1 33 33 HIS C C 33 171.914 171.914 174.234 -2.320 25155 131 1 1 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.425 0.875 25155 132 1 1 . 1 1 33 33 HIS CB C 33 32.050 32.050 30.968 1.082 25155 133 1 1 . 1 1 33 33 HIS H H 33 9.130 9.130 8.876 0.254 25155 134 1 1 . 1 1 34 34 ASN N N 34 123.987 123.987 120.764 3.223 25155 135 1 1 . 1 1 34 34 ASN HA H 34 3.600 3.600 3.766 -0.166 25155 136 1 1 . 1 1 34 34 ASN C C 34 177.930 177.930 175.512 2.418 25155 137 1 1 . 1 1 34 34 ASN CA C 34 51.730 51.730 53.275 -1.545 25155 138 1 1 . 1 1 34 34 ASN CB C 34 38.747 38.747 38.350 0.397 25155 139 1 1 . 1 1 34 34 ASN H H 34 8.759 8.759 8.335 0.424 25155 140 1 1 . 1 1 35 35 LEU N N 35 128.751 128.751 126.360 2.391 25155 141 1 1 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.116 0.174 25155 142 1 1 . 1 1 35 35 LEU C C 35 177.363 177.363 178.223 -0.860 25155 143 1 1 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.822 -0.272 25155 144 1 1 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.829 0.933 25155 145 1 1 . 1 1 35 35 LEU H H 35 8.758 8.758 7.710 1.048 25155 146 1 1 . 1 1 36 36 LYS N N 36 120.870 120.870 117.126 3.744 25155 147 1 1 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.039 -0.106 25155 148 1 1 . 1 1 36 36 LYS C C 36 176.540 176.540 177.635 -1.095 25155 149 1 1 . 1 1 36 36 LYS CA C 36 59.260 59.260 58.109 1.151 25155 150 1 1 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.157 0.643 25155 151 1 1 . 1 1 37 37 ASP N N 37 115.288 115.288 117.168 -1.880 25155 152 1 1 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.599 0.148 25155 153 1 1 . 1 1 37 37 ASP C C 37 175.500 175.500 176.169 -0.669 25155 154 1 1 . 1 1 37 37 ASP CA C 37 54.805 54.805 55.135 -0.329 25155 155 1 1 . 1 1 37 37 ASP CB C 37 44.650 44.650 42.359 2.291 25155 156 1 1 . 1 1 38 38 ASP N N 38 121.550 121.550 118.106 3.444 25155 157 1 1 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.915 -0.050 25155 158 1 1 . 1 1 38 38 ASP C C 38 174.895 174.895 174.722 0.173 25155 159 1 1 . 1 1 38 38 ASP CA C 38 52.840 52.840 53.166 -0.326 25155 160 1 1 . 1 1 38 38 ASP CB C 38 42.240 42.240 44.273 -2.033 25155 161 1 1 . 1 1 39 39 SER N N 39 115.170 115.170 117.396 -2.226 25155 162 1 1 . 1 1 39 39 SER HA H 39 4.600 4.600 4.763 -0.163 25155 163 1 1 . 1 1 39 39 SER C C 39 174.930 174.930 174.340 0.590 25155 164 1 1 . 1 1 39 39 SER CA C 39 54.786 54.786 57.152 -2.366 25155 165 1 1 . 1 1 39 39 SER CB C 39 64.840 64.840 63.283 1.557 25155 166 1 1 . 1 1 39 39 SER H H 39 8.330 8.330 8.672 -0.342 25155 167 1 1 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.466 -0.466 25155 168 1 1 . 1 1 40 40 PRO C C 40 176.620 176.620 178.017 -1.397 25155 169 1 1 . 1 1 40 40 PRO CA C 40 63.870 63.870 65.072 -1.202 25155 170 1 1 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.791 -0.431 25155 171 1 1 . 1 1 41 41 LYS N N 41 120.913 120.913 117.799 3.114 25155 172 1 1 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.167 -0.271 25155 173 1 1 . 1 1 41 41 LYS C C 41 179.580 179.580 178.576 1.004 25155 174 1 1 . 1 1 41 41 LYS CA C 41 58.000 58.000 58.181 -0.181 25155 175 1 1 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.303 0.797 25155 176 1 1 . 1 1 42 42 LEU N N 42 118.206 118.206 120.923 -2.717 25155 177 1 1 . 1 1 42 42 LEU HA H 42 4.025 4.025 4.029 -0.004 25155 178 1 1 . 1 1 42 42 LEU C C 42 178.630 178.630 178.816 -0.186 25155 179 1 1 . 1 1 42 42 LEU CA C 42 57.030 57.030 57.266 -0.236 25155 180 1 1 . 1 1 42 42 LEU CB C 42 41.820 41.820 41.005 0.815 25155 181 1 1 . 1 1 42 42 LEU H H 42 7.598 7.598 7.588 0.010 25155 182 1 1 . 1 1 43 43 MET N N 43 118.913 118.913 117.034 1.879 25155 183 1 1 . 1 1 43 43 MET HA H 43 3.760 3.760 4.065 -0.305 25155 184 1 1 . 1 1 43 43 MET C C 43 177.710 177.710 178.076 -0.366 25155 185 1 1 . 1 1 43 43 MET CA C 43 59.864 59.864 58.487 1.377 25155 186 1 1 . 1 1 43 43 MET CB C 43 32.680 32.680 31.803 0.877 25155 187 1 1 . 1 1 43 43 MET H H 43 8.180 8.180 8.010 0.170 25155 188 1 1 . 1 1 44 44 GLU N N 44 110.906 110.906 118.093 -7.187 25155 189 1 1 . 1 1 44 44 GLU HA H 44 3.732 3.732 4.001 -0.269 25155 190 1 1 . 1 1 44 44 GLU C C 44 178.120 178.120 178.883 -0.763 25155 191 1 1 . 1 1 44 44 GLU CA C 44 59.450 59.450 58.972 0.478 25155 192 1 1 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.395 0.404 25155 193 1 1 . 1 1 45 45 GLN N N 45 115.770 115.770 117.912 -2.142 25155 194 1 1 . 1 1 45 45 GLN HA H 45 4.190 4.190 3.968 0.222 25155 195 1 1 . 1 1 45 45 GLN C C 45 175.480 175.480 176.455 -0.975 25155 196 1 1 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.258 -1.157 25155 197 1 1 . 1 1 45 45 GLN CB C 45 28.490 28.490 28.796 -0.306 25155 198 1 1 . 1 1 45 45 GLN H H 45 7.517 7.517 7.487 0.030 25155 199 1 1 . 1 1 46 46 TYR N N 46 117.840 117.840 117.653 0.187 25155 200 1 1 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.481 0.179 25155 201 1 1 . 1 1 46 46 TYR C C 46 175.480 175.480 176.555 -1.075 25155 202 1 1 . 1 1 46 46 TYR CA C 46 58.827 58.827 58.283 0.544 25155 203 1 1 . 1 1 46 46 TYR CB C 46 41.720 41.720 38.431 3.289 25155 204 1 1 . 1 1 46 46 TYR H H 46 6.955 6.955 7.391 -0.436 25155 205 1 1 . 1 1 47 47 ASP N N 47 121.540 121.540 122.689 -1.149 25155 206 1 1 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.508 0.188 25155 207 1 1 . 1 1 47 47 ASP C C 47 175.677 175.677 175.730 -0.053 25155 208 1 1 . 1 1 47 47 ASP CA C 47 56.812 56.812 57.060 -0.249 25155 209 1 1 . 1 1 47 47 ASP CB C 47 42.978 42.978 41.563 1.415 25155 210 1 1 . 1 1 48 48 VAL N N 48 118.666 118.666 116.318 2.348 25155 211 1 1 . 1 1 48 48 VAL HA H 48 5.057 5.057 4.931 0.126 25155 212 1 1 . 1 1 48 48 VAL C C 48 174.180 174.180 174.162 0.018 25155 213 1 1 . 1 1 48 48 VAL CA C 48 60.000 60.000 60.760 -0.760 25155 214 1 1 . 1 1 48 48 VAL CB C 48 36.200 36.200 34.291 1.909 25155 215 1 1 . 1 1 48 48 VAL H H 48 7.631 7.631 7.939 -0.308 25155 216 1 1 . 1 1 49 49 LEU N N 49 128.300 128.300 127.987 0.313 25155 217 1 1 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.066 0.534 25155 218 1 1 . 1 1 49 49 LEU C C 49 174.810 174.810 175.127 -0.317 25155 219 1 1 . 1 1 49 49 LEU CA C 49 52.230 52.230 53.890 -1.660 25155 220 1 1 . 1 1 49 49 LEU CB C 49 45.400 45.400 45.170 0.230 25155 221 1 1 . 1 1 49 49 LEU H H 49 9.469 9.469 8.893 0.576 25155 222 1 1 . 1 1 50 50 ILE N N 50 124.400 124.400 127.595 -3.195 25155 223 1 1 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.717 0.933 25155 224 1 1 . 1 1 50 50 ILE C C 50 175.286 175.286 174.382 0.904 25155 225 1 1 . 1 1 50 50 ILE CA C 50 59.900 59.900 61.422 -1.522 25155 226 1 1 . 1 1 50 50 ILE CB C 50 40.200 40.200 39.556 0.644 25155 227 1 1 . 1 1 50 50 ILE H H 50 9.213 9.213 9.223 -0.010 25155 228 1 1 . 1 1 51 51 LEU N N 51 127.410 127.410 129.195 -1.785 25155 229 1 1 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.764 1.306 25155 230 1 1 . 1 1 51 51 LEU C C 51 174.540 174.540 174.533 0.007 25155 231 1 1 . 1 1 51 51 LEU CA C 51 52.950 52.950 52.526 0.424 25155 232 1 1 . 1 1 51 51 LEU CB C 51 43.190 43.190 45.210 -2.020 25155 233 1 1 . 1 1 51 51 LEU H H 51 9.256 9.256 9.046 0.210 25155 234 1 1 . 1 1 52 52 GLY N N 52 108.290 108.290 113.375 -5.085 25155 235 1 1 . 1 1 52 52 GLY C C 52 174.330 174.330 171.153 3.177 25155 236 1 1 . 1 1 52 52 GLY CA C 52 44.040 44.040 43.293 0.747 25155 237 1 1 . 1 1 52 52 GLY H H 52 8.949 8.949 8.456 0.493 25155 238 1 1 . 1 1 53 53 ILE N N 53 124.912 124.912 122.456 2.456 25155 239 1 1 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.357 -0.182 25155 240 1 1 . 1 1 53 53 ILE C C 53 174.470 174.470 172.624 1.846 25155 241 1 1 . 1 1 53 53 ILE CA C 53 55.850 55.850 57.718 -1.868 25155 242 1 1 . 1 1 53 53 ILE CB C 53 42.800 42.800 41.977 0.823 25155 243 1 1 . 1 1 53 53 ILE H H 53 8.612 8.612 7.923 0.689 25155 244 1 1 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.663 0.149 25155 245 1 1 . 1 1 54 54 PRO C C 54 174.565 174.565 175.951 -1.386 25155 246 1 1 . 1 1 54 54 PRO CA C 54 61.850 61.850 62.439 -0.589 25155 247 1 1 . 1 1 54 54 PRO CB C 54 32.400 32.400 32.173 0.227 25155 248 1 1 . 1 1 55 55 THR N N 55 116.040 116.040 118.797 -2.757 25155 249 1 1 . 1 1 55 55 THR HA H 55 4.522 4.522 4.288 0.234 25155 250 1 1 . 1 1 55 55 THR C C 55 173.990 173.990 174.448 -0.458 25155 251 1 1 . 1 1 55 55 THR CA C 55 62.845 62.845 61.937 0.908 25155 252 1 1 . 1 1 55 55 THR CB C 55 70.795 70.795 69.823 0.972 25155 253 1 1 . 1 1 55 55 THR H H 55 7.663 7.663 8.561 -0.898 25155 254 1 1 . 1 1 56 56 TRP N N 56 130.540 130.540 128.282 2.258 25155 255 1 1 . 1 1 56 56 TRP CA C 56 54.800 54.800 58.006 -3.206 25155 256 1 1 . 1 1 56 56 TRP H H 56 9.075 9.075 8.719 0.356 25155 257 1 1 . 1 1 58 58 PHE HA H 58 4.540 4.540 4.433 0.107 25155 258 1 1 . 1 1 58 58 PHE C C 58 177.070 177.070 174.598 2.472 25155 259 1 1 . 1 1 58 58 PHE CA C 58 55.460 55.460 59.068 -3.608 25155 260 1 1 . 1 1 58 58 PHE CB C 58 41.200 41.200 40.130 1.070 25155 261 1 1 . 1 1 59 59 GLY N N 59 109.796 109.796 104.450 5.346 25155 262 1 1 . 1 1 59 59 GLY CA C 59 45.763 45.763 43.310 2.453 25155 263 1 1 . 1 1 59 59 GLY H H 59 8.392 8.392 7.011 1.381 25155 264 1 1 . 1 1 60 60 GLU C C 60 175.660 175.660 176.402 -0.742 25155 265 1 1 . 1 1 61 61 ILE N N 61 122.380 122.380 121.884 0.496 25155 266 1 1 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.396 1.044 25155 267 1 1 . 1 1 61 61 ILE CA C 61 62.100 62.100 61.312 0.787 25155 268 1 1 . 1 1 61 61 ILE CB C 61 38.750 38.750 36.389 2.361 25155 269 1 1 . 1 1 61 61 ILE H H 61 8.436 8.436 8.221 0.215 25155 270 1 1 . 1 1 62 62 GLN CB C 62 30.570 30.570 29.153 1.417 25155 271 1 1 . 1 1 63 63 GLU HA H 63 4.030 4.030 3.965 0.065 25155 272 1 1 . 1 1 63 63 GLU C C 63 177.134 177.134 178.190 -1.056 25155 273 1 1 . 1 1 63 63 GLU CA C 63 60.520 60.520 59.657 0.863 25155 274 1 1 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.605 0.045 25155 275 1 1 . 1 1 64 64 ASP N N 64 119.630 119.630 118.851 0.779 25155 276 1 1 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.427 0.165 25155 277 1 1 . 1 1 64 64 ASP C C 64 178.680 178.680 177.732 0.948 25155 278 1 1 . 1 1 64 64 ASP CA C 64 57.823 57.823 56.955 0.868 25155 279 1 1 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.556 0.544 25155 280 1 1 . 1 1 65 65 TRP N N 65 120.535 120.535 121.916 -1.381 25155 281 1 1 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.534 -0.209 25155 282 1 1 . 1 1 65 65 TRP C C 65 178.684 178.684 177.476 1.208 25155 283 1 1 . 1 1 65 65 TRP CA C 65 60.500 60.500 61.175 -0.675 25155 284 1 1 . 1 1 65 65 TRP CB C 65 30.100 30.100 30.553 -0.453 25155 285 1 1 . 1 1 65 65 TRP H H 65 7.416 7.416 7.986 -0.570 25155 286 1 1 . 1 1 66 66 GLU N N 66 120.760 120.760 120.847 -0.087 25155 287 1 1 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.237 -0.417 25155 288 1 1 . 1 1 66 66 GLU C C 66 178.860 178.860 178.877 -0.017 25155 289 1 1 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.821 0.279 25155 290 1 1 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.550 -0.540 25155 291 1 1 . 1 1 67 67 ALA N N 67 118.972 118.972 121.389 -2.417 25155 292 1 1 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.207 0.040 25155 293 1 1 . 1 1 67 67 ALA C C 67 179.610 179.610 178.922 0.688 25155 294 1 1 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.803 -0.203 25155 295 1 1 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.886 -0.098 25155 296 1 1 . 1 1 67 67 ALA H H 67 7.690 7.690 8.495 -0.805 25155 297 1 1 . 1 1 68 68 VAL N N 68 107.530 107.530 110.158 -2.628 25155 298 1 1 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.274 0.436 25155 299 1 1 . 1 1 68 68 VAL C C 68 176.800 176.800 177.097 -0.297 25155 300 1 1 . 1 1 68 68 VAL CA C 68 60.060 60.060 62.174 -2.114 25155 301 1 1 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.810 -0.210 25155 302 1 1 . 1 1 68 68 VAL H H 68 7.240 7.240 7.515 -0.275 25155 303 1 1 . 1 1 69 69 TRP N N 69 126.960 126.960 125.604 1.356 25155 304 1 1 . 1 1 69 69 TRP HA H 69 4.182 4.182 3.987 0.195 25155 305 1 1 . 1 1 69 69 TRP C C 69 178.640 178.640 176.764 1.876 25155 306 1 1 . 1 1 69 69 TRP CA C 69 61.300 61.300 62.182 -0.882 25155 307 1 1 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.297 2.273 25155 308 1 1 . 1 1 69 69 TRP H H 69 7.810 7.810 8.369 -0.559 25155 309 1 1 . 1 1 70 70 ASP N N 70 114.644 114.644 116.581 -1.937 25155 310 1 1 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.201 0.318 25155 311 1 1 . 1 1 70 70 ASP C C 70 178.685 178.685 178.106 0.579 25155 312 1 1 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.437 -0.437 25155 313 1 1 . 1 1 70 70 ASP CB C 70 39.810 39.810 40.994 -1.184 25155 314 1 1 . 1 1 71 71 GLN N N 71 120.100 120.100 116.955 3.145 25155 315 1 1 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.237 -0.047 25155 316 1 1 . 1 1 71 71 GLN C C 71 178.870 178.870 178.218 0.652 25155 317 1 1 . 1 1 71 71 GLN CA C 71 57.617 57.617 57.049 0.568 25155 318 1 1 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.530 -0.710 25155 319 1 1 . 1 1 71 71 GLN H H 71 7.980 7.980 7.923 0.057 25155 320 1 1 . 1 1 72 72 LEU N N 72 117.535 117.535 120.131 -2.596 25155 321 1 1 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.948 -0.151 25155 322 1 1 . 1 1 72 72 LEU C C 72 178.308 178.308 178.044 0.264 25155 323 1 1 . 1 1 72 72 LEU CA C 72 57.340 57.340 57.051 0.289 25155 324 1 1 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.531 0.169 25155 325 1 1 . 1 1 72 72 LEU H H 72 7.435 7.435 7.688 -0.253 25155 326 1 1 . 1 1 73 73 ASP N N 73 115.534 115.534 117.459 -1.925 25155 327 1 1 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.424 -0.274 25155 328 1 1 . 1 1 73 73 ASP C C 73 177.553 177.553 176.894 0.659 25155 329 1 1 . 1 1 73 73 ASP CA C 73 57.350 57.350 55.899 1.451 25155 330 1 1 . 1 1 73 73 ASP CB C 73 40.040 40.040 41.624 -1.584 25155 331 1 1 . 1 1 74 74 ASP N N 74 117.300 117.300 120.304 -3.004 25155 332 1 1 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.471 0.235 25155 333 1 1 . 1 1 74 74 ASP C C 74 176.424 176.424 177.166 -0.742 25155 334 1 1 . 1 1 74 74 ASP CA C 74 54.170 54.170 55.562 -1.393 25155 335 1 1 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.312 0.508 25155 336 1 1 . 1 1 75 75 LEU N N 75 118.500 118.500 119.570 -1.070 25155 337 1 1 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.129 0.166 25155 338 1 1 . 1 1 75 75 LEU C C 75 176.800 176.800 177.222 -0.422 25155 339 1 1 . 1 1 75 75 LEU CA C 75 54.400 54.400 55.293 -0.893 25155 340 1 1 . 1 1 75 75 LEU CB C 75 43.280 43.280 41.799 1.481 25155 341 1 1 . 1 1 75 75 LEU H H 75 6.966 6.966 7.317 -0.351 25155 342 1 1 . 1 1 76 76 ASN N N 76 123.040 123.040 120.643 2.397 25155 343 1 1 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.459 0.403 25155 344 1 1 . 1 1 76 76 ASN C C 76 174.927 174.927 176.270 -1.343 25155 345 1 1 . 1 1 76 76 ASN CA C 76 51.881 51.881 55.487 -3.606 25155 346 1 1 . 1 1 76 76 ASN CB C 76 37.510 37.510 39.481 -1.971 25155 347 1 1 . 1 1 76 76 ASN H H 76 9.882 9.882 9.223 0.659 25155 348 1 1 . 1 1 77 77 LEU N N 77 123.614 123.614 113.994 9.620 25155 349 1 1 . 1 1 77 77 LEU HA H 77 4.370 4.370 3.939 0.431 25155 350 1 1 . 1 1 77 77 LEU C C 77 175.110 175.110 175.665 -0.555 25155 351 1 1 . 1 1 77 77 LEU CA C 77 52.200 52.200 55.645 -3.445 25155 352 1 1 . 1 1 77 77 LEU CB C 77 42.786 42.786 39.866 2.920 25155 353 1 1 . 1 1 77 77 LEU H H 77 8.700 8.700 8.321 0.379 25155 354 1 1 . 1 1 78 78 GLU N N 78 120.822 120.822 120.064 0.758 25155 355 1 1 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.279 -0.379 25155 356 1 1 . 1 1 78 78 GLU C C 78 178.670 178.670 177.871 0.799 25155 357 1 1 . 1 1 78 78 GLU CA C 78 58.700 58.700 57.744 0.956 25155 358 1 1 . 1 1 78 78 GLU CB C 78 29.467 29.467 29.659 -0.192 25155 359 1 1 . 1 1 79 79 GLY N N 79 113.160 113.160 113.549 -0.389 25155 360 1 1 . 1 1 79 79 GLY C C 79 174.523 174.523 174.077 0.446 25155 361 1 1 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.630 -0.211 25155 362 1 1 . 1 1 79 79 GLY H H 79 8.450 8.450 8.491 -0.041 25155 363 1 1 . 1 1 80 80 LYS N N 80 120.283 120.283 119.771 0.512 25155 364 1 1 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.358 0.000 25155 365 1 1 . 1 1 80 80 LYS C C 80 175.304 175.304 176.034 -0.730 25155 366 1 1 . 1 1 80 80 LYS CA C 80 56.890 56.890 56.101 0.789 25155 367 1 1 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.747 -0.627 25155 368 1 1 . 1 1 81 81 ILE N N 81 122.288 122.288 121.010 1.278 25155 369 1 1 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.247 0.559 25155 370 1 1 . 1 1 81 81 ILE C C 81 174.750 174.750 175.469 -0.719 25155 371 1 1 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.458 -1.638 25155 372 1 1 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.356 0.493 25155 373 1 1 . 1 1 81 81 ILE H H 81 7.405 7.405 8.107 -0.702 25155 374 1 1 . 1 1 82 82 VAL N N 82 127.793 127.793 125.186 2.607 25155 375 1 1 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.070 0.210 25155 376 1 1 . 1 1 82 82 VAL C C 82 172.680 172.680 174.105 -1.425 25155 377 1 1 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.157 -0.057 25155 378 1 1 . 1 1 82 82 VAL CB C 82 35.280 35.280 36.542 -1.262 25155 379 1 1 . 1 1 82 82 VAL H H 82 8.800 8.800 9.028 -0.228 25155 380 1 1 . 1 1 83 83 ALA N N 83 130.911 130.911 128.235 2.676 25155 381 1 1 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.490 -0.101 25155 382 1 1 . 1 1 83 83 ALA C C 83 175.870 175.870 176.153 -0.283 25155 383 1 1 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.563 0.437 25155 384 1 1 . 1 1 83 83 ALA CB C 83 23.722 23.722 22.331 1.391 25155 385 1 1 . 1 1 83 83 ALA H H 83 9.252 9.252 8.604 0.648 25155 386 1 1 . 1 1 84 84 LEU N N 84 124.269 124.269 122.331 1.938 25155 387 1 1 . 1 1 84 84 LEU HA H 84 5.508 5.508 5.560 -0.052 25155 388 1 1 . 1 1 84 84 LEU C C 84 175.490 175.490 176.121 -0.631 25155 389 1 1 . 1 1 84 84 LEU CA C 84 53.670 53.670 53.477 0.193 25155 390 1 1 . 1 1 84 84 LEU CB C 84 45.000 45.000 44.859 0.141 25155 391 1 1 . 1 1 84 84 LEU H H 84 10.378 10.378 9.037 1.341 25155 392 1 1 . 1 1 85 85 TYR N N 85 115.826 115.826 117.809 -1.983 25155 393 1 1 . 1 1 85 85 TYR HA H 85 4.950 4.950 5.223 -0.273 25155 394 1 1 . 1 1 85 85 TYR C C 85 172.661 172.661 173.546 -0.885 25155 395 1 1 . 1 1 85 85 TYR CA C 85 55.853 55.853 55.725 0.128 25155 396 1 1 . 1 1 85 85 TYR CB C 85 43.200 43.200 41.213 1.987 25155 397 1 1 . 1 1 85 85 TYR H H 85 9.200 9.200 8.724 0.476 25155 398 1 1 . 1 1 86 86 GLY N N 86 106.802 106.802 105.230 1.572 25155 399 1 1 . 1 1 86 86 GLY C C 86 170.348 170.348 170.941 -0.593 25155 400 1 1 . 1 1 86 86 GLY CA C 86 44.687 44.687 44.100 0.587 25155 401 1 1 . 1 1 86 86 GLY H H 86 8.752 8.752 8.570 0.182 25155 402 1 1 . 1 1 87 87 LEU N N 87 120.860 120.860 120.340 0.520 25155 403 1 1 . 1 1 87 87 LEU HA H 87 5.476 5.476 5.180 0.296 25155 404 1 1 . 1 1 87 87 LEU C C 87 177.720 177.720 174.968 2.752 25155 405 1 1 . 1 1 87 87 LEU CA C 87 52.630 52.630 52.643 -0.013 25155 406 1 1 . 1 1 87 87 LEU CB C 87 45.900 45.900 45.333 0.567 25155 407 1 1 . 1 1 87 87 LEU H H 87 6.320 6.320 7.679 -1.359 25155 408 1 1 . 1 1 88 88 GLY N N 88 109.910 109.910 109.076 0.834 25155 409 1 1 . 1 1 88 88 GLY C C 88 171.386 171.386 171.354 0.032 25155 410 1 1 . 1 1 88 88 GLY CA C 88 45.710 45.710 45.809 -0.099 25155 411 1 1 . 1 1 88 88 GLY H H 88 8.320 8.320 8.252 0.068 25155 412 1 1 . 1 1 89 89 ASP N N 89 121.580 121.580 118.747 2.833 25155 413 1 1 . 1 1 89 89 ASP HA H 89 5.190 5.190 5.113 0.077 25155 414 1 1 . 1 1 89 89 ASP C C 89 176.608 176.608 175.960 0.648 25155 415 1 1 . 1 1 89 89 ASP CA C 89 52.200 52.200 53.423 -1.223 25155 416 1 1 . 1 1 89 89 ASP CB C 89 41.900 41.900 42.991 -1.091 25155 417 1 1 . 1 1 90 90 GLN N N 90 123.900 123.900 124.554 -0.654 25155 418 1 1 . 1 1 90 90 GLN HA H 90 3.645 3.645 4.131 -0.486 25155 419 1 1 . 1 1 90 90 GLN C C 90 173.523 173.523 175.674 -2.151 25155 420 1 1 . 1 1 90 90 GLN CA C 90 58.706 58.706 57.708 0.998 25155 421 1 1 . 1 1 90 90 GLN CB C 90 28.800 28.800 28.285 0.515 25155 422 1 1 . 1 1 90 90 GLN H H 90 8.726 8.726 8.696 0.030 25155 423 1 1 . 1 1 91 91 LEU N N 91 117.080 117.080 119.272 -2.192 25155 424 1 1 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.123 0.347 25155 425 1 1 . 1 1 91 91 LEU C C 91 179.840 179.840 178.461 1.379 25155 426 1 1 . 1 1 91 91 LEU CA C 91 55.800 55.800 56.393 -0.593 25155 427 1 1 . 1 1 91 91 LEU CB C 91 41.640 41.640 42.023 -0.383 25155 428 1 1 . 1 1 91 91 LEU H H 91 7.092 7.092 8.401 -1.309 25155 429 1 1 . 1 1 92 92 GLY N N 92 110.460 110.460 104.731 5.729 25155 430 1 1 . 1 1 92 92 GLY C C 92 174.824 174.824 174.856 -0.032 25155 431 1 1 . 1 1 92 92 GLY CA C 92 46.390 46.390 45.761 0.629 25155 432 1 1 . 1 1 92 92 GLY H H 92 9.243 9.243 8.630 0.613 25155 433 1 1 . 1 1 93 93 TYR N N 93 118.140 118.140 120.514 -2.374 25155 434 1 1 . 1 1 93 93 TYR HA H 93 5.173 5.173 4.786 0.387 25155 435 1 1 . 1 1 93 93 TYR C C 93 177.805 177.805 176.509 1.296 25155 436 1 1 . 1 1 93 93 TYR CA C 93 57.430 57.430 59.544 -2.114 25155 437 1 1 . 1 1 93 93 TYR CB C 93 39.300 39.300 39.330 -0.030 25155 438 1 1 . 1 1 93 93 TYR H H 93 7.252 7.252 7.923 -0.671 25155 439 1 1 . 1 1 94 94 GLY N N 94 112.455 112.455 105.913 6.542 25155 440 1 1 . 1 1 94 94 GLY C C 94 177.740 177.740 174.509 3.231 25155 441 1 1 . 1 1 94 94 GLY CA C 94 49.880 49.880 44.672 5.207 25155 442 1 1 . 1 1 94 94 GLY H H 94 8.154 8.154 8.264 -0.110 25155 443 1 1 . 1 1 95 95 GLU N N 95 123.040 123.040 120.355 2.685 25155 444 1 1 . 1 1 95 95 GLU HA H 95 4.000 4.000 3.754 0.246 25155 445 1 1 . 1 1 95 95 GLU C C 95 175.145 175.145 177.360 -2.215 25155 446 1 1 . 1 1 95 95 GLU CA C 95 57.950 57.950 59.128 -1.178 25155 447 1 1 . 1 1 95 95 GLU CB C 95 27.400 27.400 28.364 -0.964 25155 448 1 1 . 1 1 96 96 TRP N N 96 118.000 118.000 119.130 -1.130 25155 449 1 1 . 1 1 96 96 TRP HA H 96 5.213 5.213 4.753 0.460 25155 450 1 1 . 1 1 96 96 TRP C C 96 176.616 176.616 176.082 0.534 25155 451 1 1 . 1 1 96 96 TRP CA C 96 57.120 57.120 56.571 0.549 25155 452 1 1 . 1 1 96 96 TRP CB C 96 29.970 29.970 28.160 1.810 25155 453 1 1 . 1 1 96 96 TRP H H 96 7.785 7.785 7.677 0.108 25155 454 1 1 . 1 1 97 97 PHE N N 97 123.268 123.268 121.476 1.792 25155 455 1 1 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.410 0.250 25155 456 1 1 . 1 1 97 97 PHE CA C 97 58.742 58.742 58.468 0.274 25155 457 1 1 . 1 1 97 97 PHE CB C 97 40.835 40.835 40.194 0.641 25155 458 1 1 . 1 1 97 97 PHE H H 97 7.054 7.054 7.751 -0.697 25155 459 1 1 . 1 1 98 98 LEU HA H 98 3.440 3.440 3.479 -0.039 25155 460 1 1 . 1 1 98 98 LEU C C 98 176.613 176.613 176.810 -0.197 25155 461 1 1 . 1 1 98 98 LEU CA C 98 56.000 56.000 55.003 0.997 25155 462 1 1 . 1 1 98 98 LEU CB C 98 38.600 38.600 39.189 -0.589 25155 463 1 1 . 1 1 98 98 LEU H H 98 8.584 8.584 8.174 0.410 25155 464 1 1 . 1 1 99 99 ASP N N 99 123.268 123.268 120.092 3.176 25155 465 1 1 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.343 -0.378 25155 466 1 1 . 1 1 99 99 ASP C C 99 178.876 178.876 176.983 1.893 25155 467 1 1 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.352 1.908 25155 468 1 1 . 1 1 99 99 ASP CB C 99 40.350 40.350 41.191 -0.841 25155 469 1 1 . 1 1 100 100 ALA N N 100 119.124 119.124 121.795 -2.671 25155 470 1 1 . 1 1 100 100 ALA HA H 100 3.822 3.822 4.039 -0.217 25155 471 1 1 . 1 1 100 100 ALA C C 100 178.490 178.490 179.300 -0.810 25155 472 1 1 . 1 1 100 100 ALA CA C 100 55.100 55.100 54.802 0.298 25155 473 1 1 . 1 1 100 100 ALA CB C 100 19.700 19.700 18.004 1.696 25155 474 1 1 . 1 1 100 100 ALA H H 100 8.400 8.400 7.736 0.664 25155 475 1 1 . 1 1 101 101 LEU N N 101 118.687 118.687 120.338 -1.651 25155 476 1 1 . 1 1 101 101 LEU HA H 101 3.674 3.674 3.949 -0.275 25155 477 1 1 . 1 1 101 101 LEU C C 101 179.050 179.050 178.703 0.347 25155 478 1 1 . 1 1 101 101 LEU CA C 101 57.800 57.800 57.181 0.619 25155 479 1 1 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.612 1.038 25155 480 1 1 . 1 1 101 101 LEU H H 101 6.518 6.518 7.206 -0.688 25155 481 1 1 . 1 1 102 102 GLY N N 102 104.410 104.410 106.529 -2.119 25155 482 1 1 . 1 1 102 102 GLY C C 102 176.056 176.056 176.077 -0.021 25155 483 1 1 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.357 0.393 25155 484 1 1 . 1 1 102 102 GLY H H 102 7.712 7.712 8.234 -0.522 25155 485 1 1 . 1 1 103 103 MET N N 103 120.550 120.550 121.717 -1.167 25155 486 1 1 . 1 1 103 103 MET HA H 103 4.256 4.256 4.404 -0.148 25155 487 1 1 . 1 1 103 103 MET C C 103 179.650 179.650 178.411 1.239 25155 488 1 1 . 1 1 103 103 MET CA C 103 59.450 59.450 59.603 -0.153 25155 489 1 1 . 1 1 103 103 MET CB C 103 32.300 32.300 32.858 -0.558 25155 490 1 1 . 1 1 103 103 MET H H 103 8.485 8.485 8.293 0.192 25155 491 1 1 . 1 1 104 104 LEU N N 104 123.480 123.480 120.459 3.021 25155 492 1 1 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.319 -0.258 25155 493 1 1 . 1 1 104 104 LEU C C 104 177.750 177.750 179.129 -1.379 25155 494 1 1 . 1 1 104 104 LEU CA C 104 58.100 58.100 58.026 0.074 25155 495 1 1 . 1 1 104 104 LEU CB C 104 41.450 41.450 41.358 0.092 25155 496 1 1 . 1 1 104 104 LEU H H 104 8.392 8.392 8.187 0.205 25155 497 1 1 . 1 1 105 105 HIS N N 105 119.570 119.570 120.668 -1.098 25155 498 1 1 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.182 -0.330 25155 499 1 1 . 1 1 105 105 HIS C C 105 177.550 177.550 176.814 0.736 25155 500 1 1 . 1 1 105 105 HIS CA C 105 61.000 61.000 60.091 0.909 25155 501 1 1 . 1 1 105 105 HIS CB C 105 28.820 28.820 29.577 -0.757 25155 502 1 1 . 1 1 105 105 HIS H H 105 8.247 8.247 8.818 -0.571 25155 503 1 1 . 1 1 106 106 ASP N N 106 119.780 119.780 119.553 0.227 25155 504 1 1 . 1 1 106 106 ASP HA H 106 4.333 4.333 3.951 0.382 25155 505 1 1 . 1 1 106 106 ASP C C 106 179.410 179.410 178.521 0.889 25155 506 1 1 . 1 1 106 106 ASP CA C 106 57.800 57.800 56.988 0.812 25155 507 1 1 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.037 -0.437 25155 508 1 1 . 1 1 107 107 LYS N N 107 121.660 121.660 118.786 2.874 25155 509 1 1 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.066 0.034 25155 510 1 1 . 1 1 107 107 LYS C C 107 178.316 178.316 178.655 -0.339 25155 511 1 1 . 1 1 107 107 LYS CA C 107 58.750 58.750 59.053 -0.303 25155 512 1 1 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.606 -0.756 25155 513 1 1 . 1 1 108 108 LEU N N 108 116.050 116.050 118.260 -2.210 25155 514 1 1 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.378 -0.368 25155 515 1 1 . 1 1 108 108 LEU C C 108 179.050 179.050 178.262 0.788 25155 516 1 1 . 1 1 108 108 LEU CA C 108 56.240 56.240 56.347 -0.107 25155 517 1 1 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.393 -0.593 25155 518 1 1 . 1 1 108 108 LEU H H 108 8.072 8.072 7.769 0.303 25155 519 1 1 . 1 1 109 109 SER N N 109 116.280 116.280 114.952 1.328 25155 520 1 1 . 1 1 109 109 SER HA H 109 4.300 4.300 4.395 -0.095 25155 521 1 1 . 1 1 109 109 SER C C 109 175.848 175.848 176.049 -0.201 25155 522 1 1 . 1 1 109 109 SER CA C 109 62.410 62.410 62.032 0.378 25155 523 1 1 . 1 1 109 109 SER CB C 109 62.850 62.850 63.138 -0.288 25155 524 1 1 . 1 1 109 109 SER H H 109 8.366 8.366 8.291 0.075 25155 525 1 1 . 1 1 110 110 THR N N 110 110.416 110.416 110.083 0.333 25155 526 1 1 . 1 1 110 110 THR HA H 110 4.614 4.614 4.382 0.232 25155 527 1 1 . 1 1 110 110 THR C C 110 175.675 175.675 175.780 -0.105 25155 528 1 1 . 1 1 110 110 THR CA C 110 62.030 62.030 63.787 -1.757 25155 529 1 1 . 1 1 110 110 THR CB C 110 68.810 68.810 68.921 -0.111 25155 530 1 1 . 1 1 110 110 THR H H 110 7.185 7.185 7.887 -0.702 25155 531 1 1 . 1 1 111 111 LYS N N 111 120.090 120.090 120.602 -0.512 25155 532 1 1 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.385 0.128 25155 533 1 1 . 1 1 111 111 LYS C C 111 176.814 176.814 176.660 0.154 25155 534 1 1 . 1 1 111 111 LYS CA C 111 55.730 55.730 55.737 -0.007 25155 535 1 1 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.442 -1.512 25155 536 1 1 . 1 1 112 112 GLY N N 112 107.540 107.540 107.486 0.054 25155 537 1 1 . 1 1 112 112 GLY C C 112 176.223 176.223 174.466 1.757 25155 538 1 1 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.228 1.698 25155 539 1 1 . 1 1 112 112 GLY H H 112 8.315 8.315 7.530 0.785 25155 540 1 1 . 1 1 113 113 VAL N N 113 113.536 113.536 116.245 -2.709 25155 541 1 1 . 1 1 113 113 VAL HA H 113 4.494 4.494 4.511 -0.017 25155 542 1 1 . 1 1 113 113 VAL C C 113 174.560 174.560 175.026 -0.466 25155 543 1 1 . 1 1 113 113 VAL CA C 113 59.550 59.550 60.882 -1.332 25155 544 1 1 . 1 1 113 113 VAL CB C 113 32.800 32.800 32.073 0.727 25155 545 1 1 . 1 1 113 113 VAL H H 113 6.835 6.835 7.077 -0.241 25155 546 1 1 . 1 1 114 114 LYS N N 114 122.920 122.920 121.088 1.832 25155 547 1 1 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.353 0.141 25155 548 1 1 . 1 1 114 114 LYS C C 114 174.925 174.925 174.988 -0.063 25155 549 1 1 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.291 -0.011 25155 550 1 1 . 1 1 114 114 LYS CB C 114 33.630 33.630 33.477 0.153 25155 551 1 1 . 1 1 115 115 PHE N N 115 123.140 123.140 124.950 -1.810 25155 552 1 1 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.152 0.548 25155 553 1 1 . 1 1 115 115 PHE C C 115 177.580 177.580 175.784 1.796 25155 554 1 1 . 1 1 115 115 PHE CA C 115 58.677 58.677 57.139 1.538 25155 555 1 1 . 1 1 115 115 PHE CB C 115 41.120 41.120 39.667 1.453 25155 556 1 1 . 1 1 115 115 PHE H H 115 8.506 8.506 8.511 -0.005 25155 557 1 1 . 1 1 116 116 VAL N N 116 115.737 115.737 117.017 -1.280 25155 558 1 1 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.223 0.255 25155 559 1 1 . 1 1 116 116 VAL C C 116 175.300 175.300 176.055 -0.755 25155 560 1 1 . 1 1 116 116 VAL CA C 116 58.877 58.877 59.654 -0.777 25155 561 1 1 . 1 1 116 116 VAL CB C 116 34.120 34.120 33.246 0.874 25155 562 1 1 . 1 1 116 116 VAL H H 116 8.860 8.860 8.700 0.160 25155 563 1 1 . 1 1 117 117 GLY N N 117 108.137 108.137 110.616 -2.479 25155 564 1 1 . 1 1 117 117 GLY C C 117 176.110 176.110 174.189 1.921 25155 565 1 1 . 1 1 117 117 GLY CA C 117 47.500 47.500 45.012 2.488 25155 566 1 1 . 1 1 117 117 GLY H H 117 9.838 9.838 9.304 0.534 25155 567 1 1 . 1 1 118 118 TYR N N 118 120.380 120.380 119.815 0.565 25155 568 1 1 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.511 0.459 25155 569 1 1 . 1 1 118 118 TYR C C 118 177.630 177.630 174.992 2.638 25155 570 1 1 . 1 1 118 118 TYR CA C 118 55.800 55.800 59.883 -4.083 25155 571 1 1 . 1 1 118 118 TYR CB C 118 35.970 35.970 37.661 -1.691 25155 572 1 1 . 1 1 118 118 TYR H H 118 8.652 8.652 7.940 0.712 25155 573 1 1 . 1 1 119 119 TRP N N 119 126.040 126.040 118.057 7.983 25155 574 1 1 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.144 0.877 25155 575 1 1 . 1 1 119 119 TRP C C 119 173.000 173.000 173.862 -0.862 25155 576 1 1 . 1 1 119 119 TRP CA C 119 53.820 53.820 56.071 -2.251 25155 577 1 1 . 1 1 119 119 TRP CB C 119 36.050 36.050 33.283 2.767 25155 578 1 1 . 1 1 119 119 TRP H H 119 8.070 8.070 8.361 -0.291 25155 579 1 1 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.526 0.258 25155 580 1 1 . 1 1 120 120 PRO C C 120 176.870 176.870 176.829 0.041 25155 581 1 1 . 1 1 120 120 PRO CA C 120 63.780 63.780 63.319 0.461 25155 582 1 1 . 1 1 120 120 PRO CB C 120 31.990 31.990 31.899 0.091 25155 583 1 1 . 1 1 121 121 THR N N 121 109.310 109.310 115.398 -6.088 25155 584 1 1 . 1 1 121 121 THR HA H 121 4.073 4.073 3.981 0.092 25155 585 1 1 . 1 1 121 121 THR C C 121 176.324 176.324 174.878 1.446 25155 586 1 1 . 1 1 121 121 THR CA C 121 61.250 61.250 63.419 -2.169 25155 587 1 1 . 1 1 121 121 THR CB C 121 69.730 69.730 68.994 0.736 25155 588 1 1 . 1 1 121 121 THR H H 121 7.370 7.370 8.325 -0.955 25155 589 1 1 . 1 1 122 122 GLU N N 122 123.937 123.937 122.140 1.797 25155 590 1 1 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.100 0.124 25155 591 1 1 . 1 1 122 122 GLU C C 122 177.737 177.737 177.706 0.031 25155 592 1 1 . 1 1 122 122 GLU CA C 122 58.200 58.200 58.252 -0.052 25155 593 1 1 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.277 0.523 25155 594 1 1 . 1 1 123 123 GLY N N 123 114.563 114.563 111.897 2.666 25155 595 1 1 . 1 1 123 123 GLY C C 123 173.783 173.783 174.116 -0.333 25155 596 1 1 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.059 0.320 25155 597 1 1 . 1 1 123 123 GLY H H 123 9.144 9.144 8.917 0.227 25155 598 1 1 . 1 1 124 124 TYR N N 124 118.800 118.800 121.320 -2.520 25155 599 1 1 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.700 0.518 25155 600 1 1 . 1 1 124 124 TYR C C 124 175.673 175.673 175.182 0.491 25155 601 1 1 . 1 1 124 124 TYR CA C 124 56.950 56.950 57.761 -0.811 25155 602 1 1 . 1 1 124 124 TYR CB C 124 41.100 41.100 40.679 0.421 25155 603 1 1 . 1 1 124 124 TYR H H 124 7.895 7.895 8.090 -0.195 25155 604 1 1 . 1 1 125 125 GLU N N 125 124.790 124.790 121.887 2.903 25155 605 1 1 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.648 0.037 25155 606 1 1 . 1 1 125 125 GLU C C 125 172.877 172.877 175.277 -2.400 25155 607 1 1 . 1 1 125 125 GLU CA C 125 55.700 55.700 55.580 0.120 25155 608 1 1 . 1 1 125 125 GLU CB C 125 31.340 31.340 31.147 0.193 25155 609 1 1 . 1 1 126 126 PHE N N 126 118.670 118.670 119.865 -1.195 25155 610 1 1 . 1 1 126 126 PHE HA H 126 4.841 4.841 4.890 -0.049 25155 611 1 1 . 1 1 126 126 PHE C C 126 173.800 173.800 174.421 -0.621 25155 612 1 1 . 1 1 126 126 PHE CA C 126 56.950 56.950 57.904 -0.954 25155 613 1 1 . 1 1 126 126 PHE CB C 126 40.300 40.300 39.839 0.461 25155 614 1 1 . 1 1 126 126 PHE H H 126 7.645 7.645 7.653 -0.008 25155 615 1 1 . 1 1 127 127 THR N N 127 107.038 107.038 113.814 -6.776 25155 616 1 1 . 1 1 127 127 THR HA H 127 4.370 4.370 4.510 -0.140 25155 617 1 1 . 1 1 127 127 THR C C 127 175.100 175.100 173.435 1.665 25155 618 1 1 . 1 1 127 127 THR CA C 127 61.080 61.080 61.786 -0.706 25155 619 1 1 . 1 1 127 127 THR CB C 127 70.500 70.500 69.128 1.372 25155 620 1 1 . 1 1 127 127 THR H H 127 7.306 7.306 8.635 -1.329 25155 621 1 1 . 1 1 128 128 SER N N 128 118.150 118.150 117.691 0.459 25155 622 1 1 . 1 1 128 128 SER HA H 128 4.650 4.650 4.753 -0.103 25155 623 1 1 . 1 1 128 128 SER C C 128 175.760 175.760 173.697 2.063 25155 624 1 1 . 1 1 128 128 SER CA C 128 55.813 55.813 56.871 -1.058 25155 625 1 1 . 1 1 128 128 SER CB C 128 65.300 65.300 64.267 1.033 25155 626 1 1 . 1 1 128 128 SER H H 128 7.354 7.354 7.836 -0.482 25155 627 1 1 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.510 0.254 25155 628 1 1 . 1 1 129 129 PRO C C 129 178.860 178.860 178.486 0.374 25155 629 1 1 . 1 1 129 129 PRO CA C 129 62.728 62.728 64.353 -1.625 25155 630 1 1 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.428 -0.028 25155 631 1 1 . 1 1 130 130 LYS N N 130 122.158 122.158 119.615 2.543 25155 632 1 1 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.217 -0.007 25155 633 1 1 . 1 1 130 130 LYS C C 130 176.890 176.890 175.453 1.437 25155 634 1 1 . 1 1 130 130 LYS CA C 130 61.375 61.375 60.713 0.662 25155 635 1 1 . 1 1 130 130 LYS CB C 130 30.350 30.350 31.146 -0.796 25155 636 1 1 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.486 0.047 25155 637 1 1 . 1 1 131 131 PRO C C 131 173.810 173.810 175.801 -1.991 25155 638 1 1 . 1 1 131 131 PRO CA C 131 64.510 64.510 63.122 1.388 25155 639 1 1 . 1 1 131 131 PRO CB C 131 31.745 31.745 31.383 0.362 25155 640 1 1 . 1 1 132 132 VAL N N 132 114.480 114.480 114.228 0.252 25155 641 1 1 . 1 1 132 132 VAL HA H 132 5.158 5.158 5.019 0.139 25155 642 1 1 . 1 1 132 132 VAL C C 132 175.137 175.137 173.783 1.354 25155 643 1 1 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.424 0.376 25155 644 1 1 . 1 1 132 132 VAL CB C 132 34.780 34.780 35.669 -0.889 25155 645 1 1 . 1 1 132 132 VAL H H 132 6.716 6.716 7.577 -0.861 25155 646 1 1 . 1 1 133 133 ILE N N 133 120.670 120.670 112.872 7.798 25155 647 1 1 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.540 -0.148 25155 648 1 1 . 1 1 133 133 ILE C C 133 175.485 175.485 174.985 0.500 25155 649 1 1 . 1 1 133 133 ILE CA C 133 60.000 60.000 59.158 0.842 25155 650 1 1 . 1 1 133 133 ILE CB C 133 42.020 42.020 41.232 0.788 25155 651 1 1 . 1 1 133 133 ILE H H 133 8.740 8.740 8.410 0.330 25155 652 1 1 . 1 1 134 134 ALA N N 134 122.454 122.454 121.001 1.453 25155 653 1 1 . 1 1 134 134 ALA HA H 134 3.953 3.953 3.979 -0.026 25155 654 1 1 . 1 1 134 134 ALA C C 134 178.387 178.387 177.204 1.183 25155 655 1 1 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.197 -0.146 25155 656 1 1 . 1 1 134 134 ALA CB C 134 16.982 16.982 17.180 -0.198 25155 657 1 1 . 1 1 134 134 ALA H H 134 8.490 8.490 8.676 -0.186 25155 658 1 1 . 1 1 135 135 ASP N N 135 117.310 117.310 117.001 0.309 25155 659 1 1 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.338 -0.094 25155 660 1 1 . 1 1 135 135 ASP C C 135 176.390 176.390 176.223 0.167 25155 661 1 1 . 1 1 135 135 ASP CA C 135 55.120 55.120 54.771 0.349 25155 662 1 1 . 1 1 135 135 ASP CB C 135 39.865 39.865 39.762 0.103 25155 663 1 1 . 1 1 136 136 GLY N N 136 104.336 104.336 103.866 0.470 25155 664 1 1 . 1 1 136 136 GLY C C 136 174.940 174.940 175.366 -0.426 25155 665 1 1 . 1 1 136 136 GLY CA C 136 45.150 45.150 45.321 -0.170 25155 666 1 1 . 1 1 136 136 GLY H H 136 7.592 7.592 8.039 -0.447 25155 667 1 1 . 1 1 137 137 GLN N N 137 118.675 118.675 119.540 -0.865 25155 668 1 1 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.399 -0.337 25155 669 1 1 . 1 1 137 137 GLN C C 137 176.420 176.420 175.126 1.294 25155 670 1 1 . 1 1 137 137 GLN CA C 137 57.760 57.760 57.144 0.616 25155 671 1 1 . 1 1 137 137 GLN CB C 137 30.400 30.400 29.932 0.468 25155 672 1 1 . 1 1 137 137 GLN H H 137 7.843 7.843 7.558 0.285 25155 673 1 1 . 1 1 138 138 LEU N N 138 118.160 118.160 118.535 -0.375 25155 674 1 1 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.835 0.126 25155 675 1 1 . 1 1 138 138 LEU C C 138 175.700 175.700 174.872 0.828 25155 676 1 1 . 1 1 138 138 LEU CA C 138 53.705 53.705 53.121 0.584 25155 677 1 1 . 1 1 138 138 LEU CB C 138 46.480 46.480 45.746 0.734 25155 678 1 1 . 1 1 138 138 LEU H H 138 7.356 7.356 7.344 0.012 25155 679 1 1 . 1 1 139 139 PHE N N 139 119.060 119.060 121.128 -2.068 25155 680 1 1 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.652 0.692 25155 681 1 1 . 1 1 139 139 PHE C C 139 178.850 178.850 177.109 1.741 25155 682 1 1 . 1 1 139 139 PHE CA C 139 56.670 56.670 58.754 -2.084 25155 683 1 1 . 1 1 139 139 PHE CB C 139 43.652 43.652 39.600 4.052 25155 684 1 1 . 1 1 139 139 PHE H H 139 10.026 10.026 9.313 0.713 25155 685 1 1 . 1 1 140 140 VAL N N 140 109.905 109.905 122.136 -12.231 25155 686 1 1 . 1 1 140 140 VAL HA H 140 3.500 3.500 3.921 -0.421 25155 687 1 1 . 1 1 140 140 VAL C C 140 172.860 172.860 175.110 -2.250 25155 688 1 1 . 1 1 140 140 VAL CA C 140 61.812 61.812 61.638 0.174 25155 689 1 1 . 1 1 140 140 VAL CB C 140 30.250 30.250 30.885 -0.635 25155 690 1 1 . 1 1 140 140 VAL H H 140 7.550 7.550 8.424 -0.874 25155 691 1 1 . 1 1 141 141 GLY N N 141 106.600 106.600 106.373 0.227 25155 692 1 1 . 1 1 141 141 GLY C C 141 171.350 171.350 172.662 -1.312 25155 693 1 1 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.994 0.466 25155 694 1 1 . 1 1 141 141 GLY H H 141 7.052 7.052 7.441 -0.389 25155 695 1 1 . 1 1 142 142 LEU N N 142 117.820 117.820 120.329 -2.509 25155 696 1 1 . 1 1 142 142 LEU HA H 142 4.962 4.962 4.171 0.791 25155 697 1 1 . 1 1 142 142 LEU CA C 142 55.600 55.600 54.285 1.315 25155 698 1 1 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.618 -4.688 25155 699 1 1 . 1 1 142 142 LEU H H 142 7.643 7.643 8.303 -0.660 25155 700 1 1 . 1 1 143 143 ALA HA H 143 4.220 4.220 4.011 0.209 25155 701 1 1 . 1 1 143 143 ALA C C 143 175.505 175.505 175.930 -0.425 25155 702 1 1 . 1 1 143 143 ALA CA C 143 49.600 49.600 49.920 -0.320 25155 703 1 1 . 1 1 143 143 ALA CB C 143 23.330 23.330 18.550 4.779 25155 704 1 1 . 1 1 144 144 LEU N N 144 124.960 124.960 124.240 0.720 25155 705 1 1 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.320 0.460 25155 706 1 1 . 1 1 144 144 LEU C C 144 174.700 174.700 174.796 -0.096 25155 707 1 1 . 1 1 144 144 LEU CA C 144 52.790 52.790 53.879 -1.089 25155 708 1 1 . 1 1 144 144 LEU CB C 144 45.300 45.300 44.240 1.060 25155 709 1 1 . 1 1 144 144 LEU H H 144 8.583 8.583 8.412 0.171 25155 710 1 1 . 1 1 145 145 ASP N N 145 119.100 119.100 118.320 0.780 25155 711 1 1 . 1 1 145 145 ASP HA H 145 5.422 5.422 5.532 -0.110 25155 712 1 1 . 1 1 145 145 ASP C C 145 176.180 176.180 175.461 0.719 25155 713 1 1 . 1 1 145 145 ASP CA C 145 53.600 53.600 52.255 1.345 25155 714 1 1 . 1 1 145 145 ASP CB C 145 43.180 43.180 44.733 -1.553 25155 715 1 1 . 1 1 147 147 THR HA H 147 4.093 4.093 4.517 -0.424 25155 716 1 1 . 1 1 147 147 THR C C 147 175.858 175.858 175.576 0.282 25155 717 1 1 . 1 1 147 147 THR CA C 147 66.400 66.400 64.146 2.254 25155 718 1 1 . 1 1 147 147 THR CB C 147 69.400 69.400 70.245 -0.845 25155 719 1 1 . 1 1 147 147 THR H H 147 8.745 8.745 9.049 -0.304 25155 720 1 1 . 1 1 148 148 ASN N N 148 115.408 115.408 118.694 -3.286 25155 721 1 1 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.804 0.206 25155 722 1 1 . 1 1 148 148 ASN C C 148 175.750 175.750 176.061 -0.311 25155 723 1 1 . 1 1 148 148 ASN CA C 148 53.400 53.400 53.938 -0.538 25155 724 1 1 . 1 1 148 148 ASN CB C 148 41.900 41.900 39.941 1.959 25155 725 1 1 . 1 1 148 148 ASN H H 148 8.975 8.975 8.830 0.145 25155 726 1 1 . 1 1 149 149 GLN N N 149 117.900 117.900 117.948 -0.048 25155 727 1 1 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.334 0.602 25155 728 1 1 . 1 1 149 149 GLN C C 149 178.280 178.280 176.419 1.861 25155 729 1 1 . 1 1 149 149 GLN CA C 149 53.730 53.730 55.101 -1.371 25155 730 1 1 . 1 1 149 149 GLN CB C 149 29.790 29.790 29.759 0.032 25155 731 1 1 . 1 1 149 149 GLN H H 149 7.430 7.430 9.029 -1.599 25155 732 1 1 . 1 1 150 150 TYR N N 150 121.060 121.060 120.080 0.980 25155 733 1 1 . 1 1 150 150 TYR HA H 150 4.671 4.671 4.160 0.510 25155 734 1 1 . 1 1 150 150 TYR C C 150 178.680 178.680 176.788 1.892 25155 735 1 1 . 1 1 150 150 TYR CA C 150 57.930 57.930 59.653 -1.722 25155 736 1 1 . 1 1 150 150 TYR CB C 150 38.860 38.860 37.273 1.587 25155 737 1 1 . 1 1 150 150 TYR H H 150 8.115 8.115 7.864 0.251 25155 738 1 1 . 1 1 151 151 ASP N N 151 121.175 121.175 120.089 1.086 25155 739 1 1 . 1 1 151 151 ASP CA C 151 57.000 57.000 56.427 0.573 25155 740 1 1 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.699 1.301 25155 741 1 1 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.807 -0.217 25155 742 1 1 . 1 1 152 152 LEU C C 152 178.300 178.300 177.610 0.690 25155 743 1 1 . 1 1 152 152 LEU CA C 152 54.788 54.788 54.995 -0.207 25155 744 1 1 . 1 1 152 152 LEU CB C 152 42.200 42.200 41.945 0.255 25155 745 1 1 . 1 1 153 153 SER N N 153 116.170 116.170 118.337 -2.167 25155 746 1 1 . 1 1 153 153 SER HA H 153 3.911 3.911 4.031 -0.120 25155 747 1 1 . 1 1 153 153 SER CA C 153 63.400 63.400 62.495 0.905 25155 748 1 1 . 1 1 153 153 SER CB C 153 63.200 63.200 62.840 0.360 25155 749 1 1 . 1 1 153 153 SER H H 153 7.378 7.378 7.594 -0.216 25155 750 1 1 . 1 1 154 154 ASP N N 154 121.640 121.640 121.119 0.521 25155 751 1 1 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.349 -0.109 25155 752 1 1 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.980 1.320 25155 753 1 1 . 1 1 154 154 ASP CB C 154 40.000 40.000 40.891 -0.891 25155 754 1 1 . 1 1 155 155 GLU HA H 155 4.170 4.170 4.045 0.125 25155 755 1 1 . 1 1 155 155 GLU C C 155 179.420 179.420 179.161 0.259 25155 756 1 1 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.349 -0.149 25155 757 1 1 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.391 0.089 25155 758 1 1 . 1 1 156 156 ARG N N 156 121.230 121.230 119.748 1.482 25155 759 1 1 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.282 -0.006 25155 760 1 1 . 1 1 156 156 ARG C C 156 177.350 177.350 179.175 -1.825 25155 761 1 1 . 1 1 156 156 ARG CA C 156 59.950 59.950 59.733 0.217 25155 762 1 1 . 1 1 156 156 ARG CB C 156 31.100 31.100 30.328 0.772 25155 763 1 1 . 1 1 157 157 ILE N N 157 118.190 118.190 119.910 -1.720 25155 764 1 1 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.701 -0.271 25155 765 1 1 . 1 1 157 157 ILE C C 157 178.480 178.480 178.000 0.480 25155 766 1 1 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.628 0.932 25155 767 1 1 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.850 0.630 25155 768 1 1 . 1 1 157 157 ILE H H 157 8.705 8.705 8.435 0.270 25155 769 1 1 . 1 1 158 158 GLN N N 158 119.975 119.975 120.350 -0.375 25155 770 1 1 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.929 0.027 25155 771 1 1 . 1 1 158 158 GLN C C 158 178.730 178.730 178.223 0.507 25155 772 1 1 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.272 1.428 25155 773 1 1 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.447 0.035 25155 774 1 1 . 1 1 158 158 GLN H H 158 8.262 8.262 8.638 -0.376 25155 775 1 1 . 1 1 159 159 SER N N 159 115.466 115.466 115.137 0.329 25155 776 1 1 . 1 1 159 159 SER HA H 159 4.446 4.446 4.304 0.142 25155 777 1 1 . 1 1 159 159 SER C C 159 177.320 177.320 177.012 0.308 25155 778 1 1 . 1 1 159 159 SER CA C 159 63.500 63.500 61.563 1.937 25155 779 1 1 . 1 1 159 159 SER CB C 159 63.818 63.818 62.867 0.951 25155 780 1 1 . 1 1 159 159 SER H H 159 8.440 8.440 8.460 -0.020 25155 781 1 1 . 1 1 160 160 TRP N N 160 126.784 126.784 124.959 1.825 25155 782 1 1 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.506 -0.052 25155 783 1 1 . 1 1 160 160 TRP C C 160 177.934 177.934 177.683 0.251 25155 784 1 1 . 1 1 160 160 TRP CA C 160 62.745 62.745 62.702 0.043 25155 785 1 1 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.588 -0.238 25155 786 1 1 . 1 1 160 160 TRP H H 160 9.243 9.243 8.000 1.243 25155 787 1 1 . 1 1 161 161 CYS N N 161 116.395 116.395 118.856 -2.461 25155 788 1 1 . 1 1 161 161 CYS HA H 161 3.886 3.886 3.813 0.073 25155 789 1 1 . 1 1 161 161 CYS C C 161 176.245 176.245 177.024 -0.779 25155 790 1 1 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.874 0.426 25155 791 1 1 . 1 1 161 161 CYS CB C 161 27.723 27.723 27.069 0.654 25155 792 1 1 . 1 1 161 161 CYS H H 161 8.845 8.845 9.073 -0.228 25155 793 1 1 . 1 1 162 162 GLU N N 162 118.030 118.030 119.418 -1.388 25155 794 1 1 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.879 0.041 25155 795 1 1 . 1 1 162 162 GLU C C 162 178.700 178.700 178.777 -0.077 25155 796 1 1 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.517 0.283 25155 797 1 1 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.264 0.236 25155 798 1 1 . 1 1 163 163 GLN N N 163 120.650 120.650 119.726 0.924 25155 799 1 1 . 1 1 163 163 GLN HA H 163 4.173 4.173 3.949 0.224 25155 800 1 1 . 1 1 163 163 GLN C C 163 179.700 179.700 178.295 1.405 25155 801 1 1 . 1 1 163 163 GLN CA C 163 59.688 59.688 59.236 0.452 25155 802 1 1 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.799 0.101 25155 803 1 1 . 1 1 163 163 GLN H H 163 8.148 8.148 7.852 0.296 25155 804 1 1 . 1 1 164 164 ILE N N 164 114.836 114.836 117.106 -2.270 25155 805 1 1 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.560 0.500 25155 806 1 1 . 1 1 164 164 ILE C C 164 178.676 178.676 177.676 1.000 25155 807 1 1 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.457 1.703 25155 808 1 1 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.281 0.349 25155 809 1 1 . 1 1 164 164 ILE H H 164 8.958 8.958 8.204 0.754 25155 810 1 1 . 1 1 165 165 LEU N N 165 123.700 123.700 119.769 3.931 25155 811 1 1 . 1 1 165 165 LEU HA H 165 4.100 4.100 4.066 0.034 25155 812 1 1 . 1 1 165 165 LEU C C 165 180.548 180.548 178.456 2.092 25155 813 1 1 . 1 1 165 165 LEU CA C 165 58.150 58.150 58.238 -0.088 25155 814 1 1 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.513 -0.383 25155 815 1 1 . 1 1 165 165 LEU H H 165 7.830 7.830 7.894 -0.064 25155 816 1 1 . 1 1 166 166 ASN N N 166 120.160 120.160 118.313 1.847 25155 817 1 1 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.383 0.187 25155 818 1 1 . 1 1 166 166 ASN C C 166 175.690 175.690 177.360 -1.670 25155 819 1 1 . 1 1 166 166 ASN CA C 166 55.946 55.946 56.952 -1.006 25155 820 1 1 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.446 0.034 25155 821 1 1 . 1 1 166 166 ASN H H 166 7.706 7.706 7.764 -0.058 25155 822 1 1 . 1 1 167 167 GLU N N 167 121.286 121.286 121.404 -0.118 25155 823 1 1 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.364 -0.260 25155 824 1 1 . 1 1 167 167 GLU C C 167 180.520 180.520 179.391 1.129 25155 825 1 1 . 1 1 167 167 GLU CA C 167 59.920 59.920 59.129 0.791 25155 826 1 1 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.795 1.130 25155 827 1 1 . 1 1 168 168 MET N N 168 118.622 118.622 116.616 2.006 25155 828 1 1 . 1 1 168 168 MET HA H 168 3.996 3.996 4.310 -0.314 25155 829 1 1 . 1 1 168 168 MET C C 168 176.856 176.856 177.656 -0.800 25155 830 1 1 . 1 1 168 168 MET CA C 168 59.500 59.500 59.171 0.329 25155 831 1 1 . 1 1 168 168 MET CB C 168 33.700 33.700 32.577 1.123 25155 832 1 1 . 1 1 168 168 MET H H 168 8.723 8.723 8.508 0.215 25155 833 1 1 . 1 1 169 169 ALA N N 169 121.760 121.760 123.431 -1.671 25155 834 1 1 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.050 0.106 25155 835 1 1 . 1 1 169 169 ALA C C 169 179.790 179.790 179.138 0.652 25155 836 1 1 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.714 0.086 25155 837 1 1 . 1 1 169 169 ALA CB C 169 18.220 18.220 18.468 -0.248 25155 838 1 1 . 1 1 169 169 ALA H H 169 7.494 7.494 7.350 0.144 25155 839 1 1 . 1 1 170 170 GLU N N 170 116.970 116.970 118.634 -1.664 25155 840 1 1 . 1 1 170 170 GLU HA H 170 4.091 4.091 3.880 0.211 25155 841 1 1 . 1 1 170 170 GLU C C 170 177.745 177.745 178.013 -0.268 25155 842 1 1 . 1 1 170 170 GLU CA C 170 58.000 58.000 58.733 -0.733 25155 843 1 1 . 1 1 170 170 GLU CB C 170 29.730 29.730 29.404 0.326 25155 844 1 1 . 1 1 171 171 HIS N N 171 118.150 118.150 119.164 -1.014 25155 845 1 1 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.284 0.186 25155 846 1 1 . 1 1 171 171 HIS C C 171 175.848 175.848 177.087 -1.239 25155 847 1 1 . 1 1 171 171 HIS CA C 171 57.600 57.600 58.912 -1.312 25155 848 1 1 . 1 1 171 171 HIS CB C 171 30.800 30.800 30.337 0.463 25155 849 1 1 . 1 1 171 171 HIS H H 171 7.717 7.717 7.793 -0.076 25155 850 1 1 . 1 1 172 172 TYR N N 172 119.483 119.483 118.365 1.118 25155 851 1 1 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.477 0.114 25155 852 1 1 . 1 1 172 172 TYR C C 172 174.590 174.590 176.068 -1.478 25155 853 1 1 . 1 1 172 172 TYR CA C 172 57.813 57.813 57.811 0.002 25155 854 1 1 . 1 1 172 172 TYR CB C 172 38.900 38.900 38.509 0.391 25155 855 1 1 . 1 1 172 172 TYR H H 172 7.778 7.778 7.895 -0.117 25155 856 1 2 . 1 1 2 2 ASN N N 2 122.966 122.966 119.049 3.917 25155 857 1 2 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.170 0.005 25155 858 1 2 . 1 1 2 2 ASN C C 2 175.200 175.200 174.199 1.001 25155 859 1 2 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.949 -0.029 25155 860 1 2 . 1 1 2 2 ASN CB C 2 40.000 40.000 41.589 -1.589 25155 861 1 2 . 1 1 2 2 ASN H H 2 9.392 9.392 8.396 0.996 25155 862 1 2 . 1 1 3 3 MET N N 3 120.660 120.660 121.106 -0.446 25155 863 1 2 . 1 1 3 3 MET HA H 3 5.565 5.565 5.118 0.447 25155 864 1 2 . 1 1 3 3 MET C C 3 174.200 174.200 175.563 -1.363 25155 865 1 2 . 1 1 3 3 MET CA C 3 54.550 54.550 53.979 0.571 25155 866 1 2 . 1 1 3 3 MET CB C 3 34.100 34.100 34.761 -0.661 25155 867 1 2 . 1 1 3 3 MET H H 3 8.745 8.745 9.021 -0.276 25155 868 1 2 . 1 1 4 4 GLY N N 4 115.792 115.792 109.805 5.987 25155 869 1 2 . 1 1 4 4 GLY C C 4 170.444 170.444 172.234 -1.790 25155 870 1 2 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.517 -0.630 25155 871 1 2 . 1 1 4 4 GLY H H 4 8.989 8.989 8.865 0.124 25155 872 1 2 . 1 1 5 5 LEU N N 5 131.175 131.175 125.069 6.106 25155 873 1 2 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.321 1.001 25155 874 1 2 . 1 1 5 5 LEU C C 5 175.700 175.700 174.658 1.042 25155 875 1 2 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.718 -0.398 25155 876 1 2 . 1 1 5 5 LEU CB C 5 44.700 44.700 43.797 0.903 25155 877 1 2 . 1 1 5 5 LEU H H 5 8.917 8.917 8.086 0.831 25155 878 1 2 . 1 1 6 6 PHE N N 6 125.990 125.990 125.124 0.866 25155 879 1 2 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.569 0.169 25155 880 1 2 . 1 1 6 6 PHE C C 6 174.358 174.358 173.403 0.955 25155 881 1 2 . 1 1 6 6 PHE CA C 6 55.480 55.480 54.912 0.568 25155 882 1 2 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.845 -0.795 25155 883 1 2 . 1 1 6 6 PHE H H 6 9.225 9.225 9.285 -0.060 25155 884 1 2 . 1 1 7 7 TYR N N 7 118.040 118.040 117.104 0.936 25155 885 1 2 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.568 0.361 25155 886 1 2 . 1 1 7 7 TYR C C 7 171.690 171.690 173.890 -2.200 25155 887 1 2 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.566 -1.106 25155 888 1 2 . 1 1 7 7 TYR CB C 7 40.800 40.800 40.579 0.221 25155 889 1 2 . 1 1 7 7 TYR H H 7 8.235 8.235 8.017 0.218 25155 890 1 2 . 1 1 8 8 GLY N N 8 106.640 106.640 106.247 0.393 25155 891 1 2 . 1 1 8 8 GLY C C 8 171.682 171.682 172.490 -0.808 25155 892 1 2 . 1 1 8 8 GLY CA C 8 44.050 44.050 43.563 0.487 25155 893 1 2 . 1 1 8 8 GLY H H 8 6.996 6.996 8.908 -1.912 25155 894 1 2 . 1 1 9 9 SER N N 9 118.164 118.164 115.798 2.366 25155 895 1 2 . 1 1 9 9 SER C C 9 174.560 174.560 174.214 0.346 25155 896 1 2 . 1 1 9 9 SER CA C 9 57.140 57.140 57.018 0.122 25155 897 1 2 . 1 1 9 9 SER H H 9 9.680 9.680 8.202 1.478 25155 898 1 2 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.755 -0.125 25155 899 1 2 . 1 1 17 17 ALA C C 17 177.740 177.740 178.818 -1.078 25155 900 1 2 . 1 1 17 17 ALA CA C 17 54.900 54.900 55.009 -0.109 25155 901 1 2 . 1 1 17 17 ALA CB C 17 17.790 17.790 17.699 0.091 25155 902 1 2 . 1 1 17 17 ALA H H 17 8.055 8.055 8.304 -0.249 25155 903 1 2 . 1 1 18 18 ALA N N 18 120.026 120.026 120.025 0.001 25155 904 1 2 . 1 1 18 18 ALA HA H 18 3.713 3.713 4.021 -0.308 25155 905 1 2 . 1 1 18 18 ALA C C 18 179.040 179.040 179.535 -0.495 25155 906 1 2 . 1 1 18 18 ALA CA C 18 54.860 54.860 55.231 -0.371 25155 907 1 2 . 1 1 18 18 ALA CB C 18 18.200 18.200 18.095 0.105 25155 908 1 2 . 1 1 18 18 ALA H H 18 7.015 7.015 7.998 -0.983 25155 909 1 2 . 1 1 19 19 GLU N N 19 116.656 116.656 118.626 -1.970 25155 910 1 2 . 1 1 19 19 GLU HA H 19 3.580 3.580 4.046 -0.466 25155 911 1 2 . 1 1 19 19 GLU C C 19 178.487 178.487 179.239 -0.752 25155 912 1 2 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.472 0.198 25155 913 1 2 . 1 1 19 19 GLU CB C 19 29.400 29.400 29.080 0.320 25155 914 1 2 . 1 1 20 20 LYS N N 20 120.100 120.100 119.916 0.184 25155 915 1 2 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.050 0.296 25155 916 1 2 . 1 1 20 20 LYS C C 20 175.330 175.330 179.191 -3.861 25155 917 1 2 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.234 -2.134 25155 918 1 2 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.462 0.538 25155 919 1 2 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.680 -0.215 25155 920 1 2 . 1 1 21 21 ILE C C 21 177.680 177.680 177.880 -0.200 25155 921 1 2 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.603 0.037 25155 922 1 2 . 1 1 21 21 ILE CB C 21 38.030 38.030 37.996 0.034 25155 923 1 2 . 1 1 21 21 ILE H H 21 8.220 8.220 8.542 -0.322 25155 924 1 2 . 1 1 22 22 ARG N N 22 119.433 119.433 118.428 1.005 25155 925 1 2 . 1 1 22 22 ARG HA H 22 3.550 3.550 3.989 -0.439 25155 926 1 2 . 1 1 22 22 ARG C C 22 177.268 177.268 178.292 -1.024 25155 927 1 2 . 1 1 22 22 ARG CA C 22 59.760 59.760 59.236 0.524 25155 928 1 2 . 1 1 22 22 ARG CB C 22 28.900 28.900 29.518 -0.618 25155 929 1 2 . 1 1 23 23 ASP N N 23 118.945 118.945 120.030 -1.085 25155 930 1 2 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.432 -0.090 25155 931 1 2 . 1 1 23 23 ASP C C 23 178.470 178.470 178.668 -0.198 25155 932 1 2 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.162 0.288 25155 933 1 2 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.905 -0.535 25155 934 1 2 . 1 1 24 24 ILE N N 24 121.200 121.200 119.309 1.891 25155 935 1 2 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.819 -0.085 25155 936 1 2 . 1 1 24 24 ILE C C 24 178.297 178.297 177.860 0.437 25155 937 1 2 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.402 0.098 25155 938 1 2 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.558 0.182 25155 939 1 2 . 1 1 24 24 ILE H H 24 8.160 8.160 7.948 0.212 25155 940 1 2 . 1 1 25 25 ILE N N 25 121.166 121.166 117.912 3.254 25155 941 1 2 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.882 -0.239 25155 942 1 2 . 1 1 25 25 ILE C C 25 176.825 176.825 176.686 0.139 25155 943 1 2 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.187 2.703 25155 944 1 2 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.862 -1.112 25155 945 1 2 . 1 1 25 25 ILE H H 25 8.480 8.480 7.985 0.495 25155 946 1 2 . 1 1 26 26 GLY N N 26 109.050 109.050 105.164 3.886 25155 947 1 2 . 1 1 26 26 GLY C C 26 173.800 173.800 172.265 1.535 25155 948 1 2 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.532 -0.132 25155 949 1 2 . 1 1 26 26 GLY H H 26 7.945 7.945 7.736 0.209 25155 950 1 2 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.479 -0.116 25155 951 1 2 . 1 1 27 27 PRO C C 27 177.157 177.157 176.898 0.259 25155 952 1 2 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.798 0.732 25155 953 1 2 . 1 1 27 27 PRO CB C 27 32.000 32.000 32.089 -0.089 25155 954 1 2 . 1 1 28 28 GLU N N 28 116.510 116.510 116.958 -0.448 25155 955 1 2 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.216 0.044 25155 956 1 2 . 1 1 28 28 GLU C C 28 177.000 177.000 177.037 -0.037 25155 957 1 2 . 1 1 28 28 GLU CA C 28 57.680 57.680 57.966 -0.286 25155 958 1 2 . 1 1 28 28 GLU CB C 28 28.620 28.620 29.231 -0.611 25155 959 1 2 . 1 1 29 29 LEU N N 29 120.334 120.334 113.269 7.065 25155 960 1 2 . 1 1 29 29 LEU HA H 29 4.650 4.650 5.017 -0.367 25155 961 1 2 . 1 1 29 29 LEU C C 29 175.676 175.676 175.489 0.187 25155 962 1 2 . 1 1 29 29 LEU CA C 29 55.924 55.924 54.819 1.105 25155 963 1 2 . 1 1 29 29 LEU CB C 29 44.880 44.880 44.364 0.517 25155 964 1 2 . 1 1 29 29 LEU H H 29 7.924 7.924 7.476 0.449 25155 965 1 2 . 1 1 30 30 VAL N N 30 118.900 118.900 121.193 -2.293 25155 966 1 2 . 1 1 30 30 VAL HA H 30 4.639 4.639 4.702 -0.063 25155 967 1 2 . 1 1 30 30 VAL C C 30 174.368 174.368 176.145 -1.777 25155 968 1 2 . 1 1 30 30 VAL CA C 30 61.110 61.110 62.262 -1.152 25155 969 1 2 . 1 1 30 30 VAL CB C 30 34.500 34.500 33.517 0.982 25155 970 1 2 . 1 1 30 30 VAL H H 30 7.486 7.486 7.575 -0.089 25155 971 1 2 . 1 1 31 31 THR N N 31 124.000 124.000 120.026 3.974 25155 972 1 2 . 1 1 31 31 THR HA H 31 4.331 4.331 4.627 -0.296 25155 973 1 2 . 1 1 31 31 THR C C 31 172.670 172.670 173.117 -0.447 25155 974 1 2 . 1 1 31 31 THR CA C 31 61.784 61.784 60.718 1.066 25155 975 1 2 . 1 1 31 31 THR CB C 31 70.483 70.483 71.096 -0.613 25155 976 1 2 . 1 1 31 31 THR H H 31 7.947 7.947 8.703 -0.756 25155 977 1 2 . 1 1 32 32 LEU N N 32 127.408 127.408 126.213 1.195 25155 978 1 2 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.682 -0.045 25155 979 1 2 . 1 1 32 32 LEU C C 32 176.425 176.425 176.652 -0.227 25155 980 1 2 . 1 1 32 32 LEU CA C 32 54.760 54.760 55.160 -0.400 25155 981 1 2 . 1 1 32 32 LEU CB C 32 43.809 43.809 43.698 0.111 25155 982 1 2 . 1 1 32 32 LEU H H 32 8.614 8.614 8.530 0.084 25155 983 1 2 . 1 1 33 33 HIS N N 33 120.230 120.230 122.648 -2.418 25155 984 1 2 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.726 -0.306 25155 985 1 2 . 1 1 33 33 HIS C C 33 171.914 171.914 173.424 -1.510 25155 986 1 2 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.589 0.711 25155 987 1 2 . 1 1 33 33 HIS CB C 33 32.050 32.050 31.349 0.701 25155 988 1 2 . 1 1 33 33 HIS H H 33 9.130 9.130 8.858 0.272 25155 989 1 2 . 1 1 34 34 ASN N N 34 123.987 123.987 120.983 3.004 25155 990 1 2 . 1 1 34 34 ASN HA H 34 3.600 3.600 3.872 -0.272 25155 991 1 2 . 1 1 34 34 ASN C C 34 177.930 177.930 175.925 2.005 25155 992 1 2 . 1 1 34 34 ASN CA C 34 51.730 51.730 53.100 -1.370 25155 993 1 2 . 1 1 34 34 ASN CB C 34 38.747 38.747 38.198 0.549 25155 994 1 2 . 1 1 34 34 ASN H H 34 8.759 8.759 8.268 0.491 25155 995 1 2 . 1 1 35 35 LEU N N 35 128.751 128.751 125.854 2.897 25155 996 1 2 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.075 0.215 25155 997 1 2 . 1 1 35 35 LEU C C 35 177.363 177.363 178.271 -0.908 25155 998 1 2 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.722 -0.173 25155 999 1 2 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.690 1.072 25155 1000 1 2 . 1 1 35 35 LEU H H 35 8.758 8.758 8.676 0.082 25155 1001 1 2 . 1 1 36 36 LYS N N 36 120.870 120.870 118.148 2.722 25155 1002 1 2 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.056 -0.123 25155 1003 1 2 . 1 1 36 36 LYS C C 36 176.540 176.540 177.116 -0.576 25155 1004 1 2 . 1 1 36 36 LYS CA C 36 59.260 59.260 58.264 0.996 25155 1005 1 2 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.576 0.224 25155 1006 1 2 . 1 1 37 37 ASP N N 37 115.288 115.288 117.357 -2.069 25155 1007 1 2 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.679 0.068 25155 1008 1 2 . 1 1 37 37 ASP C C 37 175.500 175.500 175.947 -0.447 25155 1009 1 2 . 1 1 37 37 ASP CA C 37 54.805 54.805 54.826 -0.021 25155 1010 1 2 . 1 1 37 37 ASP CB C 37 44.650 44.650 42.949 1.701 25155 1011 1 2 . 1 1 38 38 ASP N N 38 121.550 121.550 118.123 3.427 25155 1012 1 2 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.947 -0.082 25155 1013 1 2 . 1 1 38 38 ASP C C 38 174.895 174.895 174.743 0.152 25155 1014 1 2 . 1 1 38 38 ASP CA C 38 52.840 52.840 53.046 -0.206 25155 1015 1 2 . 1 1 38 38 ASP CB C 38 42.240 42.240 44.397 -2.157 25155 1016 1 2 . 1 1 39 39 SER N N 39 115.170 115.170 116.754 -1.584 25155 1017 1 2 . 1 1 39 39 SER HA H 39 4.600 4.600 4.698 -0.098 25155 1018 1 2 . 1 1 39 39 SER C C 39 174.930 174.930 174.109 0.821 25155 1019 1 2 . 1 1 39 39 SER CA C 39 54.786 54.786 57.355 -2.569 25155 1020 1 2 . 1 1 39 39 SER CB C 39 64.840 64.840 63.412 1.428 25155 1021 1 2 . 1 1 39 39 SER H H 39 8.330 8.330 8.500 -0.170 25155 1022 1 2 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.445 -0.445 25155 1023 1 2 . 1 1 40 40 PRO C C 40 176.620 176.620 177.933 -1.313 25155 1024 1 2 . 1 1 40 40 PRO CA C 40 63.870 63.870 64.944 -1.074 25155 1025 1 2 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.774 -0.414 25155 1026 1 2 . 1 1 41 41 LYS N N 41 120.913 120.913 117.784 3.129 25155 1027 1 2 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.192 -0.296 25155 1028 1 2 . 1 1 41 41 LYS C C 41 179.580 179.580 178.465 1.115 25155 1029 1 2 . 1 1 41 41 LYS CA C 41 58.000 58.000 57.779 0.221 25155 1030 1 2 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.198 0.902 25155 1031 1 2 . 1 1 42 42 LEU N N 42 118.206 118.206 120.640 -2.434 25155 1032 1 2 . 1 1 42 42 LEU HA H 42 4.025 4.025 3.953 0.072 25155 1033 1 2 . 1 1 42 42 LEU C C 42 178.630 178.630 178.448 0.182 25155 1034 1 2 . 1 1 42 42 LEU CA C 42 57.030 57.030 56.932 0.098 25155 1035 1 2 . 1 1 42 42 LEU CB C 42 41.820 41.820 40.699 1.121 25155 1036 1 2 . 1 1 42 42 LEU H H 42 7.598 7.598 7.553 0.045 25155 1037 1 2 . 1 1 43 43 MET N N 43 118.913 118.913 116.773 2.140 25155 1038 1 2 . 1 1 43 43 MET HA H 43 3.760 3.760 4.164 -0.404 25155 1039 1 2 . 1 1 43 43 MET C C 43 177.710 177.710 177.755 -0.045 25155 1040 1 2 . 1 1 43 43 MET CA C 43 59.864 59.864 58.307 1.557 25155 1041 1 2 . 1 1 43 43 MET CB C 43 32.680 32.680 31.931 0.749 25155 1042 1 2 . 1 1 43 43 MET H H 43 8.180 8.180 7.976 0.204 25155 1043 1 2 . 1 1 44 44 GLU N N 44 110.906 110.906 117.862 -6.956 25155 1044 1 2 . 1 1 44 44 GLU HA H 44 3.732 3.732 4.085 -0.353 25155 1045 1 2 . 1 1 44 44 GLU C C 44 178.120 178.120 178.935 -0.815 25155 1046 1 2 . 1 1 44 44 GLU CA C 44 59.450 59.450 58.821 0.629 25155 1047 1 2 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.544 0.255 25155 1048 1 2 . 1 1 45 45 GLN N N 45 115.770 115.770 118.011 -2.241 25155 1049 1 2 . 1 1 45 45 GLN HA H 45 4.190 4.190 3.937 0.253 25155 1050 1 2 . 1 1 45 45 GLN C C 45 175.480 175.480 176.365 -0.885 25155 1051 1 2 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.351 -1.251 25155 1052 1 2 . 1 1 45 45 GLN CB C 45 28.490 28.490 28.663 -0.173 25155 1053 1 2 . 1 1 45 45 GLN H H 45 7.517 7.517 7.317 0.200 25155 1054 1 2 . 1 1 46 46 TYR N N 46 117.840 117.840 117.620 0.220 25155 1055 1 2 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.482 0.178 25155 1056 1 2 . 1 1 46 46 TYR C C 46 175.480 175.480 176.246 -0.766 25155 1057 1 2 . 1 1 46 46 TYR CA C 46 58.827 58.827 57.476 1.351 25155 1058 1 2 . 1 1 46 46 TYR CB C 46 41.720 41.720 38.867 2.853 25155 1059 1 2 . 1 1 46 46 TYR H H 46 6.955 6.955 7.207 -0.252 25155 1060 1 2 . 1 1 47 47 ASP N N 47 121.540 121.540 122.875 -1.335 25155 1061 1 2 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.561 0.135 25155 1062 1 2 . 1 1 47 47 ASP C C 47 175.677 175.677 175.887 -0.210 25155 1063 1 2 . 1 1 47 47 ASP CA C 47 56.812 56.812 57.039 -0.227 25155 1064 1 2 . 1 1 47 47 ASP CB C 47 42.978 42.978 41.644 1.334 25155 1065 1 2 . 1 1 48 48 VAL N N 48 118.666 118.666 117.207 1.459 25155 1066 1 2 . 1 1 48 48 VAL HA H 48 5.057 5.057 4.932 0.125 25155 1067 1 2 . 1 1 48 48 VAL C C 48 174.180 174.180 174.349 -0.169 25155 1068 1 2 . 1 1 48 48 VAL CA C 48 60.000 60.000 61.586 -1.586 25155 1069 1 2 . 1 1 48 48 VAL CB C 48 36.200 36.200 33.614 2.586 25155 1070 1 2 . 1 1 48 48 VAL H H 48 7.631 7.631 7.704 -0.073 25155 1071 1 2 . 1 1 49 49 LEU N N 49 128.300 128.300 127.775 0.525 25155 1072 1 2 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.122 0.478 25155 1073 1 2 . 1 1 49 49 LEU C C 49 174.810 174.810 174.944 -0.134 25155 1074 1 2 . 1 1 49 49 LEU CA C 49 52.230 52.230 54.118 -1.888 25155 1075 1 2 . 1 1 49 49 LEU CB C 49 45.400 45.400 45.602 -0.202 25155 1076 1 2 . 1 1 49 49 LEU H H 49 9.469 9.469 8.944 0.525 25155 1077 1 2 . 1 1 50 50 ILE N N 50 124.400 124.400 127.626 -3.226 25155 1078 1 2 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.571 1.079 25155 1079 1 2 . 1 1 50 50 ILE C C 50 175.286 175.286 174.320 0.966 25155 1080 1 2 . 1 1 50 50 ILE CA C 50 59.900 59.900 61.184 -1.284 25155 1081 1 2 . 1 1 50 50 ILE CB C 50 40.200 40.200 39.799 0.401 25155 1082 1 2 . 1 1 50 50 ILE H H 50 9.213 9.213 9.281 -0.068 25155 1083 1 2 . 1 1 51 51 LEU N N 51 127.410 127.410 128.214 -0.804 25155 1084 1 2 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.295 1.775 25155 1085 1 2 . 1 1 51 51 LEU C C 51 174.540 174.540 175.468 -0.928 25155 1086 1 2 . 1 1 51 51 LEU CA C 51 52.950 52.950 53.331 -0.381 25155 1087 1 2 . 1 1 51 51 LEU CB C 51 43.190 43.190 43.887 -0.697 25155 1088 1 2 . 1 1 51 51 LEU H H 51 9.256 9.256 8.689 0.567 25155 1089 1 2 . 1 1 52 52 GLY N N 52 108.290 108.290 110.945 -2.655 25155 1090 1 2 . 1 1 52 52 GLY C C 52 174.330 174.330 171.339 2.991 25155 1091 1 2 . 1 1 52 52 GLY CA C 52 44.040 44.040 43.636 0.404 25155 1092 1 2 . 1 1 52 52 GLY H H 52 8.949 8.949 8.301 0.648 25155 1093 1 2 . 1 1 53 53 ILE N N 53 124.912 124.912 122.848 2.064 25155 1094 1 2 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.425 -0.250 25155 1095 1 2 . 1 1 53 53 ILE C C 53 174.470 174.470 172.536 1.934 25155 1096 1 2 . 1 1 53 53 ILE CA C 53 55.850 55.850 57.881 -2.031 25155 1097 1 2 . 1 1 53 53 ILE CB C 53 42.800 42.800 42.049 0.751 25155 1098 1 2 . 1 1 53 53 ILE H H 53 8.612 8.612 7.321 1.291 25155 1099 1 2 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.610 0.202 25155 1100 1 2 . 1 1 54 54 PRO C C 54 174.565 174.565 175.345 -0.780 25155 1101 1 2 . 1 1 54 54 PRO CA C 54 61.850 61.850 61.759 0.091 25155 1102 1 2 . 1 1 54 54 PRO CB C 54 32.400 32.400 31.768 0.632 25155 1103 1 2 . 1 1 55 55 THR N N 55 116.040 116.040 114.731 1.309 25155 1104 1 2 . 1 1 55 55 THR HA H 55 4.522 4.522 4.433 0.089 25155 1105 1 2 . 1 1 55 55 THR C C 55 173.990 173.990 172.821 1.169 25155 1106 1 2 . 1 1 55 55 THR CA C 55 62.845 62.845 61.411 1.434 25155 1107 1 2 . 1 1 55 55 THR CB C 55 70.795 70.795 71.151 -0.356 25155 1108 1 2 . 1 1 55 55 THR H H 55 7.663 7.663 8.039 -0.376 25155 1109 1 2 . 1 1 56 56 TRP N N 56 130.540 130.540 124.332 6.208 25155 1110 1 2 . 1 1 56 56 TRP CA C 56 54.800 54.800 56.205 -1.405 25155 1111 1 2 . 1 1 56 56 TRP H H 56 9.075 9.075 8.402 0.673 25155 1112 1 2 . 1 1 58 58 PHE HA H 58 4.540 4.540 4.765 -0.225 25155 1113 1 2 . 1 1 58 58 PHE C C 58 177.070 177.070 176.248 0.822 25155 1114 1 2 . 1 1 58 58 PHE CA C 58 55.460 55.460 57.170 -1.710 25155 1115 1 2 . 1 1 58 58 PHE CB C 58 41.200 41.200 40.715 0.485 25155 1116 1 2 . 1 1 59 59 GLY N N 59 109.796 109.796 111.712 -1.916 25155 1117 1 2 . 1 1 59 59 GLY CA C 59 45.763 45.763 45.010 0.753 25155 1118 1 2 . 1 1 59 59 GLY H H 59 8.392 8.392 7.421 0.971 25155 1119 1 2 . 1 1 60 60 GLU C C 60 175.660 175.660 175.532 0.128 25155 1120 1 2 . 1 1 61 61 ILE N N 61 122.380 122.380 122.845 -0.465 25155 1121 1 2 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.465 0.975 25155 1122 1 2 . 1 1 61 61 ILE CA C 61 62.100 62.100 62.194 -0.094 25155 1123 1 2 . 1 1 61 61 ILE CB C 61 38.750 38.750 37.676 1.074 25155 1124 1 2 . 1 1 61 61 ILE H H 61 8.436 8.436 8.046 0.390 25155 1125 1 2 . 1 1 62 62 GLN CB C 62 30.570 30.570 29.724 0.846 25155 1126 1 2 . 1 1 63 63 GLU HA H 63 4.030 4.030 3.911 0.119 25155 1127 1 2 . 1 1 63 63 GLU C C 63 177.134 177.134 178.111 -0.977 25155 1128 1 2 . 1 1 63 63 GLU CA C 63 60.520 60.520 60.278 0.242 25155 1129 1 2 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.573 0.077 25155 1130 1 2 . 1 1 64 64 ASP N N 64 119.630 119.630 117.092 2.538 25155 1131 1 2 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.480 0.112 25155 1132 1 2 . 1 1 64 64 ASP C C 64 178.680 178.680 177.067 1.613 25155 1133 1 2 . 1 1 64 64 ASP CA C 64 57.823 57.823 56.626 1.197 25155 1134 1 2 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.463 0.637 25155 1135 1 2 . 1 1 65 65 TRP N N 65 120.535 120.535 121.601 -1.066 25155 1136 1 2 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.645 -0.320 25155 1137 1 2 . 1 1 65 65 TRP C C 65 178.684 178.684 177.233 1.451 25155 1138 1 2 . 1 1 65 65 TRP CA C 65 60.500 60.500 59.873 0.627 25155 1139 1 2 . 1 1 65 65 TRP CB C 65 30.100 30.100 31.821 -1.721 25155 1140 1 2 . 1 1 65 65 TRP H H 65 7.416 7.416 7.860 -0.444 25155 1141 1 2 . 1 1 66 66 GLU N N 66 120.760 120.760 120.943 -0.183 25155 1142 1 2 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.309 -0.489 25155 1143 1 2 . 1 1 66 66 GLU C C 66 178.860 178.860 178.926 -0.066 25155 1144 1 2 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.830 0.270 25155 1145 1 2 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.654 -0.644 25155 1146 1 2 . 1 1 67 67 ALA N N 67 118.972 118.972 122.090 -3.118 25155 1147 1 2 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.230 0.017 25155 1148 1 2 . 1 1 67 67 ALA C C 67 179.610 179.610 179.027 0.583 25155 1149 1 2 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.952 -0.352 25155 1150 1 2 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.869 -0.080 25155 1151 1 2 . 1 1 67 67 ALA H H 67 7.690 7.690 8.500 -0.810 25155 1152 1 2 . 1 1 68 68 VAL N N 68 107.530 107.530 111.614 -4.084 25155 1153 1 2 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.286 0.424 25155 1154 1 2 . 1 1 68 68 VAL C C 68 176.800 176.800 177.354 -0.554 25155 1155 1 2 . 1 1 68 68 VAL CA C 68 60.060 60.060 62.737 -2.677 25155 1156 1 2 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.209 0.391 25155 1157 1 2 . 1 1 68 68 VAL H H 68 7.240 7.240 7.543 -0.303 25155 1158 1 2 . 1 1 69 69 TRP N N 69 126.960 126.960 125.295 1.665 25155 1159 1 2 . 1 1 69 69 TRP HA H 69 4.182 4.182 3.947 0.235 25155 1160 1 2 . 1 1 69 69 TRP C C 69 178.640 178.640 176.792 1.848 25155 1161 1 2 . 1 1 69 69 TRP CA C 69 61.300 61.300 62.534 -1.234 25155 1162 1 2 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.316 2.254 25155 1163 1 2 . 1 1 69 69 TRP H H 69 7.810 7.810 8.263 -0.453 25155 1164 1 2 . 1 1 70 70 ASP N N 70 114.644 114.644 116.812 -2.168 25155 1165 1 2 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.125 0.394 25155 1166 1 2 . 1 1 70 70 ASP C C 70 178.685 178.685 178.159 0.526 25155 1167 1 2 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.477 -0.477 25155 1168 1 2 . 1 1 70 70 ASP CB C 70 39.810 39.810 40.943 -1.133 25155 1169 1 2 . 1 1 71 71 GLN N N 71 120.100 120.100 116.925 3.175 25155 1170 1 2 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.238 -0.048 25155 1171 1 2 . 1 1 71 71 GLN C C 71 178.870 178.870 178.189 0.681 25155 1172 1 2 . 1 1 71 71 GLN CA C 71 57.617 57.617 56.985 0.632 25155 1173 1 2 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.511 -0.691 25155 1174 1 2 . 1 1 71 71 GLN H H 71 7.980 7.980 7.929 0.051 25155 1175 1 2 . 1 1 72 72 LEU N N 72 117.535 117.535 120.049 -2.514 25155 1176 1 2 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.947 -0.150 25155 1177 1 2 . 1 1 72 72 LEU C C 72 178.308 178.308 177.945 0.363 25155 1178 1 2 . 1 1 72 72 LEU CA C 72 57.340 57.340 57.043 0.297 25155 1179 1 2 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.514 0.186 25155 1180 1 2 . 1 1 72 72 LEU H H 72 7.435 7.435 7.668 -0.233 25155 1181 1 2 . 1 1 73 73 ASP N N 73 115.534 115.534 117.414 -1.880 25155 1182 1 2 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.410 -0.260 25155 1183 1 2 . 1 1 73 73 ASP C C 73 177.553 177.553 176.727 0.826 25155 1184 1 2 . 1 1 73 73 ASP CA C 73 57.350 57.350 56.085 1.265 25155 1185 1 2 . 1 1 73 73 ASP CB C 73 40.040 40.040 41.677 -1.637 25155 1186 1 2 . 1 1 74 74 ASP N N 74 117.300 117.300 120.277 -2.977 25155 1187 1 2 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.466 0.240 25155 1188 1 2 . 1 1 74 74 ASP C C 74 176.424 176.424 177.249 -0.825 25155 1189 1 2 . 1 1 74 74 ASP CA C 74 54.170 54.170 55.641 -1.471 25155 1190 1 2 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.307 0.513 25155 1191 1 2 . 1 1 75 75 LEU N N 75 118.500 118.500 120.386 -1.886 25155 1192 1 2 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.171 0.124 25155 1193 1 2 . 1 1 75 75 LEU C C 75 176.800 176.800 176.669 0.131 25155 1194 1 2 . 1 1 75 75 LEU CA C 75 54.400 54.400 55.177 -0.777 25155 1195 1 2 . 1 1 75 75 LEU CB C 75 43.280 43.280 41.694 1.586 25155 1196 1 2 . 1 1 75 75 LEU H H 75 6.966 6.966 7.373 -0.407 25155 1197 1 2 . 1 1 76 76 ASN N N 76 123.040 123.040 121.058 1.982 25155 1198 1 2 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.614 0.248 25155 1199 1 2 . 1 1 76 76 ASN C C 76 174.927 174.927 174.334 0.593 25155 1200 1 2 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.775 -1.894 25155 1201 1 2 . 1 1 76 76 ASN CB C 76 37.510 37.510 38.642 -1.132 25155 1202 1 2 . 1 1 76 76 ASN H H 76 9.882 9.882 8.972 0.910 25155 1203 1 2 . 1 1 77 77 LEU N N 77 123.614 123.614 123.675 -0.061 25155 1204 1 2 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.600 -0.230 25155 1205 1 2 . 1 1 77 77 LEU C C 77 175.110 175.110 176.305 -1.195 25155 1206 1 2 . 1 1 77 77 LEU CA C 77 52.200 52.200 54.128 -1.928 25155 1207 1 2 . 1 1 77 77 LEU CB C 77 42.786 42.786 43.202 -0.416 25155 1208 1 2 . 1 1 77 77 LEU H H 77 8.700 8.700 8.164 0.536 25155 1209 1 2 . 1 1 78 78 GLU N N 78 120.822 120.822 121.644 -0.822 25155 1210 1 2 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.244 -0.344 25155 1211 1 2 . 1 1 78 78 GLU C C 78 178.670 178.670 178.049 0.621 25155 1212 1 2 . 1 1 78 78 GLU CA C 78 58.700 58.700 57.978 0.722 25155 1213 1 2 . 1 1 78 78 GLU CB C 78 29.467 29.467 29.437 0.030 25155 1214 1 2 . 1 1 79 79 GLY N N 79 113.160 113.160 113.963 -0.803 25155 1215 1 2 . 1 1 79 79 GLY C C 79 174.523 174.523 173.667 0.856 25155 1216 1 2 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.461 -0.041 25155 1217 1 2 . 1 1 79 79 GLY H H 79 8.450 8.450 8.842 -0.392 25155 1218 1 2 . 1 1 80 80 LYS N N 80 120.283 120.283 119.773 0.510 25155 1219 1 2 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.333 0.025 25155 1220 1 2 . 1 1 80 80 LYS C C 80 175.304 175.304 176.212 -0.908 25155 1221 1 2 . 1 1 80 80 LYS CA C 80 56.890 56.890 55.945 0.945 25155 1222 1 2 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.652 -0.532 25155 1223 1 2 . 1 1 81 81 ILE N N 81 122.288 122.288 122.088 0.200 25155 1224 1 2 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.423 0.384 25155 1225 1 2 . 1 1 81 81 ILE C C 81 174.750 174.750 175.410 -0.660 25155 1226 1 2 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.651 -1.831 25155 1227 1 2 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.211 0.639 25155 1228 1 2 . 1 1 81 81 ILE H H 81 7.405 7.405 8.288 -0.883 25155 1229 1 2 . 1 1 82 82 VAL N N 82 127.793 127.793 126.900 0.893 25155 1230 1 2 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.140 0.140 25155 1231 1 2 . 1 1 82 82 VAL C C 82 172.680 172.680 174.252 -1.572 25155 1232 1 2 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.634 -0.534 25155 1233 1 2 . 1 1 82 82 VAL CB C 82 35.280 35.280 35.852 -0.572 25155 1234 1 2 . 1 1 82 82 VAL H H 82 8.800 8.800 9.099 -0.299 25155 1235 1 2 . 1 1 83 83 ALA N N 83 130.911 130.911 128.892 2.019 25155 1236 1 2 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.508 -0.119 25155 1237 1 2 . 1 1 83 83 ALA C C 83 175.870 175.870 176.111 -0.241 25155 1238 1 2 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.477 0.523 25155 1239 1 2 . 1 1 83 83 ALA CB C 83 23.722 23.722 22.179 1.543 25155 1240 1 2 . 1 1 83 83 ALA H H 83 9.252 9.252 9.022 0.230 25155 1241 1 2 . 1 1 84 84 LEU N N 84 124.269 124.269 122.249 2.020 25155 1242 1 2 . 1 1 84 84 LEU HA H 84 5.508 5.508 5.204 0.304 25155 1243 1 2 . 1 1 84 84 LEU C C 84 175.490 175.490 175.565 -0.075 25155 1244 1 2 . 1 1 84 84 LEU CA C 84 53.670 53.670 54.312 -0.642 25155 1245 1 2 . 1 1 84 84 LEU CB C 84 45.000 45.000 45.633 -0.633 25155 1246 1 2 . 1 1 84 84 LEU H H 84 10.378 10.378 9.115 1.263 25155 1247 1 2 . 1 1 85 85 TYR N N 85 115.826 115.826 119.662 -3.836 25155 1248 1 2 . 1 1 85 85 TYR HA H 85 4.950 4.950 5.213 -0.263 25155 1249 1 2 . 1 1 85 85 TYR C C 85 172.661 172.661 173.367 -0.706 25155 1250 1 2 . 1 1 85 85 TYR CA C 85 55.853 55.853 55.555 0.298 25155 1251 1 2 . 1 1 85 85 TYR CB C 85 43.200 43.200 41.368 1.832 25155 1252 1 2 . 1 1 85 85 TYR H H 85 9.200 9.200 8.678 0.522 25155 1253 1 2 . 1 1 86 86 GLY N N 86 106.802 106.802 105.143 1.659 25155 1254 1 2 . 1 1 86 86 GLY C C 86 170.348 170.348 171.109 -0.761 25155 1255 1 2 . 1 1 86 86 GLY CA C 86 44.687 44.687 44.296 0.391 25155 1256 1 2 . 1 1 86 86 GLY H H 86 8.752 8.752 8.370 0.382 25155 1257 1 2 . 1 1 87 87 LEU N N 87 120.860 120.860 121.042 -0.182 25155 1258 1 2 . 1 1 87 87 LEU HA H 87 5.476 5.476 4.984 0.492 25155 1259 1 2 . 1 1 87 87 LEU C C 87 177.720 177.720 175.015 2.705 25155 1260 1 2 . 1 1 87 87 LEU CA C 87 52.630 52.630 52.925 -0.295 25155 1261 1 2 . 1 1 87 87 LEU CB C 87 45.900 45.900 45.018 0.882 25155 1262 1 2 . 1 1 87 87 LEU H H 87 6.320 6.320 7.834 -1.514 25155 1263 1 2 . 1 1 88 88 GLY N N 88 109.910 109.910 109.802 0.108 25155 1264 1 2 . 1 1 88 88 GLY C C 88 171.386 171.386 171.466 -0.080 25155 1265 1 2 . 1 1 88 88 GLY CA C 88 45.710 45.710 44.368 1.342 25155 1266 1 2 . 1 1 88 88 GLY H H 88 8.320 8.320 8.443 -0.123 25155 1267 1 2 . 1 1 89 89 ASP N N 89 121.580 121.580 117.597 3.983 25155 1268 1 2 . 1 1 89 89 ASP HA H 89 5.190 5.190 5.189 0.001 25155 1269 1 2 . 1 1 89 89 ASP C C 89 176.608 176.608 176.019 0.589 25155 1270 1 2 . 1 1 89 89 ASP CA C 89 52.200 52.200 52.818 -0.618 25155 1271 1 2 . 1 1 89 89 ASP CB C 89 41.900 41.900 44.170 -2.270 25155 1272 1 2 . 1 1 90 90 GLN N N 90 123.900 123.900 123.014 0.886 25155 1273 1 2 . 1 1 90 90 GLN HA H 90 3.645 3.645 4.553 -0.908 25155 1274 1 2 . 1 1 90 90 GLN C C 90 173.523 173.523 175.753 -2.230 25155 1275 1 2 . 1 1 90 90 GLN CA C 90 58.706 58.706 56.123 2.583 25155 1276 1 2 . 1 1 90 90 GLN CB C 90 28.800 28.800 28.975 -0.175 25155 1277 1 2 . 1 1 90 90 GLN H H 90 8.726 8.726 8.698 0.028 25155 1278 1 2 . 1 1 91 91 LEU N N 91 117.080 117.080 121.167 -4.087 25155 1279 1 2 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.043 0.427 25155 1280 1 2 . 1 1 91 91 LEU C C 91 179.840 179.840 178.976 0.864 25155 1281 1 2 . 1 1 91 91 LEU CA C 91 55.800 55.800 56.470 -0.670 25155 1282 1 2 . 1 1 91 91 LEU CB C 91 41.640 41.640 41.765 -0.125 25155 1283 1 2 . 1 1 91 91 LEU H H 91 7.092 7.092 8.920 -1.828 25155 1284 1 2 . 1 1 92 92 GLY N N 92 110.460 110.460 105.114 5.346 25155 1285 1 2 . 1 1 92 92 GLY C C 92 174.824 174.824 174.688 0.136 25155 1286 1 2 . 1 1 92 92 GLY CA C 92 46.390 46.390 44.819 1.571 25155 1287 1 2 . 1 1 92 92 GLY H H 92 9.243 9.243 8.704 0.539 25155 1288 1 2 . 1 1 93 93 TYR N N 93 118.140 118.140 116.295 1.845 25155 1289 1 2 . 1 1 93 93 TYR HA H 93 5.173 5.173 3.952 1.221 25155 1290 1 2 . 1 1 93 93 TYR C C 93 177.805 177.805 176.379 1.426 25155 1291 1 2 . 1 1 93 93 TYR CA C 93 57.430 57.430 60.237 -2.807 25155 1292 1 2 . 1 1 93 93 TYR CB C 93 39.300 39.300 35.792 3.508 25155 1293 1 2 . 1 1 93 93 TYR H H 93 7.252 7.252 7.928 -0.676 25155 1294 1 2 . 1 1 94 94 GLY N N 94 112.455 112.455 104.478 7.977 25155 1295 1 2 . 1 1 94 94 GLY C C 94 177.740 177.740 175.728 2.012 25155 1296 1 2 . 1 1 94 94 GLY CA C 94 49.880 49.880 45.797 4.083 25155 1297 1 2 . 1 1 94 94 GLY H H 94 8.154 8.154 8.361 -0.207 25155 1298 1 2 . 1 1 95 95 GLU N N 95 123.040 123.040 120.379 2.661 25155 1299 1 2 . 1 1 95 95 GLU HA H 95 4.000 4.000 4.260 -0.260 25155 1300 1 2 . 1 1 95 95 GLU C C 95 175.145 175.145 177.016 -1.871 25155 1301 1 2 . 1 1 95 95 GLU CA C 95 57.950 57.950 58.566 -0.617 25155 1302 1 2 . 1 1 95 95 GLU CB C 95 27.400 27.400 29.968 -2.568 25155 1303 1 2 . 1 1 96 96 TRP N N 96 118.000 118.000 117.794 0.206 25155 1304 1 2 . 1 1 96 96 TRP HA H 96 5.213 5.213 4.794 0.419 25155 1305 1 2 . 1 1 96 96 TRP C C 96 176.616 176.616 176.314 0.302 25155 1306 1 2 . 1 1 96 96 TRP CA C 96 57.120 57.120 56.350 0.770 25155 1307 1 2 . 1 1 96 96 TRP CB C 96 29.970 29.970 30.038 -0.069 25155 1308 1 2 . 1 1 96 96 TRP H H 96 7.785 7.785 8.063 -0.278 25155 1309 1 2 . 1 1 97 97 PHE N N 97 123.268 123.268 122.333 0.935 25155 1310 1 2 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.365 0.295 25155 1311 1 2 . 1 1 97 97 PHE CA C 97 58.742 58.742 59.314 -0.572 25155 1312 1 2 . 1 1 97 97 PHE CB C 97 40.835 40.835 39.615 1.220 25155 1313 1 2 . 1 1 97 97 PHE H H 97 7.054 7.054 7.840 -0.786 25155 1314 1 2 . 1 1 98 98 LEU HA H 98 3.440 3.440 3.434 0.006 25155 1315 1 2 . 1 1 98 98 LEU C C 98 176.613 176.613 176.746 -0.133 25155 1316 1 2 . 1 1 98 98 LEU CA C 98 56.000 56.000 55.339 0.661 25155 1317 1 2 . 1 1 98 98 LEU CB C 98 38.600 38.600 38.878 -0.278 25155 1318 1 2 . 1 1 98 98 LEU H H 98 8.584 8.584 8.309 0.275 25155 1319 1 2 . 1 1 99 99 ASP N N 99 123.268 123.268 119.877 3.391 25155 1320 1 2 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.224 -0.259 25155 1321 1 2 . 1 1 99 99 ASP C C 99 178.876 178.876 177.046 1.830 25155 1322 1 2 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.501 1.759 25155 1323 1 2 . 1 1 99 99 ASP CB C 99 40.350 40.350 40.995 -0.645 25155 1324 1 2 . 1 1 100 100 ALA N N 100 119.124 119.124 120.747 -1.623 25155 1325 1 2 . 1 1 100 100 ALA HA H 100 3.822 3.822 3.884 -0.062 25155 1326 1 2 . 1 1 100 100 ALA C C 100 178.490 178.490 178.909 -0.419 25155 1327 1 2 . 1 1 100 100 ALA CA C 100 55.100 55.100 54.681 0.419 25155 1328 1 2 . 1 1 100 100 ALA CB C 100 19.700 19.700 18.248 1.452 25155 1329 1 2 . 1 1 100 100 ALA H H 100 8.400 8.400 7.559 0.841 25155 1330 1 2 . 1 1 101 101 LEU N N 101 118.687 118.687 119.994 -1.307 25155 1331 1 2 . 1 1 101 101 LEU HA H 101 3.674 3.674 3.945 -0.271 25155 1332 1 2 . 1 1 101 101 LEU C C 101 179.050 179.050 178.577 0.473 25155 1333 1 2 . 1 1 101 101 LEU CA C 101 57.800 57.800 57.065 0.735 25155 1334 1 2 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.625 1.025 25155 1335 1 2 . 1 1 101 101 LEU H H 101 6.518 6.518 7.594 -1.076 25155 1336 1 2 . 1 1 102 102 GLY N N 102 104.410 104.410 106.518 -2.108 25155 1337 1 2 . 1 1 102 102 GLY C C 102 176.056 176.056 175.809 0.247 25155 1338 1 2 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.165 0.585 25155 1339 1 2 . 1 1 102 102 GLY H H 102 7.712 7.712 7.804 -0.092 25155 1340 1 2 . 1 1 103 103 MET N N 103 120.550 120.550 122.360 -1.810 25155 1341 1 2 . 1 1 103 103 MET HA H 103 4.256 4.256 4.308 -0.052 25155 1342 1 2 . 1 1 103 103 MET C C 103 179.650 179.650 178.285 1.365 25155 1343 1 2 . 1 1 103 103 MET CA C 103 59.450 59.450 58.990 0.459 25155 1344 1 2 . 1 1 103 103 MET CB C 103 32.300 32.300 32.603 -0.303 25155 1345 1 2 . 1 1 103 103 MET H H 103 8.485 8.485 8.065 0.420 25155 1346 1 2 . 1 1 104 104 LEU N N 104 123.480 123.480 118.872 4.608 25155 1347 1 2 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.381 -0.320 25155 1348 1 2 . 1 1 104 104 LEU C C 104 177.750 177.750 178.844 -1.094 25155 1349 1 2 . 1 1 104 104 LEU CA C 104 58.100 58.100 57.558 0.542 25155 1350 1 2 . 1 1 104 104 LEU CB C 104 41.450 41.450 41.165 0.285 25155 1351 1 2 . 1 1 104 104 LEU H H 104 8.392 8.392 7.713 0.679 25155 1352 1 2 . 1 1 105 105 HIS N N 105 119.570 119.570 120.473 -0.903 25155 1353 1 2 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.149 -0.297 25155 1354 1 2 . 1 1 105 105 HIS C C 105 177.550 177.550 177.129 0.421 25155 1355 1 2 . 1 1 105 105 HIS CA C 105 61.000 61.000 60.874 0.126 25155 1356 1 2 . 1 1 105 105 HIS CB C 105 28.820 28.820 30.263 -1.443 25155 1357 1 2 . 1 1 105 105 HIS H H 105 8.247 8.247 8.312 -0.065 25155 1358 1 2 . 1 1 106 106 ASP N N 106 119.780 119.780 119.347 0.433 25155 1359 1 2 . 1 1 106 106 ASP HA H 106 4.333 4.333 4.312 0.021 25155 1360 1 2 . 1 1 106 106 ASP C C 106 179.410 179.410 178.263 1.147 25155 1361 1 2 . 1 1 106 106 ASP CA C 106 57.800 57.800 57.204 0.596 25155 1362 1 2 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.114 -0.514 25155 1363 1 2 . 1 1 107 107 LYS N N 107 121.660 121.660 118.500 3.160 25155 1364 1 2 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.096 0.004 25155 1365 1 2 . 1 1 107 107 LYS C C 107 178.316 178.316 178.198 0.118 25155 1366 1 2 . 1 1 107 107 LYS CA C 107 58.750 58.750 58.834 -0.084 25155 1367 1 2 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.569 -0.719 25155 1368 1 2 . 1 1 108 108 LEU N N 108 116.050 116.050 117.375 -1.325 25155 1369 1 2 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.443 -0.433 25155 1370 1 2 . 1 1 108 108 LEU C C 108 179.050 179.050 178.791 0.259 25155 1371 1 2 . 1 1 108 108 LEU CA C 108 56.240 56.240 55.930 0.310 25155 1372 1 2 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.537 -0.737 25155 1373 1 2 . 1 1 108 108 LEU H H 108 8.072 8.072 7.695 0.377 25155 1374 1 2 . 1 1 109 109 SER N N 109 116.280 116.280 116.351 -0.071 25155 1375 1 2 . 1 1 109 109 SER HA H 109 4.300 4.300 4.303 -0.003 25155 1376 1 2 . 1 1 109 109 SER C C 109 175.848 175.848 176.238 -0.390 25155 1377 1 2 . 1 1 109 109 SER CA C 109 62.410 62.410 61.796 0.614 25155 1378 1 2 . 1 1 109 109 SER CB C 109 62.850 62.850 63.123 -0.273 25155 1379 1 2 . 1 1 109 109 SER H H 109 8.366 8.366 8.000 0.366 25155 1380 1 2 . 1 1 110 110 THR N N 110 110.416 110.416 111.797 -1.381 25155 1381 1 2 . 1 1 110 110 THR HA H 110 4.614 4.614 4.342 0.272 25155 1382 1 2 . 1 1 110 110 THR C C 110 175.675 175.675 174.957 0.718 25155 1383 1 2 . 1 1 110 110 THR CA C 110 62.030 62.030 63.855 -1.825 25155 1384 1 2 . 1 1 110 110 THR CB C 110 68.810 68.810 68.686 0.124 25155 1385 1 2 . 1 1 110 110 THR H H 110 7.185 7.185 8.104 -0.919 25155 1386 1 2 . 1 1 111 111 LYS N N 111 120.090 120.090 121.045 -0.955 25155 1387 1 2 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.459 0.054 25155 1388 1 2 . 1 1 111 111 LYS C C 111 176.814 176.814 176.593 0.221 25155 1389 1 2 . 1 1 111 111 LYS CA C 111 55.730 55.730 55.559 0.171 25155 1390 1 2 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.414 -1.484 25155 1391 1 2 . 1 1 112 112 GLY N N 112 107.540 107.540 108.061 -0.521 25155 1392 1 2 . 1 1 112 112 GLY C C 112 176.223 176.223 174.311 1.912 25155 1393 1 2 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.529 1.397 25155 1394 1 2 . 1 1 112 112 GLY H H 112 8.315 8.315 7.608 0.707 25155 1395 1 2 . 1 1 113 113 VAL N N 113 113.536 113.536 116.122 -2.586 25155 1396 1 2 . 1 1 113 113 VAL HA H 113 4.494 4.494 4.211 0.283 25155 1397 1 2 . 1 1 113 113 VAL C C 113 174.560 174.560 174.923 -0.363 25155 1398 1 2 . 1 1 113 113 VAL CA C 113 59.550 59.550 61.204 -1.654 25155 1399 1 2 . 1 1 113 113 VAL CB C 113 32.800 32.800 32.293 0.507 25155 1400 1 2 . 1 1 113 113 VAL H H 113 6.835 6.835 7.004 -0.169 25155 1401 1 2 . 1 1 114 114 LYS N N 114 122.920 122.920 122.113 0.807 25155 1402 1 2 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.415 0.079 25155 1403 1 2 . 1 1 114 114 LYS C C 114 174.925 174.925 174.733 0.192 25155 1404 1 2 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.236 0.044 25155 1405 1 2 . 1 1 114 114 LYS CB C 114 33.630 33.630 34.043 -0.413 25155 1406 1 2 . 1 1 115 115 PHE N N 115 123.140 123.140 123.747 -0.607 25155 1407 1 2 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.445 0.255 25155 1408 1 2 . 1 1 115 115 PHE C C 115 177.580 177.580 176.373 1.207 25155 1409 1 2 . 1 1 115 115 PHE CA C 115 58.677 58.677 56.836 1.841 25155 1410 1 2 . 1 1 115 115 PHE CB C 115 41.120 41.120 40.146 0.974 25155 1411 1 2 . 1 1 115 115 PHE H H 115 8.506 8.506 8.470 0.036 25155 1412 1 2 . 1 1 116 116 VAL N N 116 115.737 115.737 117.078 -1.341 25155 1413 1 2 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.465 0.013 25155 1414 1 2 . 1 1 116 116 VAL C C 116 175.300 175.300 175.352 -0.052 25155 1415 1 2 . 1 1 116 116 VAL CA C 116 58.877 58.877 60.036 -1.159 25155 1416 1 2 . 1 1 116 116 VAL CB C 116 34.120 34.120 34.629 -0.509 25155 1417 1 2 . 1 1 116 116 VAL H H 116 8.860 8.860 8.717 0.143 25155 1418 1 2 . 1 1 117 117 GLY N N 117 108.137 108.137 111.258 -3.121 25155 1419 1 2 . 1 1 117 117 GLY C C 117 176.110 176.110 174.216 1.894 25155 1420 1 2 . 1 1 117 117 GLY CA C 117 47.500 47.500 45.096 2.404 25155 1421 1 2 . 1 1 117 117 GLY H H 117 9.838 9.838 9.327 0.511 25155 1422 1 2 . 1 1 118 118 TYR N N 118 120.380 120.380 119.565 0.815 25155 1423 1 2 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.493 0.477 25155 1424 1 2 . 1 1 118 118 TYR C C 118 177.630 177.630 174.292 3.338 25155 1425 1 2 . 1 1 118 118 TYR CA C 118 55.800 55.800 59.171 -3.371 25155 1426 1 2 . 1 1 118 118 TYR CB C 118 35.970 35.970 38.047 -2.077 25155 1427 1 2 . 1 1 118 118 TYR H H 118 8.652 8.652 8.427 0.225 25155 1428 1 2 . 1 1 119 119 TRP N N 119 126.040 126.040 119.076 6.964 25155 1429 1 2 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.004 1.017 25155 1430 1 2 . 1 1 119 119 TRP C C 119 173.000 173.000 173.919 -0.919 25155 1431 1 2 . 1 1 119 119 TRP CA C 119 53.820 53.820 55.503 -1.683 25155 1432 1 2 . 1 1 119 119 TRP CB C 119 36.050 36.050 32.821 3.229 25155 1433 1 2 . 1 1 119 119 TRP H H 119 8.070 8.070 8.496 -0.426 25155 1434 1 2 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.744 0.040 25155 1435 1 2 . 1 1 120 120 PRO C C 120 176.870 176.870 176.642 0.228 25155 1436 1 2 . 1 1 120 120 PRO CA C 120 63.780 63.780 63.184 0.595 25155 1437 1 2 . 1 1 120 120 PRO CB C 120 31.990 31.990 31.935 0.055 25155 1438 1 2 . 1 1 121 121 THR N N 121 109.310 109.310 115.457 -6.147 25155 1439 1 2 . 1 1 121 121 THR HA H 121 4.073 4.073 3.690 0.383 25155 1440 1 2 . 1 1 121 121 THR C C 121 176.324 176.324 175.071 1.253 25155 1441 1 2 . 1 1 121 121 THR CA C 121 61.250 61.250 62.444 -1.194 25155 1442 1 2 . 1 1 121 121 THR CB C 121 69.730 69.730 68.701 1.030 25155 1443 1 2 . 1 1 121 121 THR H H 121 7.370 7.370 8.475 -1.105 25155 1444 1 2 . 1 1 122 122 GLU N N 122 123.937 123.937 122.354 1.583 25155 1445 1 2 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.275 -0.051 25155 1446 1 2 . 1 1 122 122 GLU C C 122 177.737 177.737 177.274 0.463 25155 1447 1 2 . 1 1 122 122 GLU CA C 122 58.200 58.200 57.847 0.353 25155 1448 1 2 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.423 0.377 25155 1449 1 2 . 1 1 123 123 GLY N N 123 114.563 114.563 113.386 1.177 25155 1450 1 2 . 1 1 123 123 GLY C C 123 173.783 173.783 174.589 -0.806 25155 1451 1 2 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.430 -0.050 25155 1452 1 2 . 1 1 123 123 GLY H H 123 9.144 9.144 8.766 0.378 25155 1453 1 2 . 1 1 124 124 TYR N N 124 118.800 118.800 121.095 -2.295 25155 1454 1 2 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.636 0.582 25155 1455 1 2 . 1 1 124 124 TYR C C 124 175.673 175.673 175.465 0.208 25155 1456 1 2 . 1 1 124 124 TYR CA C 124 56.950 56.950 58.407 -1.457 25155 1457 1 2 . 1 1 124 124 TYR CB C 124 41.100 41.100 40.209 0.891 25155 1458 1 2 . 1 1 124 124 TYR H H 124 7.895 7.895 8.002 -0.107 25155 1459 1 2 . 1 1 125 125 GLU N N 125 124.790 124.790 125.601 -0.811 25155 1460 1 2 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.646 0.039 25155 1461 1 2 . 1 1 125 125 GLU C C 125 172.877 172.877 175.654 -2.777 25155 1462 1 2 . 1 1 125 125 GLU CA C 125 55.700 55.700 55.529 0.171 25155 1463 1 2 . 1 1 125 125 GLU CB C 125 31.340 31.340 30.372 0.968 25155 1464 1 2 . 1 1 126 126 PHE N N 126 118.670 118.670 120.282 -1.612 25155 1465 1 2 . 1 1 126 126 PHE HA H 126 4.841 4.841 4.874 -0.033 25155 1466 1 2 . 1 1 126 126 PHE C C 126 173.800 173.800 173.665 0.135 25155 1467 1 2 . 1 1 126 126 PHE CA C 126 56.950 56.950 57.475 -0.525 25155 1468 1 2 . 1 1 126 126 PHE CB C 126 40.300 40.300 39.967 0.333 25155 1469 1 2 . 1 1 126 126 PHE H H 126 7.645 7.645 8.091 -0.446 25155 1470 1 2 . 1 1 127 127 THR N N 127 107.038 107.038 114.522 -7.484 25155 1471 1 2 . 1 1 127 127 THR HA H 127 4.370 4.370 4.159 0.211 25155 1472 1 2 . 1 1 127 127 THR C C 127 175.100 175.100 175.166 -0.066 25155 1473 1 2 . 1 1 127 127 THR CA C 127 61.080 61.080 61.888 -0.808 25155 1474 1 2 . 1 1 127 127 THR CB C 127 70.500 70.500 69.937 0.563 25155 1475 1 2 . 1 1 127 127 THR H H 127 7.306 7.306 8.825 -1.519 25155 1476 1 2 . 1 1 128 128 SER N N 128 118.150 118.150 120.555 -2.405 25155 1477 1 2 . 1 1 128 128 SER HA H 128 4.650 4.650 4.399 0.251 25155 1478 1 2 . 1 1 128 128 SER C C 128 175.760 175.760 174.069 1.691 25155 1479 1 2 . 1 1 128 128 SER CA C 128 55.813 55.813 58.730 -2.917 25155 1480 1 2 . 1 1 128 128 SER CB C 128 65.300 65.300 63.461 1.839 25155 1481 1 2 . 1 1 128 128 SER H H 128 7.354 7.354 7.884 -0.530 25155 1482 1 2 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.577 0.187 25155 1483 1 2 . 1 1 129 129 PRO C C 129 178.860 178.860 177.854 1.006 25155 1484 1 2 . 1 1 129 129 PRO CA C 129 62.728 62.728 64.498 -1.770 25155 1485 1 2 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.490 -0.090 25155 1486 1 2 . 1 1 130 130 LYS N N 130 122.158 122.158 119.481 2.677 25155 1487 1 2 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.137 0.073 25155 1488 1 2 . 1 1 130 130 LYS C C 130 176.890 176.890 175.598 1.292 25155 1489 1 2 . 1 1 130 130 LYS CA C 130 61.375 61.375 60.276 1.099 25155 1490 1 2 . 1 1 130 130 LYS CB C 130 30.350 30.350 31.205 -0.855 25155 1491 1 2 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.432 0.101 25155 1492 1 2 . 1 1 131 131 PRO C C 131 173.810 173.810 175.312 -1.502 25155 1493 1 2 . 1 1 131 131 PRO CA C 131 64.510 64.510 62.593 1.917 25155 1494 1 2 . 1 1 131 131 PRO CB C 131 31.745 31.745 30.936 0.809 25155 1495 1 2 . 1 1 132 132 VAL N N 132 114.480 114.480 114.332 0.148 25155 1496 1 2 . 1 1 132 132 VAL HA H 132 5.158 5.158 5.085 0.073 25155 1497 1 2 . 1 1 132 132 VAL C C 132 175.137 175.137 174.415 0.722 25155 1498 1 2 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.426 0.374 25155 1499 1 2 . 1 1 132 132 VAL CB C 132 34.780 34.780 35.444 -0.664 25155 1500 1 2 . 1 1 132 132 VAL H H 132 6.716 6.716 7.579 -0.863 25155 1501 1 2 . 1 1 133 133 ILE N N 133 120.670 120.670 115.572 5.098 25155 1502 1 2 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.557 -0.165 25155 1503 1 2 . 1 1 133 133 ILE C C 133 175.485 175.485 175.704 -0.219 25155 1504 1 2 . 1 1 133 133 ILE CA C 133 60.000 60.000 59.303 0.697 25155 1505 1 2 . 1 1 133 133 ILE CB C 133 42.020 42.020 40.819 1.201 25155 1506 1 2 . 1 1 133 133 ILE H H 133 8.740 8.740 7.717 1.023 25155 1507 1 2 . 1 1 134 134 ALA N N 134 122.454 122.454 124.051 -1.597 25155 1508 1 2 . 1 1 134 134 ALA HA H 134 3.953 3.953 3.954 -0.001 25155 1509 1 2 . 1 1 134 134 ALA C C 134 178.387 178.387 176.694 1.693 25155 1510 1 2 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.243 -0.193 25155 1511 1 2 . 1 1 134 134 ALA CB C 134 16.982 16.982 16.943 0.039 25155 1512 1 2 . 1 1 134 134 ALA H H 134 8.490 8.490 8.516 -0.026 25155 1513 1 2 . 1 1 135 135 ASP N N 135 117.310 117.310 117.134 0.176 25155 1514 1 2 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.331 -0.087 25155 1515 1 2 . 1 1 135 135 ASP C C 135 176.390 176.390 176.196 0.194 25155 1516 1 2 . 1 1 135 135 ASP CA C 135 55.120 55.120 54.597 0.523 25155 1517 1 2 . 1 1 135 135 ASP CB C 135 39.865 39.865 40.226 -0.361 25155 1518 1 2 . 1 1 136 136 GLY N N 136 104.336 104.336 105.572 -1.236 25155 1519 1 2 . 1 1 136 136 GLY C C 136 174.940 174.940 174.726 0.214 25155 1520 1 2 . 1 1 136 136 GLY CA C 136 45.150 45.150 45.071 0.079 25155 1521 1 2 . 1 1 136 136 GLY H H 136 7.592 7.592 8.012 -0.420 25155 1522 1 2 . 1 1 137 137 GLN N N 137 118.675 118.675 119.277 -0.602 25155 1523 1 2 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.627 -0.565 25155 1524 1 2 . 1 1 137 137 GLN C C 137 176.420 176.420 174.921 1.499 25155 1525 1 2 . 1 1 137 137 GLN CA C 137 57.760 57.760 56.425 1.335 25155 1526 1 2 . 1 1 137 137 GLN CB C 137 30.400 30.400 31.418 -1.018 25155 1527 1 2 . 1 1 137 137 GLN H H 137 7.843 7.843 8.391 -0.548 25155 1528 1 2 . 1 1 138 138 LEU N N 138 118.160 118.160 118.840 -0.680 25155 1529 1 2 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.978 -0.017 25155 1530 1 2 . 1 1 138 138 LEU C C 138 175.700 175.700 176.268 -0.568 25155 1531 1 2 . 1 1 138 138 LEU CA C 138 53.705 53.705 53.452 0.253 25155 1532 1 2 . 1 1 138 138 LEU CB C 138 46.480 46.480 44.943 1.537 25155 1533 1 2 . 1 1 138 138 LEU H H 138 7.356 7.356 7.337 0.019 25155 1534 1 2 . 1 1 139 139 PHE N N 139 119.060 119.060 121.906 -2.846 25155 1535 1 2 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.411 0.933 25155 1536 1 2 . 1 1 139 139 PHE C C 139 178.850 178.850 176.270 2.580 25155 1537 1 2 . 1 1 139 139 PHE CA C 139 56.670 56.670 58.714 -2.044 25155 1538 1 2 . 1 1 139 139 PHE CB C 139 43.652 43.652 38.410 5.242 25155 1539 1 2 . 1 1 139 139 PHE H H 139 10.026 10.026 8.769 1.257 25155 1540 1 2 . 1 1 140 140 VAL N N 140 109.905 109.905 111.384 -1.479 25155 1541 1 2 . 1 1 140 140 VAL HA H 140 3.500 3.500 2.090 1.410 25155 1542 1 2 . 1 1 140 140 VAL C C 140 172.860 172.860 174.005 -1.145 25155 1543 1 2 . 1 1 140 140 VAL CA C 140 61.812 61.812 62.858 -1.046 25155 1544 1 2 . 1 1 140 140 VAL CB C 140 30.250 30.250 29.766 0.484 25155 1545 1 2 . 1 1 140 140 VAL H H 140 7.550 7.550 7.394 0.156 25155 1546 1 2 . 1 1 141 141 GLY N N 141 106.600 106.600 105.254 1.346 25155 1547 1 2 . 1 1 141 141 GLY C C 141 171.350 171.350 172.858 -1.508 25155 1548 1 2 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.589 0.871 25155 1549 1 2 . 1 1 141 141 GLY H H 141 7.052 7.052 7.171 -0.119 25155 1550 1 2 . 1 1 142 142 LEU N N 142 117.820 117.820 119.580 -1.760 25155 1551 1 2 . 1 1 142 142 LEU HA H 142 4.962 4.962 4.135 0.827 25155 1552 1 2 . 1 1 142 142 LEU CA C 142 55.600 55.600 54.026 1.574 25155 1553 1 2 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.702 -4.772 25155 1554 1 2 . 1 1 142 142 LEU H H 142 7.643 7.643 8.063 -0.420 25155 1555 1 2 . 1 1 143 143 ALA HA H 143 4.220 4.220 3.906 0.314 25155 1556 1 2 . 1 1 143 143 ALA C C 143 175.505 175.505 175.914 -0.409 25155 1557 1 2 . 1 1 143 143 ALA CA C 143 49.600 49.600 49.882 -0.282 25155 1558 1 2 . 1 1 143 143 ALA CB C 143 23.330 23.330 17.776 5.554 25155 1559 1 2 . 1 1 144 144 LEU N N 144 124.960 124.960 124.491 0.469 25155 1560 1 2 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.419 0.361 25155 1561 1 2 . 1 1 144 144 LEU C C 144 174.700 174.700 175.265 -0.565 25155 1562 1 2 . 1 1 144 144 LEU CA C 144 52.790 52.790 53.699 -0.909 25155 1563 1 2 . 1 1 144 144 LEU CB C 144 45.300 45.300 43.812 1.488 25155 1564 1 2 . 1 1 144 144 LEU H H 144 8.583 8.583 8.239 0.344 25155 1565 1 2 . 1 1 145 145 ASP N N 145 119.100 119.100 119.457 -0.357 25155 1566 1 2 . 1 1 145 145 ASP HA H 145 5.422 5.422 5.094 0.328 25155 1567 1 2 . 1 1 145 145 ASP C C 145 176.180 176.180 174.554 1.626 25155 1568 1 2 . 1 1 145 145 ASP CA C 145 53.600 53.600 53.594 0.006 25155 1569 1 2 . 1 1 145 145 ASP CB C 145 43.180 43.180 44.361 -1.181 25155 1570 1 2 . 1 1 147 147 THR HA H 147 4.093 4.093 4.475 -0.382 25155 1571 1 2 . 1 1 147 147 THR C C 147 175.858 175.858 175.351 0.507 25155 1572 1 2 . 1 1 147 147 THR CA C 147 66.400 66.400 64.178 2.222 25155 1573 1 2 . 1 1 147 147 THR CB C 147 69.400 69.400 69.979 -0.579 25155 1574 1 2 . 1 1 147 147 THR H H 147 8.745 8.745 8.914 -0.169 25155 1575 1 2 . 1 1 148 148 ASN N N 148 115.408 115.408 118.373 -2.965 25155 1576 1 2 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.725 0.285 25155 1577 1 2 . 1 1 148 148 ASN C C 148 175.750 175.750 175.485 0.265 25155 1578 1 2 . 1 1 148 148 ASN CA C 148 53.400 53.400 54.984 -1.584 25155 1579 1 2 . 1 1 148 148 ASN CB C 148 41.900 41.900 39.568 2.332 25155 1580 1 2 . 1 1 148 148 ASN H H 148 8.975 8.975 8.813 0.162 25155 1581 1 2 . 1 1 149 149 GLN N N 149 117.900 117.900 116.953 0.947 25155 1582 1 2 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.658 0.278 25155 1583 1 2 . 1 1 149 149 GLN C C 149 178.280 178.280 174.646 3.634 25155 1584 1 2 . 1 1 149 149 GLN CA C 149 53.730 53.730 55.018 -1.288 25155 1585 1 2 . 1 1 149 149 GLN CB C 149 29.790 29.790 32.214 -2.424 25155 1586 1 2 . 1 1 149 149 GLN H H 149 7.430 7.430 8.346 -0.916 25155 1587 1 2 . 1 1 150 150 TYR N N 150 121.060 121.060 119.808 1.252 25155 1588 1 2 . 1 1 150 150 TYR HA H 150 4.671 4.671 4.613 0.058 25155 1589 1 2 . 1 1 150 150 TYR C C 150 178.680 178.680 175.982 2.698 25155 1590 1 2 . 1 1 150 150 TYR CA C 150 57.930 57.930 59.942 -2.012 25155 1591 1 2 . 1 1 150 150 TYR CB C 150 38.860 38.860 40.376 -1.516 25155 1592 1 2 . 1 1 150 150 TYR H H 150 8.115 8.115 8.652 -0.537 25155 1593 1 2 . 1 1 151 151 ASP N N 151 121.175 121.175 120.519 0.656 25155 1594 1 2 . 1 1 151 151 ASP CA C 151 57.000 57.000 56.890 0.110 25155 1595 1 2 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.667 1.333 25155 1596 1 2 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.527 0.063 25155 1597 1 2 . 1 1 152 152 LEU C C 152 178.300 178.300 177.469 0.831 25155 1598 1 2 . 1 1 152 152 LEU CA C 152 54.788 54.788 56.155 -1.367 25155 1599 1 2 . 1 1 152 152 LEU CB C 152 42.200 42.200 41.852 0.347 25155 1600 1 2 . 1 1 153 153 SER N N 153 116.170 116.170 117.281 -1.111 25155 1601 1 2 . 1 1 153 153 SER HA H 153 3.911 3.911 4.018 -0.107 25155 1602 1 2 . 1 1 153 153 SER CA C 153 63.400 63.400 62.639 0.761 25155 1603 1 2 . 1 1 153 153 SER CB C 153 63.200 63.200 62.780 0.420 25155 1604 1 2 . 1 1 153 153 SER H H 153 7.378 7.378 7.762 -0.384 25155 1605 1 2 . 1 1 154 154 ASP N N 154 121.640 121.640 120.714 0.926 25155 1606 1 2 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.331 -0.091 25155 1607 1 2 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.616 1.684 25155 1608 1 2 . 1 1 154 154 ASP CB C 154 40.000 40.000 40.959 -0.959 25155 1609 1 2 . 1 1 155 155 GLU HA H 155 4.170 4.170 4.017 0.153 25155 1610 1 2 . 1 1 155 155 GLU C C 155 179.420 179.420 179.021 0.399 25155 1611 1 2 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.267 -0.067 25155 1612 1 2 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.423 0.057 25155 1613 1 2 . 1 1 156 156 ARG N N 156 121.230 121.230 118.597 2.633 25155 1614 1 2 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.247 0.029 25155 1615 1 2 . 1 1 156 156 ARG C C 156 177.350 177.350 179.372 -2.022 25155 1616 1 2 . 1 1 156 156 ARG CA C 156 59.950 59.950 59.466 0.484 25155 1617 1 2 . 1 1 156 156 ARG CB C 156 31.100 31.100 30.202 0.898 25155 1618 1 2 . 1 1 157 157 ILE N N 157 118.190 118.190 119.874 -1.684 25155 1619 1 2 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.702 -0.272 25155 1620 1 2 . 1 1 157 157 ILE C C 157 178.480 178.480 177.833 0.647 25155 1621 1 2 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.296 1.264 25155 1622 1 2 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.908 0.572 25155 1623 1 2 . 1 1 157 157 ILE H H 157 8.705 8.705 7.625 1.080 25155 1624 1 2 . 1 1 158 158 GLN N N 158 119.975 119.975 120.493 -0.518 25155 1625 1 2 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.873 0.083 25155 1626 1 2 . 1 1 158 158 GLN C C 158 178.730 178.730 178.323 0.407 25155 1627 1 2 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.301 1.399 25155 1628 1 2 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.308 0.174 25155 1629 1 2 . 1 1 158 158 GLN H H 158 8.262 8.262 8.587 -0.325 25155 1630 1 2 . 1 1 159 159 SER N N 159 115.466 115.466 115.208 0.258 25155 1631 1 2 . 1 1 159 159 SER HA H 159 4.446 4.446 4.275 0.171 25155 1632 1 2 . 1 1 159 159 SER C C 159 177.320 177.320 176.813 0.507 25155 1633 1 2 . 1 1 159 159 SER CA C 159 63.500 63.500 61.149 2.351 25155 1634 1 2 . 1 1 159 159 SER CB C 159 63.818 63.818 63.180 0.638 25155 1635 1 2 . 1 1 159 159 SER H H 159 8.440 8.440 8.187 0.253 25155 1636 1 2 . 1 1 160 160 TRP N N 160 126.784 126.784 124.930 1.854 25155 1637 1 2 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.437 0.017 25155 1638 1 2 . 1 1 160 160 TRP C C 160 177.934 177.934 177.773 0.161 25155 1639 1 2 . 1 1 160 160 TRP CA C 160 62.745 62.745 62.206 0.539 25155 1640 1 2 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.422 -0.072 25155 1641 1 2 . 1 1 160 160 TRP H H 160 9.243 9.243 7.697 1.546 25155 1642 1 2 . 1 1 161 161 CYS N N 161 116.395 116.395 118.324 -1.929 25155 1643 1 2 . 1 1 161 161 CYS HA H 161 3.886 3.886 3.857 0.029 25155 1644 1 2 . 1 1 161 161 CYS C C 161 176.245 176.245 177.099 -0.854 25155 1645 1 2 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.606 0.694 25155 1646 1 2 . 1 1 161 161 CYS CB C 161 27.723 27.723 27.213 0.510 25155 1647 1 2 . 1 1 161 161 CYS H H 161 8.845 8.845 9.065 -0.220 25155 1648 1 2 . 1 1 162 162 GLU N N 162 118.030 118.030 119.495 -1.465 25155 1649 1 2 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.874 0.046 25155 1650 1 2 . 1 1 162 162 GLU C C 162 178.700 178.700 178.735 -0.035 25155 1651 1 2 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.525 0.275 25155 1652 1 2 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.248 0.252 25155 1653 1 2 . 1 1 163 163 GLN N N 163 120.650 120.650 119.804 0.846 25155 1654 1 2 . 1 1 163 163 GLN HA H 163 4.173 4.173 3.946 0.227 25155 1655 1 2 . 1 1 163 163 GLN C C 163 179.700 179.700 178.309 1.391 25155 1656 1 2 . 1 1 163 163 GLN CA C 163 59.688 59.688 59.239 0.449 25155 1657 1 2 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.754 0.146 25155 1658 1 2 . 1 1 163 163 GLN H H 163 8.148 8.148 7.911 0.237 25155 1659 1 2 . 1 1 164 164 ILE N N 164 114.836 114.836 117.108 -2.272 25155 1660 1 2 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.587 0.473 25155 1661 1 2 . 1 1 164 164 ILE C C 164 178.676 178.676 177.664 1.012 25155 1662 1 2 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.456 1.704 25155 1663 1 2 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.328 0.302 25155 1664 1 2 . 1 1 164 164 ILE H H 164 8.958 8.958 8.170 0.788 25155 1665 1 2 . 1 1 165 165 LEU N N 165 123.700 123.700 120.636 3.064 25155 1666 1 2 . 1 1 165 165 LEU HA H 165 4.100 4.100 3.984 0.116 25155 1667 1 2 . 1 1 165 165 LEU C C 165 180.548 180.548 178.578 1.970 25155 1668 1 2 . 1 1 165 165 LEU CA C 165 58.150 58.150 58.359 -0.209 25155 1669 1 2 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.335 -0.205 25155 1670 1 2 . 1 1 165 165 LEU H H 165 7.830 7.830 7.921 -0.091 25155 1671 1 2 . 1 1 166 166 ASN N N 166 120.160 120.160 118.463 1.697 25155 1672 1 2 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.372 0.198 25155 1673 1 2 . 1 1 166 166 ASN C C 166 175.690 175.690 177.444 -1.754 25155 1674 1 2 . 1 1 166 166 ASN CA C 166 55.946 55.946 57.020 -1.074 25155 1675 1 2 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.368 0.112 25155 1676 1 2 . 1 1 166 166 ASN H H 166 7.706 7.706 7.952 -0.246 25155 1677 1 2 . 1 1 167 167 GLU N N 167 121.286 121.286 121.408 -0.122 25155 1678 1 2 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.356 -0.252 25155 1679 1 2 . 1 1 167 167 GLU C C 167 180.520 180.520 179.369 1.151 25155 1680 1 2 . 1 1 167 167 GLU CA C 167 59.920 59.920 59.200 0.720 25155 1681 1 2 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.800 1.125 25155 1682 1 2 . 1 1 168 168 MET N N 168 118.622 118.622 115.959 2.663 25155 1683 1 2 . 1 1 168 168 MET HA H 168 3.996 3.996 4.389 -0.393 25155 1684 1 2 . 1 1 168 168 MET C C 168 176.856 176.856 177.660 -0.804 25155 1685 1 2 . 1 1 168 168 MET CA C 168 59.500 59.500 58.473 1.027 25155 1686 1 2 . 1 1 168 168 MET CB C 168 33.700 33.700 32.743 0.957 25155 1687 1 2 . 1 1 168 168 MET H H 168 8.723 8.723 8.373 0.350 25155 1688 1 2 . 1 1 169 169 ALA N N 169 121.760 121.760 122.349 -0.589 25155 1689 1 2 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.301 -0.144 25155 1690 1 2 . 1 1 169 169 ALA C C 169 179.790 179.790 180.136 -0.346 25155 1691 1 2 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.153 0.647 25155 1692 1 2 . 1 1 169 169 ALA CB C 169 18.220 18.220 19.310 -1.090 25155 1693 1 2 . 1 1 169 169 ALA H H 169 7.494 7.494 7.530 -0.036 25155 1694 1 2 . 1 1 170 170 GLU N N 170 116.970 116.970 119.331 -2.361 25155 1695 1 2 . 1 1 170 170 GLU HA H 170 4.091 4.091 4.079 0.012 25155 1696 1 2 . 1 1 170 170 GLU C C 170 177.745 177.745 178.926 -1.181 25155 1697 1 2 . 1 1 170 170 GLU CA C 170 58.000 58.000 58.752 -0.751 25155 1698 1 2 . 1 1 170 170 GLU CB C 170 29.730 29.730 29.319 0.411 25155 1699 1 2 . 1 1 171 171 HIS N N 171 118.150 118.150 119.794 -1.644 25155 1700 1 2 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.277 0.193 25155 1701 1 2 . 1 1 171 171 HIS C C 171 175.848 175.848 176.259 -0.411 25155 1702 1 2 . 1 1 171 171 HIS CA C 171 57.600 57.600 58.814 -1.214 25155 1703 1 2 . 1 1 171 171 HIS CB C 171 30.800 30.800 29.774 1.026 25155 1704 1 2 . 1 1 171 171 HIS H H 171 7.717 7.717 8.012 -0.295 25155 1705 1 2 . 1 1 172 172 TYR N N 172 119.483 119.483 117.810 1.673 25155 1706 1 2 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.445 0.146 25155 1707 1 2 . 1 1 172 172 TYR C C 172 174.590 174.590 175.627 -1.037 25155 1708 1 2 . 1 1 172 172 TYR CA C 172 57.813 57.813 58.049 -0.236 25155 1709 1 2 . 1 1 172 172 TYR CB C 172 38.900 38.900 38.804 0.096 25155 1710 1 2 . 1 1 172 172 TYR H H 172 7.778 7.778 7.884 -0.106 25155 1711 1 3 . 1 1 2 2 ASN N N 2 122.966 122.966 118.985 3.981 25155 1712 1 3 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.139 0.036 25155 1713 1 3 . 1 1 2 2 ASN C C 2 175.200 175.200 174.143 1.057 25155 1714 1 3 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.864 0.056 25155 1715 1 3 . 1 1 2 2 ASN CB C 2 40.000 40.000 41.518 -1.518 25155 1716 1 3 . 1 1 2 2 ASN H H 2 9.392 9.392 8.344 1.048 25155 1717 1 3 . 1 1 3 3 MET N N 3 120.660 120.660 121.329 -0.669 25155 1718 1 3 . 1 1 3 3 MET HA H 3 5.565 5.565 5.109 0.456 25155 1719 1 3 . 1 1 3 3 MET C C 3 174.200 174.200 175.509 -1.309 25155 1720 1 3 . 1 1 3 3 MET CA C 3 54.550 54.550 53.978 0.572 25155 1721 1 3 . 1 1 3 3 MET CB C 3 34.100 34.100 34.667 -0.568 25155 1722 1 3 . 1 1 3 3 MET H H 3 8.745 8.745 9.013 -0.268 25155 1723 1 3 . 1 1 4 4 GLY N N 4 115.792 115.792 109.792 6.000 25155 1724 1 3 . 1 1 4 4 GLY C C 4 170.444 170.444 172.230 -1.786 25155 1725 1 3 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.478 -0.591 25155 1726 1 3 . 1 1 4 4 GLY H H 4 8.989 8.989 8.924 0.065 25155 1727 1 3 . 1 1 5 5 LEU N N 5 131.175 131.175 124.898 6.277 25155 1728 1 3 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.331 0.991 25155 1729 1 3 . 1 1 5 5 LEU C C 5 175.700 175.700 174.769 0.931 25155 1730 1 3 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.737 -0.417 25155 1731 1 3 . 1 1 5 5 LEU CB C 5 44.700 44.700 43.864 0.836 25155 1732 1 3 . 1 1 5 5 LEU H H 5 8.917 8.917 8.114 0.803 25155 1733 1 3 . 1 1 6 6 PHE N N 6 125.990 125.990 125.402 0.588 25155 1734 1 3 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.762 -0.024 25155 1735 1 3 . 1 1 6 6 PHE C C 6 174.358 174.358 173.461 0.897 25155 1736 1 3 . 1 1 6 6 PHE CA C 6 55.480 55.480 55.080 0.400 25155 1737 1 3 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.817 -0.767 25155 1738 1 3 . 1 1 6 6 PHE H H 6 9.225 9.225 9.399 -0.174 25155 1739 1 3 . 1 1 7 7 TYR N N 7 118.040 118.040 117.646 0.394 25155 1740 1 3 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.493 0.436 25155 1741 1 3 . 1 1 7 7 TYR C C 7 171.690 171.690 173.865 -2.175 25155 1742 1 3 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.714 -1.254 25155 1743 1 3 . 1 1 7 7 TYR CB C 7 40.800 40.800 40.840 -0.040 25155 1744 1 3 . 1 1 7 7 TYR H H 7 8.235 8.235 8.172 0.063 25155 1745 1 3 . 1 1 8 8 GLY N N 8 106.640 106.640 107.723 -1.083 25155 1746 1 3 . 1 1 8 8 GLY C C 8 171.682 171.682 173.062 -1.380 25155 1747 1 3 . 1 1 8 8 GLY CA C 8 44.050 44.050 45.864 -1.814 25155 1748 1 3 . 1 1 8 8 GLY H H 8 6.996 6.996 8.801 -1.805 25155 1749 1 3 . 1 1 9 9 SER N N 9 118.164 118.164 119.902 -1.738 25155 1750 1 3 . 1 1 9 9 SER C C 9 174.560 174.560 174.292 0.268 25155 1751 1 3 . 1 1 9 9 SER CA C 9 57.140 57.140 56.852 0.288 25155 1752 1 3 . 1 1 9 9 SER H H 9 9.680 9.680 8.025 1.655 25155 1753 1 3 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.964 -0.334 25155 1754 1 3 . 1 1 17 17 ALA C C 17 177.740 177.740 178.497 -0.757 25155 1755 1 3 . 1 1 17 17 ALA CA C 17 54.900 54.900 55.592 -0.692 25155 1756 1 3 . 1 1 17 17 ALA CB C 17 17.790 17.790 18.153 -0.363 25155 1757 1 3 . 1 1 17 17 ALA H H 17 8.055 8.055 8.745 -0.690 25155 1758 1 3 . 1 1 18 18 ALA N N 18 120.026 120.026 121.427 -1.401 25155 1759 1 3 . 1 1 18 18 ALA HA H 18 3.713 3.713 3.930 -0.217 25155 1760 1 3 . 1 1 18 18 ALA C C 18 179.040 179.040 179.390 -0.350 25155 1761 1 3 . 1 1 18 18 ALA CA C 18 54.860 54.860 55.519 -0.659 25155 1762 1 3 . 1 1 18 18 ALA CB C 18 18.200 18.200 17.641 0.559 25155 1763 1 3 . 1 1 18 18 ALA H H 18 7.015 7.015 7.727 -0.712 25155 1764 1 3 . 1 1 19 19 GLU N N 19 116.656 116.656 118.626 -1.970 25155 1765 1 3 . 1 1 19 19 GLU HA H 19 3.580 3.580 3.907 -0.327 25155 1766 1 3 . 1 1 19 19 GLU C C 19 178.487 178.487 178.817 -0.330 25155 1767 1 3 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.036 0.634 25155 1768 1 3 . 1 1 19 19 GLU CB C 19 29.400 29.400 28.614 0.786 25155 1769 1 3 . 1 1 20 20 LYS N N 20 120.100 120.100 119.634 0.466 25155 1770 1 3 . 1 1 20 20 LYS HA H 20 4.346 4.346 3.930 0.416 25155 1771 1 3 . 1 1 20 20 LYS C C 20 175.330 175.330 179.237 -3.907 25155 1772 1 3 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.780 -2.680 25155 1773 1 3 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.331 0.669 25155 1774 1 3 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.646 -0.181 25155 1775 1 3 . 1 1 21 21 ILE C C 21 177.680 177.680 178.026 -0.346 25155 1776 1 3 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.637 0.003 25155 1777 1 3 . 1 1 21 21 ILE CB C 21 38.030 38.030 37.871 0.159 25155 1778 1 3 . 1 1 21 21 ILE H H 21 8.220 8.220 8.571 -0.351 25155 1779 1 3 . 1 1 22 22 ARG N N 22 119.433 119.433 119.804 -0.371 25155 1780 1 3 . 1 1 22 22 ARG HA H 22 3.550 3.550 3.895 -0.345 25155 1781 1 3 . 1 1 22 22 ARG C C 22 177.268 177.268 178.348 -1.080 25155 1782 1 3 . 1 1 22 22 ARG CA C 22 59.760 59.760 59.673 0.087 25155 1783 1 3 . 1 1 22 22 ARG CB C 22 28.900 28.900 30.025 -1.125 25155 1784 1 3 . 1 1 23 23 ASP N N 23 118.945 118.945 119.182 -0.237 25155 1785 1 3 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.442 -0.100 25155 1786 1 3 . 1 1 23 23 ASP C C 23 178.470 178.470 178.925 -0.455 25155 1787 1 3 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.284 0.166 25155 1788 1 3 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.856 -0.486 25155 1789 1 3 . 1 1 24 24 ILE N N 24 121.200 121.200 119.323 1.877 25155 1790 1 3 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.793 -0.059 25155 1791 1 3 . 1 1 24 24 ILE C C 24 178.297 178.297 177.912 0.385 25155 1792 1 3 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.415 0.086 25155 1793 1 3 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.477 0.263 25155 1794 1 3 . 1 1 24 24 ILE H H 24 8.160 8.160 7.953 0.207 25155 1795 1 3 . 1 1 25 25 ILE N N 25 121.166 121.166 117.731 3.435 25155 1796 1 3 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.878 -0.235 25155 1797 1 3 . 1 1 25 25 ILE C C 25 176.825 176.825 176.662 0.163 25155 1798 1 3 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.111 2.779 25155 1799 1 3 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.783 -1.033 25155 1800 1 3 . 1 1 25 25 ILE H H 25 8.480 8.480 7.952 0.528 25155 1801 1 3 . 1 1 26 26 GLY N N 26 109.050 109.050 104.873 4.177 25155 1802 1 3 . 1 1 26 26 GLY C C 26 173.800 173.800 172.315 1.485 25155 1803 1 3 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.503 -0.103 25155 1804 1 3 . 1 1 26 26 GLY H H 26 7.945 7.945 7.715 0.230 25155 1805 1 3 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.403 -0.040 25155 1806 1 3 . 1 1 27 27 PRO C C 27 177.157 177.157 177.320 -0.163 25155 1807 1 3 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.949 0.581 25155 1808 1 3 . 1 1 27 27 PRO CB C 27 32.000 32.000 32.059 -0.059 25155 1809 1 3 . 1 1 28 28 GLU N N 28 116.510 116.510 117.060 -0.550 25155 1810 1 3 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.215 0.045 25155 1811 1 3 . 1 1 28 28 GLU C C 28 177.000 177.000 176.832 0.168 25155 1812 1 3 . 1 1 28 28 GLU CA C 28 57.680 57.680 58.087 -0.407 25155 1813 1 3 . 1 1 28 28 GLU CB C 28 28.620 28.620 29.102 -0.482 25155 1814 1 3 . 1 1 29 29 LEU N N 29 120.334 120.334 112.983 7.351 25155 1815 1 3 . 1 1 29 29 LEU HA H 29 4.650 4.650 5.005 -0.355 25155 1816 1 3 . 1 1 29 29 LEU C C 29 175.676 175.676 175.382 0.294 25155 1817 1 3 . 1 1 29 29 LEU CA C 29 55.924 55.924 54.846 1.078 25155 1818 1 3 . 1 1 29 29 LEU CB C 29 44.880 44.880 44.557 0.323 25155 1819 1 3 . 1 1 29 29 LEU H H 29 7.924 7.924 7.509 0.415 25155 1820 1 3 . 1 1 30 30 VAL N N 30 118.900 118.900 121.482 -2.582 25155 1821 1 3 . 1 1 30 30 VAL HA H 30 4.639 4.639 4.821 -0.182 25155 1822 1 3 . 1 1 30 30 VAL C C 30 174.368 174.368 176.117 -1.749 25155 1823 1 3 . 1 1 30 30 VAL CA C 30 61.110 61.110 62.051 -0.941 25155 1824 1 3 . 1 1 30 30 VAL CB C 30 34.500 34.500 33.637 0.863 25155 1825 1 3 . 1 1 30 30 VAL H H 30 7.486 7.486 7.774 -0.288 25155 1826 1 3 . 1 1 31 31 THR N N 31 124.000 124.000 119.759 4.241 25155 1827 1 3 . 1 1 31 31 THR HA H 31 4.331 4.331 4.665 -0.334 25155 1828 1 3 . 1 1 31 31 THR C C 31 172.670 172.670 172.912 -0.242 25155 1829 1 3 . 1 1 31 31 THR CA C 31 61.784 61.784 61.540 0.244 25155 1830 1 3 . 1 1 31 31 THR CB C 31 70.483 70.483 71.081 -0.598 25155 1831 1 3 . 1 1 31 31 THR H H 31 7.947 7.947 8.399 -0.452 25155 1832 1 3 . 1 1 32 32 LEU N N 32 127.408 127.408 124.731 2.677 25155 1833 1 3 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.628 0.009 25155 1834 1 3 . 1 1 32 32 LEU C C 32 176.425 176.425 177.185 -0.760 25155 1835 1 3 . 1 1 32 32 LEU CA C 32 54.760 54.760 55.050 -0.290 25155 1836 1 3 . 1 1 32 32 LEU CB C 32 43.809 43.809 43.023 0.786 25155 1837 1 3 . 1 1 32 32 LEU H H 32 8.614 8.614 8.494 0.120 25155 1838 1 3 . 1 1 33 33 HIS N N 33 120.230 120.230 123.885 -3.655 25155 1839 1 3 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.984 -0.564 25155 1840 1 3 . 1 1 33 33 HIS C C 33 171.914 171.914 173.955 -2.041 25155 1841 1 3 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.769 0.531 25155 1842 1 3 . 1 1 33 33 HIS CB C 33 32.050 32.050 30.491 1.559 25155 1843 1 3 . 1 1 33 33 HIS H H 33 9.130 9.130 9.139 -0.009 25155 1844 1 3 . 1 1 34 34 ASN N N 34 123.987 123.987 121.574 2.413 25155 1845 1 3 . 1 1 34 34 ASN HA H 34 3.600 3.600 4.074 -0.474 25155 1846 1 3 . 1 1 34 34 ASN C C 34 177.930 177.930 175.827 2.103 25155 1847 1 3 . 1 1 34 34 ASN CA C 34 51.730 51.730 52.146 -0.416 25155 1848 1 3 . 1 1 34 34 ASN CB C 34 38.747 38.747 38.413 0.334 25155 1849 1 3 . 1 1 34 34 ASN H H 34 8.759 8.759 8.087 0.672 25155 1850 1 3 . 1 1 35 35 LEU N N 35 128.751 128.751 126.194 2.557 25155 1851 1 3 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.201 0.089 25155 1852 1 3 . 1 1 35 35 LEU C C 35 177.363 177.363 178.118 -0.755 25155 1853 1 3 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.349 0.201 25155 1854 1 3 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.517 1.245 25155 1855 1 3 . 1 1 35 35 LEU H H 35 8.758 8.758 8.737 0.021 25155 1856 1 3 . 1 1 36 36 LYS N N 36 120.870 120.870 118.776 2.094 25155 1857 1 3 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.229 -0.296 25155 1858 1 3 . 1 1 36 36 LYS C C 36 176.540 176.540 177.057 -0.517 25155 1859 1 3 . 1 1 36 36 LYS CA C 36 59.260 59.260 58.147 1.113 25155 1860 1 3 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.551 0.249 25155 1861 1 3 . 1 1 37 37 ASP N N 37 115.288 115.288 115.734 -0.446 25155 1862 1 3 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.747 0.000 25155 1863 1 3 . 1 1 37 37 ASP C C 37 175.500 175.500 176.119 -0.619 25155 1864 1 3 . 1 1 37 37 ASP CA C 37 54.805 54.805 54.688 0.117 25155 1865 1 3 . 1 1 37 37 ASP CB C 37 44.650 44.650 43.498 1.151 25155 1866 1 3 . 1 1 38 38 ASP N N 38 121.550 121.550 121.334 0.216 25155 1867 1 3 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.898 -0.033 25155 1868 1 3 . 1 1 38 38 ASP C C 38 174.895 174.895 175.967 -1.072 25155 1869 1 3 . 1 1 38 38 ASP CA C 38 52.840 52.840 54.188 -1.347 25155 1870 1 3 . 1 1 38 38 ASP CB C 38 42.240 42.240 42.345 -0.105 25155 1871 1 3 . 1 1 39 39 SER N N 39 115.170 115.170 117.990 -2.820 25155 1872 1 3 . 1 1 39 39 SER HA H 39 4.600 4.600 4.655 -0.055 25155 1873 1 3 . 1 1 39 39 SER C C 39 174.930 174.930 174.360 0.570 25155 1874 1 3 . 1 1 39 39 SER CA C 39 54.786 54.786 56.847 -2.061 25155 1875 1 3 . 1 1 39 39 SER CB C 39 64.840 64.840 63.400 1.440 25155 1876 1 3 . 1 1 39 39 SER H H 39 8.330 8.330 8.681 -0.351 25155 1877 1 3 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.493 -0.493 25155 1878 1 3 . 1 1 40 40 PRO C C 40 176.620 176.620 177.986 -1.366 25155 1879 1 3 . 1 1 40 40 PRO CA C 40 63.870 63.870 64.862 -0.992 25155 1880 1 3 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.787 -0.427 25155 1881 1 3 . 1 1 41 41 LYS N N 41 120.913 120.913 117.935 2.978 25155 1882 1 3 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.171 -0.275 25155 1883 1 3 . 1 1 41 41 LYS C C 41 179.580 179.580 178.385 1.195 25155 1884 1 3 . 1 1 41 41 LYS CA C 41 58.000 58.000 57.735 0.265 25155 1885 1 3 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.179 0.921 25155 1886 1 3 . 1 1 42 42 LEU N N 42 118.206 118.206 120.640 -2.434 25155 1887 1 3 . 1 1 42 42 LEU HA H 42 4.025 4.025 3.879 0.146 25155 1888 1 3 . 1 1 42 42 LEU C C 42 178.630 178.630 178.251 0.379 25155 1889 1 3 . 1 1 42 42 LEU CA C 42 57.030 57.030 56.855 0.175 25155 1890 1 3 . 1 1 42 42 LEU CB C 42 41.820 41.820 40.667 1.153 25155 1891 1 3 . 1 1 42 42 LEU H H 42 7.598 7.598 7.511 0.087 25155 1892 1 3 . 1 1 43 43 MET N N 43 118.913 118.913 116.002 2.911 25155 1893 1 3 . 1 1 43 43 MET HA H 43 3.760 3.760 4.010 -0.250 25155 1894 1 3 . 1 1 43 43 MET C C 43 177.710 177.710 176.886 0.824 25155 1895 1 3 . 1 1 43 43 MET CA C 43 59.864 59.864 58.037 1.827 25155 1896 1 3 . 1 1 43 43 MET CB C 43 32.680 32.680 32.068 0.612 25155 1897 1 3 . 1 1 43 43 MET H H 43 8.180 8.180 7.925 0.255 25155 1898 1 3 . 1 1 44 44 GLU N N 44 110.906 110.906 116.189 -5.283 25155 1899 1 3 . 1 1 44 44 GLU HA H 44 3.732 3.732 3.998 -0.266 25155 1900 1 3 . 1 1 44 44 GLU C C 44 178.120 178.120 179.280 -1.160 25155 1901 1 3 . 1 1 44 44 GLU CA C 44 59.450 59.450 58.459 0.991 25155 1902 1 3 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.631 0.169 25155 1903 1 3 . 1 1 45 45 GLN N N 45 115.770 115.770 118.057 -2.287 25155 1904 1 3 . 1 1 45 45 GLN HA H 45 4.190 4.190 3.939 0.251 25155 1905 1 3 . 1 1 45 45 GLN C C 45 175.480 175.480 176.196 -0.716 25155 1906 1 3 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.370 -1.270 25155 1907 1 3 . 1 1 45 45 GLN CB C 45 28.490 28.490 28.703 -0.213 25155 1908 1 3 . 1 1 45 45 GLN H H 45 7.517 7.517 7.233 0.284 25155 1909 1 3 . 1 1 46 46 TYR N N 46 117.840 117.840 117.592 0.248 25155 1910 1 3 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.375 0.285 25155 1911 1 3 . 1 1 46 46 TYR C C 46 175.480 175.480 176.533 -1.053 25155 1912 1 3 . 1 1 46 46 TYR CA C 46 58.827 58.827 57.336 1.491 25155 1913 1 3 . 1 1 46 46 TYR CB C 46 41.720 41.720 38.420 3.300 25155 1914 1 3 . 1 1 46 46 TYR H H 46 6.955 6.955 7.089 -0.134 25155 1915 1 3 . 1 1 47 47 ASP N N 47 121.540 121.540 122.739 -1.199 25155 1916 1 3 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.493 0.203 25155 1917 1 3 . 1 1 47 47 ASP C C 47 175.677 175.677 175.723 -0.046 25155 1918 1 3 . 1 1 47 47 ASP CA C 47 56.812 56.812 56.869 -0.057 25155 1919 1 3 . 1 1 47 47 ASP CB C 47 42.978 42.978 41.573 1.405 25155 1920 1 3 . 1 1 48 48 VAL N N 48 118.666 118.666 117.087 1.579 25155 1921 1 3 . 1 1 48 48 VAL HA H 48 5.057 5.057 4.938 0.119 25155 1922 1 3 . 1 1 48 48 VAL C C 48 174.180 174.180 174.297 -0.117 25155 1923 1 3 . 1 1 48 48 VAL CA C 48 60.000 60.000 61.236 -1.236 25155 1924 1 3 . 1 1 48 48 VAL CB C 48 36.200 36.200 33.895 2.305 25155 1925 1 3 . 1 1 48 48 VAL H H 48 7.631 7.631 7.883 -0.252 25155 1926 1 3 . 1 1 49 49 LEU N N 49 128.300 128.300 127.511 0.789 25155 1927 1 3 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.122 0.478 25155 1928 1 3 . 1 1 49 49 LEU C C 49 174.810 174.810 175.107 -0.297 25155 1929 1 3 . 1 1 49 49 LEU CA C 49 52.230 52.230 54.200 -1.970 25155 1930 1 3 . 1 1 49 49 LEU CB C 49 45.400 45.400 45.137 0.263 25155 1931 1 3 . 1 1 49 49 LEU H H 49 9.469 9.469 8.902 0.567 25155 1932 1 3 . 1 1 50 50 ILE N N 50 124.400 124.400 127.898 -3.498 25155 1933 1 3 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.461 1.189 25155 1934 1 3 . 1 1 50 50 ILE C C 50 175.286 175.286 174.412 0.874 25155 1935 1 3 . 1 1 50 50 ILE CA C 50 59.900 59.900 61.641 -1.741 25155 1936 1 3 . 1 1 50 50 ILE CB C 50 40.200 40.200 39.511 0.689 25155 1937 1 3 . 1 1 50 50 ILE H H 50 9.213 9.213 9.317 -0.104 25155 1938 1 3 . 1 1 51 51 LEU N N 51 127.410 127.410 127.957 -0.547 25155 1939 1 3 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.520 1.550 25155 1940 1 3 . 1 1 51 51 LEU C C 51 174.540 174.540 175.627 -1.087 25155 1941 1 3 . 1 1 51 51 LEU CA C 51 52.950 52.950 53.328 -0.378 25155 1942 1 3 . 1 1 51 51 LEU CB C 51 43.190 43.190 43.876 -0.686 25155 1943 1 3 . 1 1 51 51 LEU H H 51 9.256 9.256 8.659 0.597 25155 1944 1 3 . 1 1 52 52 GLY N N 52 108.290 108.290 110.811 -2.521 25155 1945 1 3 . 1 1 52 52 GLY C C 52 174.330 174.330 171.252 3.078 25155 1946 1 3 . 1 1 52 52 GLY CA C 52 44.040 44.040 43.597 0.443 25155 1947 1 3 . 1 1 52 52 GLY H H 52 8.949 8.949 8.446 0.503 25155 1948 1 3 . 1 1 53 53 ILE N N 53 124.912 124.912 122.584 2.328 25155 1949 1 3 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.411 -0.236 25155 1950 1 3 . 1 1 53 53 ILE C C 53 174.470 174.470 172.470 2.000 25155 1951 1 3 . 1 1 53 53 ILE CA C 53 55.850 55.850 57.737 -1.887 25155 1952 1 3 . 1 1 53 53 ILE CB C 53 42.800 42.800 42.044 0.756 25155 1953 1 3 . 1 1 53 53 ILE H H 53 8.612 8.612 7.276 1.336 25155 1954 1 3 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.490 0.322 25155 1955 1 3 . 1 1 54 54 PRO C C 54 174.565 174.565 175.323 -0.758 25155 1956 1 3 . 1 1 54 54 PRO CA C 54 61.850 61.850 61.769 0.081 25155 1957 1 3 . 1 1 54 54 PRO CB C 54 32.400 32.400 31.623 0.777 25155 1958 1 3 . 1 1 55 55 THR N N 55 116.040 116.040 115.805 0.235 25155 1959 1 3 . 1 1 55 55 THR HA H 55 4.522 4.522 4.360 0.162 25155 1960 1 3 . 1 1 55 55 THR C C 55 173.990 173.990 172.873 1.117 25155 1961 1 3 . 1 1 55 55 THR CA C 55 62.845 62.845 61.824 1.021 25155 1962 1 3 . 1 1 55 55 THR CB C 55 70.795 70.795 71.209 -0.414 25155 1963 1 3 . 1 1 55 55 THR H H 55 7.663 7.663 8.273 -0.610 25155 1964 1 3 . 1 1 56 56 TRP N N 56 130.540 130.540 124.741 5.799 25155 1965 1 3 . 1 1 56 56 TRP CA C 56 54.800 54.800 56.676 -1.876 25155 1966 1 3 . 1 1 56 56 TRP H H 56 9.075 9.075 8.125 0.950 25155 1967 1 3 . 1 1 58 58 PHE HA H 58 4.540 4.540 4.341 0.199 25155 1968 1 3 . 1 1 58 58 PHE C C 58 177.070 177.070 175.895 1.175 25155 1969 1 3 . 1 1 58 58 PHE CA C 58 55.460 55.460 57.677 -2.217 25155 1970 1 3 . 1 1 58 58 PHE CB C 58 41.200 41.200 38.600 2.600 25155 1971 1 3 . 1 1 59 59 GLY N N 59 109.796 109.796 107.812 1.984 25155 1972 1 3 . 1 1 59 59 GLY CA C 59 45.763 45.763 44.505 1.258 25155 1973 1 3 . 1 1 59 59 GLY H H 59 8.392 8.392 7.502 0.890 25155 1974 1 3 . 1 1 60 60 GLU C C 60 175.660 175.660 176.313 -0.653 25155 1975 1 3 . 1 1 61 61 ILE N N 61 122.380 122.380 118.493 3.887 25155 1976 1 3 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.228 1.212 25155 1977 1 3 . 1 1 61 61 ILE CA C 61 62.100 62.100 62.398 -0.298 25155 1978 1 3 . 1 1 61 61 ILE CB C 61 38.750 38.750 37.094 1.655 25155 1979 1 3 . 1 1 61 61 ILE H H 61 8.436 8.436 8.212 0.224 25155 1980 1 3 . 1 1 62 62 GLN CB C 62 30.570 30.570 30.912 -0.342 25155 1981 1 3 . 1 1 63 63 GLU HA H 63 4.030 4.030 3.962 0.068 25155 1982 1 3 . 1 1 63 63 GLU C C 63 177.134 177.134 177.217 -0.083 25155 1983 1 3 . 1 1 63 63 GLU CA C 63 60.520 60.520 60.306 0.214 25155 1984 1 3 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.787 -0.137 25155 1985 1 3 . 1 1 64 64 ASP N N 64 119.630 119.630 117.400 2.230 25155 1986 1 3 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.493 0.099 25155 1987 1 3 . 1 1 64 64 ASP C C 64 178.680 178.680 176.822 1.858 25155 1988 1 3 . 1 1 64 64 ASP CA C 64 57.823 57.823 56.715 1.108 25155 1989 1 3 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.296 0.804 25155 1990 1 3 . 1 1 65 65 TRP N N 65 120.535 120.535 121.646 -1.111 25155 1991 1 3 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.631 -0.306 25155 1992 1 3 . 1 1 65 65 TRP C C 65 178.684 178.684 177.414 1.270 25155 1993 1 3 . 1 1 65 65 TRP CA C 65 60.500 60.500 60.184 0.316 25155 1994 1 3 . 1 1 65 65 TRP CB C 65 30.100 30.100 31.602 -1.502 25155 1995 1 3 . 1 1 65 65 TRP H H 65 7.416 7.416 7.826 -0.410 25155 1996 1 3 . 1 1 66 66 GLU N N 66 120.760 120.760 120.784 -0.024 25155 1997 1 3 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.274 -0.454 25155 1998 1 3 . 1 1 66 66 GLU C C 66 178.860 178.860 178.932 -0.072 25155 1999 1 3 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.797 0.303 25155 2000 1 3 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.629 -0.619 25155 2001 1 3 . 1 1 67 67 ALA N N 67 118.972 118.972 121.969 -2.997 25155 2002 1 3 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.215 0.032 25155 2003 1 3 . 1 1 67 67 ALA C C 67 179.610 179.610 178.999 0.611 25155 2004 1 3 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.940 -0.340 25155 2005 1 3 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.863 -0.074 25155 2006 1 3 . 1 1 67 67 ALA H H 67 7.690 7.690 8.541 -0.851 25155 2007 1 3 . 1 1 68 68 VAL N N 68 107.530 107.530 111.311 -3.781 25155 2008 1 3 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.308 0.402 25155 2009 1 3 . 1 1 68 68 VAL C C 68 176.800 176.800 177.289 -0.489 25155 2010 1 3 . 1 1 68 68 VAL CA C 68 60.060 60.060 62.670 -2.610 25155 2011 1 3 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.293 0.307 25155 2012 1 3 . 1 1 68 68 VAL H H 68 7.240 7.240 7.463 -0.223 25155 2013 1 3 . 1 1 69 69 TRP N N 69 126.960 126.960 125.079 1.881 25155 2014 1 3 . 1 1 69 69 TRP HA H 69 4.182 4.182 3.962 0.220 25155 2015 1 3 . 1 1 69 69 TRP C C 69 178.640 178.640 176.758 1.882 25155 2016 1 3 . 1 1 69 69 TRP CA C 69 61.300 61.300 62.480 -1.179 25155 2017 1 3 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.398 2.172 25155 2018 1 3 . 1 1 69 69 TRP H H 69 7.810 7.810 8.176 -0.366 25155 2019 1 3 . 1 1 70 70 ASP N N 70 114.644 114.644 116.294 -1.650 25155 2020 1 3 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.155 0.364 25155 2021 1 3 . 1 1 70 70 ASP C C 70 178.685 178.685 178.230 0.455 25155 2022 1 3 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.367 -0.367 25155 2023 1 3 . 1 1 70 70 ASP CB C 70 39.810 39.810 40.962 -1.151 25155 2024 1 3 . 1 1 71 71 GLN N N 71 120.100 120.100 116.949 3.151 25155 2025 1 3 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.245 -0.055 25155 2026 1 3 . 1 1 71 71 GLN C C 71 178.870 178.870 178.138 0.732 25155 2027 1 3 . 1 1 71 71 GLN CA C 71 57.617 57.617 57.022 0.596 25155 2028 1 3 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.548 -0.728 25155 2029 1 3 . 1 1 71 71 GLN H H 71 7.980 7.980 7.963 0.017 25155 2030 1 3 . 1 1 72 72 LEU N N 72 117.535 117.535 120.038 -2.503 25155 2031 1 3 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.940 -0.143 25155 2032 1 3 . 1 1 72 72 LEU C C 72 178.308 178.308 177.931 0.377 25155 2033 1 3 . 1 1 72 72 LEU CA C 72 57.340 57.340 57.038 0.302 25155 2034 1 3 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.500 0.200 25155 2035 1 3 . 1 1 72 72 LEU H H 72 7.435 7.435 7.680 -0.245 25155 2036 1 3 . 1 1 73 73 ASP N N 73 115.534 115.534 117.573 -2.039 25155 2037 1 3 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.400 -0.250 25155 2038 1 3 . 1 1 73 73 ASP C C 73 177.553 177.553 176.788 0.765 25155 2039 1 3 . 1 1 73 73 ASP CA C 73 57.350 57.350 56.188 1.162 25155 2040 1 3 . 1 1 73 73 ASP CB C 73 40.040 40.040 41.633 -1.593 25155 2041 1 3 . 1 1 74 74 ASP N N 74 117.300 117.300 120.202 -2.902 25155 2042 1 3 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.472 0.234 25155 2043 1 3 . 1 1 74 74 ASP C C 74 176.424 176.424 177.239 -0.815 25155 2044 1 3 . 1 1 74 74 ASP CA C 74 54.170 54.170 55.592 -1.422 25155 2045 1 3 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.314 0.506 25155 2046 1 3 . 1 1 75 75 LEU N N 75 118.500 118.500 120.172 -1.672 25155 2047 1 3 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.155 0.140 25155 2048 1 3 . 1 1 75 75 LEU C C 75 176.800 176.800 176.668 0.132 25155 2049 1 3 . 1 1 75 75 LEU CA C 75 54.400 54.400 55.107 -0.707 25155 2050 1 3 . 1 1 75 75 LEU CB C 75 43.280 43.280 41.794 1.486 25155 2051 1 3 . 1 1 75 75 LEU H H 75 6.966 6.966 7.314 -0.348 25155 2052 1 3 . 1 1 76 76 ASN N N 76 123.040 123.040 120.860 2.180 25155 2053 1 3 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.605 0.257 25155 2054 1 3 . 1 1 76 76 ASN C C 76 174.927 174.927 174.835 0.092 25155 2055 1 3 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.514 -1.633 25155 2056 1 3 . 1 1 76 76 ASN CB C 76 37.510 37.510 38.427 -0.917 25155 2057 1 3 . 1 1 76 76 ASN H H 76 9.882 9.882 9.001 0.881 25155 2058 1 3 . 1 1 77 77 LEU N N 77 123.614 123.614 123.550 0.064 25155 2059 1 3 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.533 -0.163 25155 2060 1 3 . 1 1 77 77 LEU C C 77 175.110 175.110 176.723 -1.613 25155 2061 1 3 . 1 1 77 77 LEU CA C 77 52.200 52.200 54.062 -1.863 25155 2062 1 3 . 1 1 77 77 LEU CB C 77 42.786 42.786 42.637 0.149 25155 2063 1 3 . 1 1 77 77 LEU H H 77 8.700 8.700 7.870 0.830 25155 2064 1 3 . 1 1 78 78 GLU N N 78 120.822 120.822 121.489 -0.667 25155 2065 1 3 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.228 -0.328 25155 2066 1 3 . 1 1 78 78 GLU C C 78 178.670 178.670 178.048 0.622 25155 2067 1 3 . 1 1 78 78 GLU CA C 78 58.700 58.700 58.056 0.644 25155 2068 1 3 . 1 1 78 78 GLU CB C 78 29.467 29.467 29.388 0.079 25155 2069 1 3 . 1 1 79 79 GLY N N 79 113.160 113.160 112.976 0.184 25155 2070 1 3 . 1 1 79 79 GLY C C 79 174.523 174.523 174.135 0.388 25155 2071 1 3 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.375 0.045 25155 2072 1 3 . 1 1 79 79 GLY H H 79 8.450 8.450 8.471 -0.021 25155 2073 1 3 . 1 1 80 80 LYS N N 80 120.283 120.283 120.618 -0.335 25155 2074 1 3 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.321 0.037 25155 2075 1 3 . 1 1 80 80 LYS C C 80 175.304 175.304 175.943 -0.639 25155 2076 1 3 . 1 1 80 80 LYS CA C 80 56.890 56.890 56.258 0.632 25155 2077 1 3 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.822 -0.702 25155 2078 1 3 . 1 1 81 81 ILE N N 81 122.288 122.288 121.474 0.814 25155 2079 1 3 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.322 0.484 25155 2080 1 3 . 1 1 81 81 ILE C C 81 174.750 174.750 175.518 -0.768 25155 2081 1 3 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.596 -1.776 25155 2082 1 3 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.375 0.475 25155 2083 1 3 . 1 1 81 81 ILE H H 81 7.405 7.405 8.004 -0.599 25155 2084 1 3 . 1 1 82 82 VAL N N 82 127.793 127.793 125.950 1.843 25155 2085 1 3 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.162 0.118 25155 2086 1 3 . 1 1 82 82 VAL C C 82 172.680 172.680 174.300 -1.620 25155 2087 1 3 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.188 -0.088 25155 2088 1 3 . 1 1 82 82 VAL CB C 82 35.280 35.280 36.099 -0.820 25155 2089 1 3 . 1 1 82 82 VAL H H 82 8.800 8.800 9.073 -0.273 25155 2090 1 3 . 1 1 83 83 ALA N N 83 130.911 130.911 128.806 2.105 25155 2091 1 3 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.858 -0.469 25155 2092 1 3 . 1 1 83 83 ALA C C 83 175.870 175.870 176.300 -0.430 25155 2093 1 3 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.222 0.778 25155 2094 1 3 . 1 1 83 83 ALA CB C 83 23.722 23.722 22.640 1.082 25155 2095 1 3 . 1 1 83 83 ALA H H 83 9.252 9.252 8.883 0.369 25155 2096 1 3 . 1 1 84 84 LEU N N 84 124.269 124.269 121.180 3.089 25155 2097 1 3 . 1 1 84 84 LEU HA H 84 5.508 5.508 5.221 0.287 25155 2098 1 3 . 1 1 84 84 LEU C C 84 175.490 175.490 175.421 0.069 25155 2099 1 3 . 1 1 84 84 LEU CA C 84 53.670 53.670 54.478 -0.808 25155 2100 1 3 . 1 1 84 84 LEU CB C 84 45.000 45.000 45.818 -0.818 25155 2101 1 3 . 1 1 84 84 LEU H H 84 10.378 10.378 8.881 1.497 25155 2102 1 3 . 1 1 85 85 TYR N N 85 115.826 115.826 119.377 -3.551 25155 2103 1 3 . 1 1 85 85 TYR HA H 85 4.950 4.950 5.239 -0.289 25155 2104 1 3 . 1 1 85 85 TYR C C 85 172.661 172.661 173.452 -0.791 25155 2105 1 3 . 1 1 85 85 TYR CA C 85 55.853 55.853 55.289 0.564 25155 2106 1 3 . 1 1 85 85 TYR CB C 85 43.200 43.200 41.264 1.936 25155 2107 1 3 . 1 1 85 85 TYR H H 85 9.200 9.200 8.658 0.542 25155 2108 1 3 . 1 1 86 86 GLY N N 86 106.802 106.802 105.094 1.708 25155 2109 1 3 . 1 1 86 86 GLY C C 86 170.348 170.348 171.029 -0.681 25155 2110 1 3 . 1 1 86 86 GLY CA C 86 44.687 44.687 44.631 0.056 25155 2111 1 3 . 1 1 86 86 GLY H H 86 8.752 8.752 8.269 0.483 25155 2112 1 3 . 1 1 87 87 LEU N N 87 120.860 120.860 121.129 -0.269 25155 2113 1 3 . 1 1 87 87 LEU HA H 87 5.476 5.476 4.791 0.685 25155 2114 1 3 . 1 1 87 87 LEU C C 87 177.720 177.720 175.420 2.300 25155 2115 1 3 . 1 1 87 87 LEU CA C 87 52.630 52.630 52.761 -0.131 25155 2116 1 3 . 1 1 87 87 LEU CB C 87 45.900 45.900 44.897 1.003 25155 2117 1 3 . 1 1 87 87 LEU H H 87 6.320 6.320 7.672 -1.352 25155 2118 1 3 . 1 1 88 88 GLY N N 88 109.910 109.910 110.084 -0.174 25155 2119 1 3 . 1 1 88 88 GLY C C 88 171.386 171.386 171.470 -0.084 25155 2120 1 3 . 1 1 88 88 GLY CA C 88 45.710 45.710 45.525 0.185 25155 2121 1 3 . 1 1 88 88 GLY H H 88 8.320 8.320 8.170 0.150 25155 2122 1 3 . 1 1 89 89 ASP N N 89 121.580 121.580 118.506 3.074 25155 2123 1 3 . 1 1 89 89 ASP HA H 89 5.190 5.190 4.976 0.214 25155 2124 1 3 . 1 1 89 89 ASP C C 89 176.608 176.608 175.936 0.672 25155 2125 1 3 . 1 1 89 89 ASP CA C 89 52.200 52.200 53.107 -0.907 25155 2126 1 3 . 1 1 89 89 ASP CB C 89 41.900 41.900 42.778 -0.878 25155 2127 1 3 . 1 1 90 90 GLN N N 90 123.900 123.900 124.864 -0.964 25155 2128 1 3 . 1 1 90 90 GLN HA H 90 3.645 3.645 3.867 -0.222 25155 2129 1 3 . 1 1 90 90 GLN C C 90 173.523 173.523 177.892 -4.369 25155 2130 1 3 . 1 1 90 90 GLN CA C 90 58.706 58.706 58.816 -0.110 25155 2131 1 3 . 1 1 90 90 GLN CB C 90 28.800 28.800 28.622 0.178 25155 2132 1 3 . 1 1 90 90 GLN H H 90 8.726 8.726 8.820 -0.094 25155 2133 1 3 . 1 1 91 91 LEU N N 91 117.080 117.080 116.565 0.515 25155 2134 1 3 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.158 0.312 25155 2135 1 3 . 1 1 91 91 LEU C C 91 179.840 179.840 178.444 1.396 25155 2136 1 3 . 1 1 91 91 LEU CA C 91 55.800 55.800 55.597 0.203 25155 2137 1 3 . 1 1 91 91 LEU CB C 91 41.640 41.640 42.032 -0.392 25155 2138 1 3 . 1 1 91 91 LEU H H 91 7.092 7.092 8.612 -1.520 25155 2139 1 3 . 1 1 92 92 GLY N N 92 110.460 110.460 106.467 3.993 25155 2140 1 3 . 1 1 92 92 GLY C C 92 174.824 174.824 175.177 -0.353 25155 2141 1 3 . 1 1 92 92 GLY CA C 92 46.390 46.390 46.991 -0.601 25155 2142 1 3 . 1 1 92 92 GLY H H 92 9.243 9.243 7.980 1.263 25155 2143 1 3 . 1 1 93 93 TYR N N 93 118.140 118.140 117.002 1.138 25155 2144 1 3 . 1 1 93 93 TYR HA H 93 5.173 5.173 4.805 0.368 25155 2145 1 3 . 1 1 93 93 TYR C C 93 177.805 177.805 177.679 0.126 25155 2146 1 3 . 1 1 93 93 TYR CA C 93 57.430 57.430 57.467 -0.037 25155 2147 1 3 . 1 1 93 93 TYR CB C 93 39.300 39.300 39.308 -0.008 25155 2148 1 3 . 1 1 93 93 TYR H H 93 7.252 7.252 7.467 -0.215 25155 2149 1 3 . 1 1 94 94 GLY N N 94 112.455 112.455 108.851 3.604 25155 2150 1 3 . 1 1 94 94 GLY C C 94 177.740 177.740 176.491 1.249 25155 2151 1 3 . 1 1 94 94 GLY CA C 94 49.880 49.880 46.985 2.895 25155 2152 1 3 . 1 1 94 94 GLY H H 94 8.154 8.154 8.473 -0.319 25155 2153 1 3 . 1 1 95 95 GLU N N 95 123.040 123.040 122.203 0.837 25155 2154 1 3 . 1 1 95 95 GLU HA H 95 4.000 4.000 4.014 -0.014 25155 2155 1 3 . 1 1 95 95 GLU C C 95 175.145 175.145 176.748 -1.603 25155 2156 1 3 . 1 1 95 95 GLU CA C 95 57.950 57.950 59.160 -1.210 25155 2157 1 3 . 1 1 95 95 GLU CB C 95 27.400 27.400 28.992 -1.592 25155 2158 1 3 . 1 1 96 96 TRP N N 96 118.000 118.000 115.778 2.222 25155 2159 1 3 . 1 1 96 96 TRP HA H 96 5.213 5.213 4.997 0.216 25155 2160 1 3 . 1 1 96 96 TRP C C 96 176.616 176.616 175.807 0.809 25155 2161 1 3 . 1 1 96 96 TRP CA C 96 57.120 57.120 55.660 1.460 25155 2162 1 3 . 1 1 96 96 TRP CB C 96 29.970 29.970 28.241 1.729 25155 2163 1 3 . 1 1 96 96 TRP H H 96 7.785 7.785 7.884 -0.099 25155 2164 1 3 . 1 1 97 97 PHE N N 97 123.268 123.268 122.383 0.885 25155 2165 1 3 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.403 0.257 25155 2166 1 3 . 1 1 97 97 PHE CA C 97 58.742 58.742 59.792 -1.050 25155 2167 1 3 . 1 1 97 97 PHE CB C 97 40.835 40.835 39.958 0.877 25155 2168 1 3 . 1 1 97 97 PHE H H 97 7.054 7.054 7.695 -0.641 25155 2169 1 3 . 1 1 98 98 LEU HA H 98 3.440 3.440 3.475 -0.035 25155 2170 1 3 . 1 1 98 98 LEU C C 98 176.613 176.613 177.058 -0.445 25155 2171 1 3 . 1 1 98 98 LEU CA C 98 56.000 56.000 55.238 0.762 25155 2172 1 3 . 1 1 98 98 LEU CB C 98 38.600 38.600 39.384 -0.784 25155 2173 1 3 . 1 1 98 98 LEU H H 98 8.584 8.584 8.267 0.317 25155 2174 1 3 . 1 1 99 99 ASP N N 99 123.268 123.268 120.293 2.975 25155 2175 1 3 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.312 -0.347 25155 2176 1 3 . 1 1 99 99 ASP C C 99 178.876 178.876 177.094 1.782 25155 2177 1 3 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.598 1.662 25155 2178 1 3 . 1 1 99 99 ASP CB C 99 40.350 40.350 41.169 -0.819 25155 2179 1 3 . 1 1 100 100 ALA N N 100 119.124 119.124 120.706 -1.582 25155 2180 1 3 . 1 1 100 100 ALA HA H 100 3.822 3.822 3.931 -0.109 25155 2181 1 3 . 1 1 100 100 ALA C C 100 178.490 178.490 178.899 -0.409 25155 2182 1 3 . 1 1 100 100 ALA CA C 100 55.100 55.100 54.752 0.348 25155 2183 1 3 . 1 1 100 100 ALA CB C 100 19.700 19.700 18.248 1.452 25155 2184 1 3 . 1 1 100 100 ALA H H 100 8.400 8.400 7.650 0.750 25155 2185 1 3 . 1 1 101 101 LEU N N 101 118.687 118.687 120.243 -1.556 25155 2186 1 3 . 1 1 101 101 LEU HA H 101 3.674 3.674 3.923 -0.249 25155 2187 1 3 . 1 1 101 101 LEU C C 101 179.050 179.050 178.696 0.354 25155 2188 1 3 . 1 1 101 101 LEU CA C 101 57.800 57.800 57.154 0.646 25155 2189 1 3 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.597 1.053 25155 2190 1 3 . 1 1 101 101 LEU H H 101 6.518 6.518 7.413 -0.895 25155 2191 1 3 . 1 1 102 102 GLY N N 102 104.410 104.410 106.365 -1.955 25155 2192 1 3 . 1 1 102 102 GLY C C 102 176.056 176.056 175.788 0.268 25155 2193 1 3 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.224 0.526 25155 2194 1 3 . 1 1 102 102 GLY H H 102 7.712 7.712 8.081 -0.369 25155 2195 1 3 . 1 1 103 103 MET N N 103 120.550 120.550 122.282 -1.732 25155 2196 1 3 . 1 1 103 103 MET HA H 103 4.256 4.256 4.344 -0.088 25155 2197 1 3 . 1 1 103 103 MET C C 103 179.650 179.650 178.320 1.330 25155 2198 1 3 . 1 1 103 103 MET CA C 103 59.450 59.450 59.013 0.437 25155 2199 1 3 . 1 1 103 103 MET CB C 103 32.300 32.300 32.688 -0.388 25155 2200 1 3 . 1 1 103 103 MET H H 103 8.485 8.485 8.143 0.342 25155 2201 1 3 . 1 1 104 104 LEU N N 104 123.480 123.480 119.126 4.354 25155 2202 1 3 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.380 -0.319 25155 2203 1 3 . 1 1 104 104 LEU C C 104 177.750 177.750 178.332 -0.582 25155 2204 1 3 . 1 1 104 104 LEU CA C 104 58.100 58.100 57.097 1.003 25155 2205 1 3 . 1 1 104 104 LEU CB C 104 41.450 41.450 41.218 0.232 25155 2206 1 3 . 1 1 104 104 LEU H H 104 8.392 8.392 7.775 0.617 25155 2207 1 3 . 1 1 105 105 HIS N N 105 119.570 119.570 120.180 -0.610 25155 2208 1 3 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.216 -0.364 25155 2209 1 3 . 1 1 105 105 HIS C C 105 177.550 177.550 177.227 0.323 25155 2210 1 3 . 1 1 105 105 HIS CA C 105 61.000 61.000 60.628 0.372 25155 2211 1 3 . 1 1 105 105 HIS CB C 105 28.820 28.820 29.835 -1.015 25155 2212 1 3 . 1 1 105 105 HIS H H 105 8.247 8.247 8.301 -0.054 25155 2213 1 3 . 1 1 106 106 ASP N N 106 119.780 119.780 119.590 0.190 25155 2214 1 3 . 1 1 106 106 ASP HA H 106 4.333 4.333 4.345 -0.012 25155 2215 1 3 . 1 1 106 106 ASP C C 106 179.410 179.410 178.091 1.319 25155 2216 1 3 . 1 1 106 106 ASP CA C 106 57.800 57.800 57.350 0.450 25155 2217 1 3 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.161 -0.561 25155 2218 1 3 . 1 1 107 107 LYS N N 107 121.660 121.660 119.362 2.298 25155 2219 1 3 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.066 0.034 25155 2220 1 3 . 1 1 107 107 LYS C C 107 178.316 178.316 178.925 -0.609 25155 2221 1 3 . 1 1 107 107 LYS CA C 107 58.750 58.750 59.029 -0.279 25155 2222 1 3 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.599 -0.749 25155 2223 1 3 . 1 1 108 108 LEU N N 108 116.050 116.050 117.302 -1.252 25155 2224 1 3 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.436 -0.426 25155 2225 1 3 . 1 1 108 108 LEU C C 108 179.050 179.050 179.075 -0.025 25155 2226 1 3 . 1 1 108 108 LEU CA C 108 56.240 56.240 55.997 0.243 25155 2227 1 3 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.010 -0.210 25155 2228 1 3 . 1 1 108 108 LEU H H 108 8.072 8.072 7.977 0.095 25155 2229 1 3 . 1 1 109 109 SER N N 109 116.280 116.280 116.487 -0.207 25155 2230 1 3 . 1 1 109 109 SER HA H 109 4.300 4.300 4.502 -0.202 25155 2231 1 3 . 1 1 109 109 SER C C 109 175.848 175.848 176.222 -0.374 25155 2232 1 3 . 1 1 109 109 SER CA C 109 62.410 62.410 62.008 0.402 25155 2233 1 3 . 1 1 109 109 SER CB C 109 62.850 62.850 62.901 -0.051 25155 2234 1 3 . 1 1 109 109 SER H H 109 8.366 8.366 8.249 0.117 25155 2235 1 3 . 1 1 110 110 THR N N 110 110.416 110.416 111.536 -1.120 25155 2236 1 3 . 1 1 110 110 THR HA H 110 4.614 4.614 4.416 0.198 25155 2237 1 3 . 1 1 110 110 THR C C 110 175.675 175.675 175.360 0.315 25155 2238 1 3 . 1 1 110 110 THR CA C 110 62.030 62.030 63.807 -1.777 25155 2239 1 3 . 1 1 110 110 THR CB C 110 68.810 68.810 68.743 0.067 25155 2240 1 3 . 1 1 110 110 THR H H 110 7.185 7.185 7.942 -0.757 25155 2241 1 3 . 1 1 111 111 LYS N N 111 120.090 120.090 120.625 -0.535 25155 2242 1 3 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.464 0.049 25155 2243 1 3 . 1 1 111 111 LYS C C 111 176.814 176.814 176.549 0.265 25155 2244 1 3 . 1 1 111 111 LYS CA C 111 55.730 55.730 55.721 0.009 25155 2245 1 3 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.546 -1.616 25155 2246 1 3 . 1 1 112 112 GLY N N 112 107.540 107.540 108.105 -0.565 25155 2247 1 3 . 1 1 112 112 GLY C C 112 176.223 176.223 174.099 2.124 25155 2248 1 3 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.391 1.535 25155 2249 1 3 . 1 1 112 112 GLY H H 112 8.315 8.315 7.643 0.672 25155 2250 1 3 . 1 1 113 113 VAL N N 113 113.536 113.536 114.400 -0.864 25155 2251 1 3 . 1 1 113 113 VAL HA H 113 4.494 4.494 4.415 0.079 25155 2252 1 3 . 1 1 113 113 VAL C C 113 174.560 174.560 174.621 -0.061 25155 2253 1 3 . 1 1 113 113 VAL CA C 113 59.550 59.550 60.418 -0.868 25155 2254 1 3 . 1 1 113 113 VAL CB C 113 32.800 32.800 32.465 0.335 25155 2255 1 3 . 1 1 113 113 VAL H H 113 6.835 6.835 6.975 -0.140 25155 2256 1 3 . 1 1 114 114 LYS N N 114 122.920 122.920 121.381 1.539 25155 2257 1 3 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.468 0.026 25155 2258 1 3 . 1 1 114 114 LYS C C 114 174.925 174.925 174.679 0.246 25155 2259 1 3 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.353 -0.073 25155 2260 1 3 . 1 1 114 114 LYS CB C 114 33.630 33.630 34.004 -0.374 25155 2261 1 3 . 1 1 115 115 PHE N N 115 123.140 123.140 124.096 -0.956 25155 2262 1 3 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.363 0.337 25155 2263 1 3 . 1 1 115 115 PHE C C 115 177.580 177.580 176.443 1.137 25155 2264 1 3 . 1 1 115 115 PHE CA C 115 58.677 58.677 57.004 1.673 25155 2265 1 3 . 1 1 115 115 PHE CB C 115 41.120 41.120 40.051 1.069 25155 2266 1 3 . 1 1 115 115 PHE H H 115 8.506 8.506 8.608 -0.102 25155 2267 1 3 . 1 1 116 116 VAL N N 116 115.737 115.737 117.867 -2.130 25155 2268 1 3 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.432 0.046 25155 2269 1 3 . 1 1 116 116 VAL C C 116 175.300 175.300 176.277 -0.977 25155 2270 1 3 . 1 1 116 116 VAL CA C 116 58.877 58.877 59.948 -1.071 25155 2271 1 3 . 1 1 116 116 VAL CB C 116 34.120 34.120 33.799 0.321 25155 2272 1 3 . 1 1 116 116 VAL H H 116 8.860 8.860 9.029 -0.169 25155 2273 1 3 . 1 1 117 117 GLY N N 117 108.137 108.137 109.915 -1.778 25155 2274 1 3 . 1 1 117 117 GLY C C 117 176.110 176.110 175.231 0.879 25155 2275 1 3 . 1 1 117 117 GLY CA C 117 47.500 47.500 45.589 1.911 25155 2276 1 3 . 1 1 117 117 GLY H H 117 9.838 9.838 9.514 0.324 25155 2277 1 3 . 1 1 118 118 TYR N N 118 120.380 120.380 120.334 0.046 25155 2278 1 3 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.784 0.186 25155 2279 1 3 . 1 1 118 118 TYR C C 118 177.630 177.630 175.851 1.779 25155 2280 1 3 . 1 1 118 118 TYR CA C 118 55.800 55.800 58.084 -2.284 25155 2281 1 3 . 1 1 118 118 TYR CB C 118 35.970 35.970 38.891 -2.921 25155 2282 1 3 . 1 1 118 118 TYR H H 118 8.652 8.652 8.053 0.599 25155 2283 1 3 . 1 1 119 119 TRP N N 119 126.040 126.040 122.531 3.509 25155 2284 1 3 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.190 0.831 25155 2285 1 3 . 1 1 119 119 TRP C C 119 173.000 173.000 173.517 -0.517 25155 2286 1 3 . 1 1 119 119 TRP CA C 119 53.820 53.820 53.986 -0.166 25155 2287 1 3 . 1 1 119 119 TRP CB C 119 36.050 36.050 33.650 2.400 25155 2288 1 3 . 1 1 119 119 TRP H H 119 8.070 8.070 8.721 -0.651 25155 2289 1 3 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.456 0.328 25155 2290 1 3 . 1 1 120 120 PRO C C 120 176.870 176.870 176.394 0.476 25155 2291 1 3 . 1 1 120 120 PRO CA C 120 63.780 63.780 63.509 0.271 25155 2292 1 3 . 1 1 120 120 PRO CB C 120 31.990 31.990 32.051 -0.061 25155 2293 1 3 . 1 1 121 121 THR N N 121 109.310 109.310 114.263 -4.953 25155 2294 1 3 . 1 1 121 121 THR HA H 121 4.073 4.073 4.136 -0.063 25155 2295 1 3 . 1 1 121 121 THR C C 121 176.324 176.324 174.731 1.593 25155 2296 1 3 . 1 1 121 121 THR CA C 121 61.250 61.250 62.688 -1.438 25155 2297 1 3 . 1 1 121 121 THR CB C 121 69.730 69.730 69.018 0.712 25155 2298 1 3 . 1 1 121 121 THR H H 121 7.370 7.370 8.632 -1.262 25155 2299 1 3 . 1 1 122 122 GLU N N 122 123.937 123.937 120.916 3.021 25155 2300 1 3 . 1 1 122 122 GLU HA H 122 4.224 4.224 3.965 0.259 25155 2301 1 3 . 1 1 122 122 GLU C C 122 177.737 177.737 177.843 -0.106 25155 2302 1 3 . 1 1 122 122 GLU CA C 122 58.200 58.200 57.517 0.683 25155 2303 1 3 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.621 0.179 25155 2304 1 3 . 1 1 123 123 GLY N N 123 114.563 114.563 110.669 3.894 25155 2305 1 3 . 1 1 123 123 GLY C C 123 173.783 173.783 173.112 0.671 25155 2306 1 3 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.437 -0.057 25155 2307 1 3 . 1 1 123 123 GLY H H 123 9.144 9.144 8.900 0.244 25155 2308 1 3 . 1 1 124 124 TYR N N 124 118.800 118.800 120.435 -1.635 25155 2309 1 3 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.730 0.488 25155 2310 1 3 . 1 1 124 124 TYR C C 124 175.673 175.673 173.304 2.369 25155 2311 1 3 . 1 1 124 124 TYR CA C 124 56.950 56.950 56.575 0.375 25155 2312 1 3 . 1 1 124 124 TYR CB C 124 41.100 41.100 41.146 -0.046 25155 2313 1 3 . 1 1 124 124 TYR H H 124 7.895 7.895 7.610 0.285 25155 2314 1 3 . 1 1 125 125 GLU N N 125 124.790 124.790 120.201 4.589 25155 2315 1 3 . 1 1 125 125 GLU HA H 125 4.685 4.685 3.722 0.963 25155 2316 1 3 . 1 1 125 125 GLU C C 125 172.877 172.877 173.561 -0.684 25155 2317 1 3 . 1 1 125 125 GLU CA C 125 55.700 55.700 54.435 1.265 25155 2318 1 3 . 1 1 125 125 GLU CB C 125 31.340 31.340 32.398 -1.058 25155 2319 1 3 . 1 1 126 126 PHE N N 126 118.670 118.670 116.172 2.498 25155 2320 1 3 . 1 1 126 126 PHE HA H 126 4.841 4.841 4.706 0.135 25155 2321 1 3 . 1 1 126 126 PHE C C 126 173.800 173.800 174.221 -0.421 25155 2322 1 3 . 1 1 126 126 PHE CA C 126 56.950 56.950 56.683 0.267 25155 2323 1 3 . 1 1 126 126 PHE CB C 126 40.300 40.300 40.041 0.259 25155 2324 1 3 . 1 1 126 126 PHE H H 126 7.645 7.645 7.134 0.511 25155 2325 1 3 . 1 1 127 127 THR N N 127 107.038 107.038 114.162 -7.124 25155 2326 1 3 . 1 1 127 127 THR HA H 127 4.370 4.370 4.448 -0.078 25155 2327 1 3 . 1 1 127 127 THR C C 127 175.100 175.100 175.222 -0.122 25155 2328 1 3 . 1 1 127 127 THR CA C 127 61.080 61.080 61.312 -0.232 25155 2329 1 3 . 1 1 127 127 THR CB C 127 70.500 70.500 70.531 -0.031 25155 2330 1 3 . 1 1 127 127 THR H H 127 7.306 7.306 8.555 -1.249 25155 2331 1 3 . 1 1 128 128 SER N N 128 118.150 118.150 119.904 -1.754 25155 2332 1 3 . 1 1 128 128 SER HA H 128 4.650 4.650 4.686 -0.036 25155 2333 1 3 . 1 1 128 128 SER C C 128 175.760 175.760 174.665 1.095 25155 2334 1 3 . 1 1 128 128 SER CA C 128 55.813 55.813 56.492 -0.679 25155 2335 1 3 . 1 1 128 128 SER CB C 128 65.300 65.300 64.260 1.040 25155 2336 1 3 . 1 1 128 128 SER H H 128 7.354 7.354 7.870 -0.516 25155 2337 1 3 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.627 0.137 25155 2338 1 3 . 1 1 129 129 PRO C C 129 178.860 178.860 177.637 1.223 25155 2339 1 3 . 1 1 129 129 PRO CA C 129 62.728 62.728 64.115 -1.387 25155 2340 1 3 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.428 -0.028 25155 2341 1 3 . 1 1 130 130 LYS N N 130 122.158 122.158 120.026 2.132 25155 2342 1 3 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.126 0.084 25155 2343 1 3 . 1 1 130 130 LYS C C 130 176.890 176.890 176.000 0.890 25155 2344 1 3 . 1 1 130 130 LYS CA C 130 61.375 61.375 61.027 0.348 25155 2345 1 3 . 1 1 130 130 LYS CB C 130 30.350 30.350 31.259 -0.909 25155 2346 1 3 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.473 0.060 25155 2347 1 3 . 1 1 131 131 PRO C C 131 173.810 173.810 175.478 -1.668 25155 2348 1 3 . 1 1 131 131 PRO CA C 131 64.510 64.510 62.770 1.740 25155 2349 1 3 . 1 1 131 131 PRO CB C 131 31.745 31.745 31.337 0.408 25155 2350 1 3 . 1 1 132 132 VAL N N 132 114.480 114.480 114.530 -0.050 25155 2351 1 3 . 1 1 132 132 VAL HA H 132 5.158 5.158 5.081 0.077 25155 2352 1 3 . 1 1 132 132 VAL C C 132 175.137 175.137 174.230 0.907 25155 2353 1 3 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.519 0.281 25155 2354 1 3 . 1 1 132 132 VAL CB C 132 34.780 34.780 35.764 -0.984 25155 2355 1 3 . 1 1 132 132 VAL H H 132 6.716 6.716 7.592 -0.876 25155 2356 1 3 . 1 1 133 133 ILE N N 133 120.670 120.670 113.638 7.032 25155 2357 1 3 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.541 -0.149 25155 2358 1 3 . 1 1 133 133 ILE C C 133 175.485 175.485 175.091 0.394 25155 2359 1 3 . 1 1 133 133 ILE CA C 133 60.000 60.000 59.161 0.839 25155 2360 1 3 . 1 1 133 133 ILE CB C 133 42.020 42.020 41.275 0.745 25155 2361 1 3 . 1 1 133 133 ILE H H 133 8.740 8.740 8.343 0.397 25155 2362 1 3 . 1 1 134 134 ALA N N 134 122.454 122.454 122.920 -0.466 25155 2363 1 3 . 1 1 134 134 ALA HA H 134 3.953 3.953 3.929 0.024 25155 2364 1 3 . 1 1 134 134 ALA C C 134 178.387 178.387 177.417 0.970 25155 2365 1 3 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.366 -0.316 25155 2366 1 3 . 1 1 134 134 ALA CB C 134 16.982 16.982 17.214 -0.232 25155 2367 1 3 . 1 1 134 134 ALA H H 134 8.490 8.490 8.574 -0.084 25155 2368 1 3 . 1 1 135 135 ASP N N 135 117.310 117.310 116.612 0.698 25155 2369 1 3 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.312 -0.068 25155 2370 1 3 . 1 1 135 135 ASP C C 135 176.390 176.390 176.853 -0.463 25155 2371 1 3 . 1 1 135 135 ASP CA C 135 55.120 55.120 54.415 0.705 25155 2372 1 3 . 1 1 135 135 ASP CB C 135 39.865 39.865 40.024 -0.159 25155 2373 1 3 . 1 1 136 136 GLY N N 136 104.336 104.336 103.784 0.552 25155 2374 1 3 . 1 1 136 136 GLY C C 136 174.940 174.940 175.365 -0.425 25155 2375 1 3 . 1 1 136 136 GLY CA C 136 45.150 45.150 45.316 -0.166 25155 2376 1 3 . 1 1 136 136 GLY H H 136 7.592 7.592 7.985 -0.393 25155 2377 1 3 . 1 1 137 137 GLN N N 137 118.675 118.675 119.094 -0.419 25155 2378 1 3 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.365 -0.303 25155 2379 1 3 . 1 1 137 137 GLN C C 137 176.420 176.420 175.238 1.182 25155 2380 1 3 . 1 1 137 137 GLN CA C 137 57.760 57.760 56.590 1.170 25155 2381 1 3 . 1 1 137 137 GLN CB C 137 30.400 30.400 29.890 0.510 25155 2382 1 3 . 1 1 137 137 GLN H H 137 7.843 7.843 7.746 0.097 25155 2383 1 3 . 1 1 138 138 LEU N N 138 118.160 118.160 119.031 -0.871 25155 2384 1 3 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.505 0.456 25155 2385 1 3 . 1 1 138 138 LEU C C 138 175.700 175.700 174.205 1.495 25155 2386 1 3 . 1 1 138 138 LEU CA C 138 53.705 53.705 54.516 -0.811 25155 2387 1 3 . 1 1 138 138 LEU CB C 138 46.480 46.480 46.172 0.308 25155 2388 1 3 . 1 1 138 138 LEU H H 138 7.356 7.356 7.274 0.082 25155 2389 1 3 . 1 1 139 139 PHE N N 139 119.060 119.060 121.699 -2.639 25155 2390 1 3 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.959 0.385 25155 2391 1 3 . 1 1 139 139 PHE C C 139 178.850 178.850 177.510 1.340 25155 2392 1 3 . 1 1 139 139 PHE CA C 139 56.670 56.670 57.426 -0.756 25155 2393 1 3 . 1 1 139 139 PHE CB C 139 43.652 43.652 39.926 3.726 25155 2394 1 3 . 1 1 139 139 PHE H H 139 10.026 10.026 9.216 0.810 25155 2395 1 3 . 1 1 140 140 VAL N N 140 109.905 109.905 117.819 -7.914 25155 2396 1 3 . 1 1 140 140 VAL HA H 140 3.500 3.500 3.451 0.049 25155 2397 1 3 . 1 1 140 140 VAL C C 140 172.860 172.860 175.288 -2.428 25155 2398 1 3 . 1 1 140 140 VAL CA C 140 61.812 61.812 62.108 -0.296 25155 2399 1 3 . 1 1 140 140 VAL CB C 140 30.250 30.250 31.072 -0.822 25155 2400 1 3 . 1 1 140 140 VAL H H 140 7.550 7.550 8.513 -0.963 25155 2401 1 3 . 1 1 141 141 GLY N N 141 106.600 106.600 107.042 -0.442 25155 2402 1 3 . 1 1 141 141 GLY C C 141 171.350 171.350 172.929 -1.579 25155 2403 1 3 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.286 1.174 25155 2404 1 3 . 1 1 141 141 GLY H H 141 7.052 7.052 7.329 -0.277 25155 2405 1 3 . 1 1 142 142 LEU N N 142 117.820 117.820 119.905 -2.085 25155 2406 1 3 . 1 1 142 142 LEU HA H 142 4.962 4.962 3.634 1.328 25155 2407 1 3 . 1 1 142 142 LEU CA C 142 55.600 55.600 54.247 1.353 25155 2408 1 3 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.042 -4.112 25155 2409 1 3 . 1 1 142 142 LEU H H 142 7.643 7.643 8.065 -0.422 25155 2410 1 3 . 1 1 143 143 ALA HA H 143 4.220 4.220 4.157 0.063 25155 2411 1 3 . 1 1 143 143 ALA C C 143 175.505 175.505 176.144 -0.639 25155 2412 1 3 . 1 1 143 143 ALA CA C 143 49.600 49.600 50.909 -1.309 25155 2413 1 3 . 1 1 143 143 ALA CB C 143 23.330 23.330 19.616 3.714 25155 2414 1 3 . 1 1 144 144 LEU N N 144 124.960 124.960 123.451 1.509 25155 2415 1 3 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.673 0.107 25155 2416 1 3 . 1 1 144 144 LEU C C 144 174.700 174.700 175.134 -0.434 25155 2417 1 3 . 1 1 144 144 LEU CA C 144 52.790 52.790 53.078 -0.288 25155 2418 1 3 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.097 0.203 25155 2419 1 3 . 1 1 144 144 LEU H H 144 8.583 8.583 8.225 0.358 25155 2420 1 3 . 1 1 145 145 ASP N N 145 119.100 119.100 118.413 0.687 25155 2421 1 3 . 1 1 145 145 ASP HA H 145 5.422 5.422 5.261 0.161 25155 2422 1 3 . 1 1 145 145 ASP C C 145 176.180 176.180 175.358 0.822 25155 2423 1 3 . 1 1 145 145 ASP CA C 145 53.600 53.600 53.255 0.345 25155 2424 1 3 . 1 1 145 145 ASP CB C 145 43.180 43.180 44.556 -1.376 25155 2425 1 3 . 1 1 147 147 THR HA H 147 4.093 4.093 4.572 -0.479 25155 2426 1 3 . 1 1 147 147 THR C C 147 175.858 175.858 175.369 0.489 25155 2427 1 3 . 1 1 147 147 THR CA C 147 66.400 66.400 63.476 2.924 25155 2428 1 3 . 1 1 147 147 THR CB C 147 69.400 69.400 70.708 -1.308 25155 2429 1 3 . 1 1 147 147 THR H H 147 8.745 8.745 8.725 0.020 25155 2430 1 3 . 1 1 148 148 ASN N N 148 115.408 115.408 119.596 -4.188 25155 2431 1 3 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.670 0.340 25155 2432 1 3 . 1 1 148 148 ASN C C 148 175.750 175.750 175.845 -0.095 25155 2433 1 3 . 1 1 148 148 ASN CA C 148 53.400 53.400 55.203 -1.803 25155 2434 1 3 . 1 1 148 148 ASN CB C 148 41.900 41.900 39.434 2.466 25155 2435 1 3 . 1 1 148 148 ASN H H 148 8.975 8.975 8.638 0.337 25155 2436 1 3 . 1 1 149 149 GLN N N 149 117.900 117.900 116.519 1.381 25155 2437 1 3 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.474 0.462 25155 2438 1 3 . 1 1 149 149 GLN C C 149 178.280 178.280 176.656 1.624 25155 2439 1 3 . 1 1 149 149 GLN CA C 149 53.730 53.730 55.572 -1.842 25155 2440 1 3 . 1 1 149 149 GLN CB C 149 29.790 29.790 28.970 0.820 25155 2441 1 3 . 1 1 149 149 GLN H H 149 7.430 7.430 8.898 -1.468 25155 2442 1 3 . 1 1 150 150 TYR N N 150 121.060 121.060 120.961 0.099 25155 2443 1 3 . 1 1 150 150 TYR HA H 150 4.671 4.671 4.240 0.431 25155 2444 1 3 . 1 1 150 150 TYR C C 150 178.680 178.680 177.006 1.674 25155 2445 1 3 . 1 1 150 150 TYR CA C 150 57.930 57.930 58.892 -0.962 25155 2446 1 3 . 1 1 150 150 TYR CB C 150 38.860 38.860 36.699 2.162 25155 2447 1 3 . 1 1 150 150 TYR H H 150 8.115 8.115 8.349 -0.234 25155 2448 1 3 . 1 1 151 151 ASP N N 151 121.175 121.175 120.253 0.922 25155 2449 1 3 . 1 1 151 151 ASP CA C 151 57.000 57.000 56.196 0.805 25155 2450 1 3 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.495 1.505 25155 2451 1 3 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.814 -0.224 25155 2452 1 3 . 1 1 152 152 LEU C C 152 178.300 178.300 177.070 1.230 25155 2453 1 3 . 1 1 152 152 LEU CA C 152 54.788 54.788 54.683 0.105 25155 2454 1 3 . 1 1 152 152 LEU CB C 152 42.200 42.200 42.692 -0.492 25155 2455 1 3 . 1 1 153 153 SER N N 153 116.170 116.170 119.183 -3.013 25155 2456 1 3 . 1 1 153 153 SER HA H 153 3.911 3.911 4.033 -0.122 25155 2457 1 3 . 1 1 153 153 SER CA C 153 63.400 63.400 62.907 0.493 25155 2458 1 3 . 1 1 153 153 SER CB C 153 63.200 63.200 62.958 0.242 25155 2459 1 3 . 1 1 153 153 SER H H 153 7.378 7.378 7.589 -0.211 25155 2460 1 3 . 1 1 154 154 ASP N N 154 121.640 121.640 120.493 1.147 25155 2461 1 3 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.242 -0.002 25155 2462 1 3 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.874 1.426 25155 2463 1 3 . 1 1 154 154 ASP CB C 154 40.000 40.000 40.634 -0.634 25155 2464 1 3 . 1 1 155 155 GLU HA H 155 4.170 4.170 3.992 0.178 25155 2465 1 3 . 1 1 155 155 GLU C C 155 179.420 179.420 178.636 0.784 25155 2466 1 3 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.471 -0.271 25155 2467 1 3 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.567 -0.087 25155 2468 1 3 . 1 1 156 156 ARG N N 156 121.230 121.230 118.870 2.360 25155 2469 1 3 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.303 -0.027 25155 2470 1 3 . 1 1 156 156 ARG C C 156 177.350 177.350 179.181 -1.831 25155 2471 1 3 . 1 1 156 156 ARG CA C 156 59.950 59.950 58.098 1.852 25155 2472 1 3 . 1 1 156 156 ARG CB C 156 31.100 31.100 29.382 1.718 25155 2473 1 3 . 1 1 157 157 ILE N N 157 118.190 118.190 120.791 -2.601 25155 2474 1 3 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.566 -0.136 25155 2475 1 3 . 1 1 157 157 ILE C C 157 178.480 178.480 178.319 0.161 25155 2476 1 3 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.672 0.888 25155 2477 1 3 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.504 0.976 25155 2478 1 3 . 1 1 157 157 ILE H H 157 8.705 8.705 8.307 0.398 25155 2479 1 3 . 1 1 158 158 GLN N N 158 119.975 119.975 120.512 -0.537 25155 2480 1 3 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.885 0.071 25155 2481 1 3 . 1 1 158 158 GLN C C 158 178.730 178.730 178.340 0.390 25155 2482 1 3 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.712 0.988 25155 2483 1 3 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.479 0.003 25155 2484 1 3 . 1 1 158 158 GLN H H 158 8.262 8.262 8.480 -0.218 25155 2485 1 3 . 1 1 159 159 SER N N 159 115.466 115.466 115.380 0.086 25155 2486 1 3 . 1 1 159 159 SER HA H 159 4.446 4.446 4.253 0.193 25155 2487 1 3 . 1 1 159 159 SER C C 159 177.320 177.320 176.983 0.337 25155 2488 1 3 . 1 1 159 159 SER CA C 159 63.500 63.500 61.370 2.130 25155 2489 1 3 . 1 1 159 159 SER CB C 159 63.818 63.818 63.062 0.756 25155 2490 1 3 . 1 1 159 159 SER H H 159 8.440 8.440 8.301 0.139 25155 2491 1 3 . 1 1 160 160 TRP N N 160 126.784 126.784 124.996 1.788 25155 2492 1 3 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.514 -0.060 25155 2493 1 3 . 1 1 160 160 TRP C C 160 177.934 177.934 177.684 0.250 25155 2494 1 3 . 1 1 160 160 TRP CA C 160 62.745 62.745 62.150 0.595 25155 2495 1 3 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.220 0.130 25155 2496 1 3 . 1 1 160 160 TRP H H 160 9.243 9.243 8.096 1.147 25155 2497 1 3 . 1 1 161 161 CYS N N 161 116.395 116.395 117.970 -1.575 25155 2498 1 3 . 1 1 161 161 CYS HA H 161 3.886 3.886 3.716 0.170 25155 2499 1 3 . 1 1 161 161 CYS C C 161 176.245 176.245 177.114 -0.869 25155 2500 1 3 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.404 0.896 25155 2501 1 3 . 1 1 161 161 CYS CB C 161 27.723 27.723 27.196 0.527 25155 2502 1 3 . 1 1 161 161 CYS H H 161 8.845 8.845 8.998 -0.153 25155 2503 1 3 . 1 1 162 162 GLU N N 162 118.030 118.030 119.371 -1.341 25155 2504 1 3 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.896 0.024 25155 2505 1 3 . 1 1 162 162 GLU C C 162 178.700 178.700 178.820 -0.120 25155 2506 1 3 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.490 0.310 25155 2507 1 3 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.223 0.277 25155 2508 1 3 . 1 1 163 163 GLN N N 163 120.650 120.650 119.813 0.837 25155 2509 1 3 . 1 1 163 163 GLN HA H 163 4.173 4.173 4.102 0.071 25155 2510 1 3 . 1 1 163 163 GLN C C 163 179.700 179.700 178.511 1.189 25155 2511 1 3 . 1 1 163 163 GLN CA C 163 59.688 59.688 58.991 0.697 25155 2512 1 3 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.922 -0.022 25155 2513 1 3 . 1 1 163 163 GLN H H 163 8.148 8.148 7.759 0.389 25155 2514 1 3 . 1 1 164 164 ILE N N 164 114.836 114.836 117.376 -2.540 25155 2515 1 3 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.630 0.430 25155 2516 1 3 . 1 1 164 164 ILE C C 164 178.676 178.676 177.675 1.001 25155 2517 1 3 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.496 1.664 25155 2518 1 3 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.312 0.318 25155 2519 1 3 . 1 1 164 164 ILE H H 164 8.958 8.958 8.195 0.763 25155 2520 1 3 . 1 1 165 165 LEU N N 165 123.700 123.700 119.774 3.926 25155 2521 1 3 . 1 1 165 165 LEU HA H 165 4.100 4.100 3.998 0.102 25155 2522 1 3 . 1 1 165 165 LEU C C 165 180.548 180.548 178.409 2.139 25155 2523 1 3 . 1 1 165 165 LEU CA C 165 58.150 58.150 58.669 -0.519 25155 2524 1 3 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.140 -0.010 25155 2525 1 3 . 1 1 165 165 LEU H H 165 7.830 7.830 7.959 -0.129 25155 2526 1 3 . 1 1 166 166 ASN N N 166 120.160 120.160 118.234 1.926 25155 2527 1 3 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.356 0.214 25155 2528 1 3 . 1 1 166 166 ASN C C 166 175.690 175.690 177.429 -1.739 25155 2529 1 3 . 1 1 166 166 ASN CA C 166 55.946 55.946 56.911 -0.965 25155 2530 1 3 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.150 0.330 25155 2531 1 3 . 1 1 166 166 ASN H H 166 7.706 7.706 7.524 0.182 25155 2532 1 3 . 1 1 167 167 GLU N N 167 121.286 121.286 120.378 0.908 25155 2533 1 3 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.388 -0.284 25155 2534 1 3 . 1 1 167 167 GLU C C 167 180.520 180.520 178.322 2.198 25155 2535 1 3 . 1 1 167 167 GLU CA C 167 59.920 59.920 58.860 1.060 25155 2536 1 3 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.788 1.137 25155 2537 1 3 . 1 1 168 168 MET N N 168 118.622 118.622 115.983 2.639 25155 2538 1 3 . 1 1 168 168 MET HA H 168 3.996 3.996 4.901 -0.905 25155 2539 1 3 . 1 1 168 168 MET C C 168 176.856 176.856 178.513 -1.657 25155 2540 1 3 . 1 1 168 168 MET CA C 168 59.500 59.500 58.450 1.050 25155 2541 1 3 . 1 1 168 168 MET CB C 168 33.700 33.700 33.321 0.379 25155 2542 1 3 . 1 1 168 168 MET H H 168 8.723 8.723 8.328 0.395 25155 2543 1 3 . 1 1 169 169 ALA N N 169 121.760 121.760 123.410 -1.650 25155 2544 1 3 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.343 -0.187 25155 2545 1 3 . 1 1 169 169 ALA C C 169 179.790 179.790 179.652 0.138 25155 2546 1 3 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.360 0.440 25155 2547 1 3 . 1 1 169 169 ALA CB C 169 18.220 18.220 18.822 -0.602 25155 2548 1 3 . 1 1 169 169 ALA H H 169 7.494 7.494 7.987 -0.493 25155 2549 1 3 . 1 1 170 170 GLU N N 170 116.970 116.970 118.475 -1.505 25155 2550 1 3 . 1 1 170 170 GLU HA H 170 4.091 4.091 3.933 0.158 25155 2551 1 3 . 1 1 170 170 GLU C C 170 177.745 177.745 178.856 -1.111 25155 2552 1 3 . 1 1 170 170 GLU CA C 170 58.000 58.000 58.961 -0.961 25155 2553 1 3 . 1 1 170 170 GLU CB C 170 29.730 29.730 28.911 0.819 25155 2554 1 3 . 1 1 171 171 HIS N N 171 118.150 118.150 117.912 0.238 25155 2555 1 3 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.292 0.178 25155 2556 1 3 . 1 1 171 171 HIS C C 171 175.848 175.848 175.636 0.212 25155 2557 1 3 . 1 1 171 171 HIS CA C 171 57.600 57.600 58.029 -0.429 25155 2558 1 3 . 1 1 171 171 HIS CB C 171 30.800 30.800 29.861 0.939 25155 2559 1 3 . 1 1 171 171 HIS H H 171 7.717 7.717 7.579 0.138 25155 2560 1 3 . 1 1 172 172 TYR N N 172 119.483 119.483 115.948 3.535 25155 2561 1 3 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.629 -0.038 25155 2562 1 3 . 1 1 172 172 TYR C C 172 174.590 174.590 174.975 -0.385 25155 2563 1 3 . 1 1 172 172 TYR CA C 172 57.813 57.813 57.244 0.569 25155 2564 1 3 . 1 1 172 172 TYR CB C 172 38.900 38.900 38.752 0.148 25155 2565 1 3 . 1 1 172 172 TYR H H 172 7.778 7.778 8.082 -0.304 25155 2566 1 4 . 1 1 2 2 ASN N N 2 122.966 122.966 118.437 4.529 25155 2567 1 4 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.218 -0.043 25155 2568 1 4 . 1 1 2 2 ASN C C 2 175.200 175.200 173.410 1.790 25155 2569 1 4 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.373 0.547 25155 2570 1 4 . 1 1 2 2 ASN CB C 2 40.000 40.000 41.413 -1.413 25155 2571 1 4 . 1 1 2 2 ASN H H 2 9.392 9.392 8.299 1.093 25155 2572 1 4 . 1 1 3 3 MET N N 3 120.660 120.660 117.044 3.616 25155 2573 1 4 . 1 1 3 3 MET HA H 3 5.565 5.565 5.170 0.395 25155 2574 1 4 . 1 1 3 3 MET C C 3 174.200 174.200 175.420 -1.220 25155 2575 1 4 . 1 1 3 3 MET CA C 3 54.550 54.550 54.657 -0.107 25155 2576 1 4 . 1 1 3 3 MET CB C 3 34.100 34.100 36.180 -2.080 25155 2577 1 4 . 1 1 3 3 MET H H 3 8.745 8.745 8.754 -0.009 25155 2578 1 4 . 1 1 4 4 GLY N N 4 115.792 115.792 109.963 5.829 25155 2579 1 4 . 1 1 4 4 GLY C C 4 170.444 170.444 171.874 -1.430 25155 2580 1 4 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.089 -0.202 25155 2581 1 4 . 1 1 4 4 GLY H H 4 8.989 8.989 8.996 -0.007 25155 2582 1 4 . 1 1 5 5 LEU N N 5 131.175 131.175 124.858 6.317 25155 2583 1 4 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.324 0.998 25155 2584 1 4 . 1 1 5 5 LEU C C 5 175.700 175.700 174.708 0.992 25155 2585 1 4 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.697 -0.377 25155 2586 1 4 . 1 1 5 5 LEU CB C 5 44.700 44.700 43.861 0.839 25155 2587 1 4 . 1 1 5 5 LEU H H 5 8.917 8.917 7.986 0.931 25155 2588 1 4 . 1 1 6 6 PHE N N 6 125.990 125.990 124.915 1.075 25155 2589 1 4 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.742 -0.004 25155 2590 1 4 . 1 1 6 6 PHE C C 6 174.358 174.358 173.483 0.875 25155 2591 1 4 . 1 1 6 6 PHE CA C 6 55.480 55.480 54.912 0.568 25155 2592 1 4 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.349 -0.299 25155 2593 1 4 . 1 1 6 6 PHE H H 6 9.225 9.225 9.239 -0.014 25155 2594 1 4 . 1 1 7 7 TYR N N 7 118.040 118.040 116.609 1.431 25155 2595 1 4 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.689 0.240 25155 2596 1 4 . 1 1 7 7 TYR C C 7 171.690 171.690 174.116 -2.426 25155 2597 1 4 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.509 -1.049 25155 2598 1 4 . 1 1 7 7 TYR CB C 7 40.800 40.800 41.212 -0.412 25155 2599 1 4 . 1 1 7 7 TYR H H 7 8.235 8.235 8.084 0.151 25155 2600 1 4 . 1 1 8 8 GLY N N 8 106.640 106.640 107.777 -1.137 25155 2601 1 4 . 1 1 8 8 GLY C C 8 171.682 171.682 172.297 -0.615 25155 2602 1 4 . 1 1 8 8 GLY CA C 8 44.050 44.050 46.037 -1.987 25155 2603 1 4 . 1 1 8 8 GLY H H 8 6.996 6.996 8.735 -1.739 25155 2604 1 4 . 1 1 9 9 SER N N 9 118.164 118.164 117.772 0.392 25155 2605 1 4 . 1 1 9 9 SER C C 9 174.560 174.560 174.602 -0.042 25155 2606 1 4 . 1 1 9 9 SER CA C 9 57.140 57.140 56.853 0.287 25155 2607 1 4 . 1 1 9 9 SER H H 9 9.680 9.680 7.985 1.695 25155 2608 1 4 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.882 -0.252 25155 2609 1 4 . 1 1 17 17 ALA C C 17 177.740 177.740 179.213 -1.473 25155 2610 1 4 . 1 1 17 17 ALA CA C 17 54.900 54.900 54.689 0.211 25155 2611 1 4 . 1 1 17 17 ALA CB C 17 17.790 17.790 17.799 -0.009 25155 2612 1 4 . 1 1 17 17 ALA H H 17 8.055 8.055 7.621 0.434 25155 2613 1 4 . 1 1 18 18 ALA N N 18 120.026 120.026 121.527 -1.501 25155 2614 1 4 . 1 1 18 18 ALA HA H 18 3.713 3.713 3.950 -0.237 25155 2615 1 4 . 1 1 18 18 ALA C C 18 179.040 179.040 179.394 -0.354 25155 2616 1 4 . 1 1 18 18 ALA CA C 18 54.860 54.860 55.114 -0.253 25155 2617 1 4 . 1 1 18 18 ALA CB C 18 18.200 18.200 18.295 -0.095 25155 2618 1 4 . 1 1 18 18 ALA H H 18 7.015 7.015 7.982 -0.967 25155 2619 1 4 . 1 1 19 19 GLU N N 19 116.656 116.656 117.748 -1.092 25155 2620 1 4 . 1 1 19 19 GLU HA H 19 3.580 3.580 4.019 -0.439 25155 2621 1 4 . 1 1 19 19 GLU C C 19 178.487 178.487 178.919 -0.432 25155 2622 1 4 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.344 0.326 25155 2623 1 4 . 1 1 19 19 GLU CB C 19 29.400 29.400 29.294 0.106 25155 2624 1 4 . 1 1 20 20 LYS N N 20 120.100 120.100 120.235 -0.135 25155 2625 1 4 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.055 0.291 25155 2626 1 4 . 1 1 20 20 LYS C C 20 175.330 175.330 179.212 -3.882 25155 2627 1 4 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.249 -2.149 25155 2628 1 4 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.356 0.644 25155 2629 1 4 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.729 -0.264 25155 2630 1 4 . 1 1 21 21 ILE C C 21 177.680 177.680 178.028 -0.348 25155 2631 1 4 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.581 0.059 25155 2632 1 4 . 1 1 21 21 ILE CB C 21 38.030 38.030 38.033 -0.003 25155 2633 1 4 . 1 1 21 21 ILE H H 21 8.220 8.220 8.525 -0.305 25155 2634 1 4 . 1 1 22 22 ARG N N 22 119.433 119.433 118.554 0.879 25155 2635 1 4 . 1 1 22 22 ARG HA H 22 3.550 3.550 3.987 -0.437 25155 2636 1 4 . 1 1 22 22 ARG C C 22 177.268 177.268 178.233 -0.965 25155 2637 1 4 . 1 1 22 22 ARG CA C 22 59.760 59.760 59.405 0.355 25155 2638 1 4 . 1 1 22 22 ARG CB C 22 28.900 28.900 29.467 -0.567 25155 2639 1 4 . 1 1 23 23 ASP N N 23 118.945 118.945 120.032 -1.087 25155 2640 1 4 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.439 -0.097 25155 2641 1 4 . 1 1 23 23 ASP C C 23 178.470 178.470 178.622 -0.152 25155 2642 1 4 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.136 0.314 25155 2643 1 4 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.881 -0.511 25155 2644 1 4 . 1 1 24 24 ILE N N 24 121.200 121.200 119.315 1.885 25155 2645 1 4 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.801 -0.067 25155 2646 1 4 . 1 1 24 24 ILE C C 24 178.297 178.297 177.902 0.395 25155 2647 1 4 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.459 0.041 25155 2648 1 4 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.512 0.228 25155 2649 1 4 . 1 1 24 24 ILE H H 24 8.160 8.160 7.913 0.247 25155 2650 1 4 . 1 1 25 25 ILE N N 25 121.166 121.166 117.799 3.367 25155 2651 1 4 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.824 -0.181 25155 2652 1 4 . 1 1 25 25 ILE C C 25 176.825 176.825 176.781 0.044 25155 2653 1 4 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.326 2.564 25155 2654 1 4 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.816 -1.066 25155 2655 1 4 . 1 1 25 25 ILE H H 25 8.480 8.480 8.041 0.439 25155 2656 1 4 . 1 1 26 26 GLY N N 26 109.050 109.050 105.045 4.005 25155 2657 1 4 . 1 1 26 26 GLY C C 26 173.800 173.800 172.601 1.199 25155 2658 1 4 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.513 -0.113 25155 2659 1 4 . 1 1 26 26 GLY H H 26 7.945 7.945 7.824 0.121 25155 2660 1 4 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.359 0.004 25155 2661 1 4 . 1 1 27 27 PRO C C 27 177.157 177.157 178.067 -0.910 25155 2662 1 4 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.912 0.618 25155 2663 1 4 . 1 1 27 27 PRO CB C 27 32.000 32.000 31.917 0.083 25155 2664 1 4 . 1 1 28 28 GLU N N 28 116.510 116.510 118.225 -1.715 25155 2665 1 4 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.215 0.045 25155 2666 1 4 . 1 1 28 28 GLU C C 28 177.000 177.000 176.953 0.047 25155 2667 1 4 . 1 1 28 28 GLU CA C 28 57.680 57.680 58.375 -0.695 25155 2668 1 4 . 1 1 28 28 GLU CB C 28 28.620 28.620 28.839 -0.219 25155 2669 1 4 . 1 1 29 29 LEU N N 29 120.334 120.334 112.416 7.918 25155 2670 1 4 . 1 1 29 29 LEU HA H 29 4.650 4.650 4.789 -0.139 25155 2671 1 4 . 1 1 29 29 LEU C C 29 175.676 175.676 174.741 0.935 25155 2672 1 4 . 1 1 29 29 LEU CA C 29 55.924 55.924 54.314 1.610 25155 2673 1 4 . 1 1 29 29 LEU CB C 29 44.880 44.880 43.492 1.388 25155 2674 1 4 . 1 1 29 29 LEU H H 29 7.924 7.924 7.528 0.396 25155 2675 1 4 . 1 1 30 30 VAL N N 30 118.900 118.900 119.626 -0.726 25155 2676 1 4 . 1 1 30 30 VAL HA H 30 4.639 4.639 5.043 -0.404 25155 2677 1 4 . 1 1 30 30 VAL C C 30 174.368 174.368 175.955 -1.587 25155 2678 1 4 . 1 1 30 30 VAL CA C 30 61.110 61.110 60.590 0.520 25155 2679 1 4 . 1 1 30 30 VAL CB C 30 34.500 34.500 35.745 -1.245 25155 2680 1 4 . 1 1 30 30 VAL H H 30 7.486 7.486 7.290 0.196 25155 2681 1 4 . 1 1 31 31 THR N N 31 124.000 124.000 119.828 4.172 25155 2682 1 4 . 1 1 31 31 THR HA H 31 4.331 4.331 4.771 -0.440 25155 2683 1 4 . 1 1 31 31 THR C C 31 172.670 172.670 172.846 -0.176 25155 2684 1 4 . 1 1 31 31 THR CA C 31 61.784 61.784 61.146 0.638 25155 2685 1 4 . 1 1 31 31 THR CB C 31 70.483 70.483 71.597 -1.114 25155 2686 1 4 . 1 1 31 31 THR H H 31 7.947 7.947 8.748 -0.801 25155 2687 1 4 . 1 1 32 32 LEU N N 32 127.408 127.408 125.263 2.145 25155 2688 1 4 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.452 0.185 25155 2689 1 4 . 1 1 32 32 LEU C C 32 176.425 176.425 176.475 -0.050 25155 2690 1 4 . 1 1 32 32 LEU CA C 32 54.760 54.760 55.013 -0.253 25155 2691 1 4 . 1 1 32 32 LEU CB C 32 43.809 43.809 42.993 0.816 25155 2692 1 4 . 1 1 32 32 LEU H H 32 8.614 8.614 8.572 0.042 25155 2693 1 4 . 1 1 33 33 HIS N N 33 120.230 120.230 123.225 -2.995 25155 2694 1 4 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.718 -0.298 25155 2695 1 4 . 1 1 33 33 HIS C C 33 171.914 171.914 173.860 -1.946 25155 2696 1 4 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.289 1.011 25155 2697 1 4 . 1 1 33 33 HIS CB C 33 32.050 32.050 31.280 0.770 25155 2698 1 4 . 1 1 33 33 HIS H H 33 9.130 9.130 8.989 0.141 25155 2699 1 4 . 1 1 34 34 ASN N N 34 123.987 123.987 121.047 2.940 25155 2700 1 4 . 1 1 34 34 ASN HA H 34 3.600 3.600 3.759 -0.159 25155 2701 1 4 . 1 1 34 34 ASN C C 34 177.930 177.930 175.569 2.361 25155 2702 1 4 . 1 1 34 34 ASN CA C 34 51.730 51.730 52.777 -1.047 25155 2703 1 4 . 1 1 34 34 ASN CB C 34 38.747 38.747 38.247 0.500 25155 2704 1 4 . 1 1 34 34 ASN H H 34 8.759 8.759 8.497 0.262 25155 2705 1 4 . 1 1 35 35 LEU N N 35 128.751 128.751 126.091 2.660 25155 2706 1 4 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.082 0.208 25155 2707 1 4 . 1 1 35 35 LEU C C 35 177.363 177.363 178.189 -0.826 25155 2708 1 4 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.684 -0.134 25155 2709 1 4 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.936 0.826 25155 2710 1 4 . 1 1 35 35 LEU H H 35 8.758 8.758 8.380 0.378 25155 2711 1 4 . 1 1 36 36 LYS N N 36 120.870 120.870 118.413 2.457 25155 2712 1 4 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.069 -0.136 25155 2713 1 4 . 1 1 36 36 LYS C C 36 176.540 176.540 177.260 -0.720 25155 2714 1 4 . 1 1 36 36 LYS CA C 36 59.260 59.260 58.038 1.222 25155 2715 1 4 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.111 0.689 25155 2716 1 4 . 1 1 37 37 ASP N N 37 115.288 115.288 116.442 -1.154 25155 2717 1 4 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.616 0.131 25155 2718 1 4 . 1 1 37 37 ASP C C 37 175.500 175.500 176.197 -0.697 25155 2719 1 4 . 1 1 37 37 ASP CA C 37 54.805 54.805 55.179 -0.374 25155 2720 1 4 . 1 1 37 37 ASP CB C 37 44.650 44.650 42.464 2.186 25155 2721 1 4 . 1 1 38 38 ASP N N 38 121.550 121.550 118.074 3.476 25155 2722 1 4 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.916 -0.051 25155 2723 1 4 . 1 1 38 38 ASP C C 38 174.895 174.895 174.808 0.087 25155 2724 1 4 . 1 1 38 38 ASP CA C 38 52.840 52.840 53.103 -0.263 25155 2725 1 4 . 1 1 38 38 ASP CB C 38 42.240 42.240 44.201 -1.961 25155 2726 1 4 . 1 1 39 39 SER N N 39 115.170 115.170 117.741 -2.571 25155 2727 1 4 . 1 1 39 39 SER HA H 39 4.600 4.600 4.731 -0.131 25155 2728 1 4 . 1 1 39 39 SER C C 39 174.930 174.930 174.293 0.637 25155 2729 1 4 . 1 1 39 39 SER CA C 39 54.786 54.786 57.226 -2.440 25155 2730 1 4 . 1 1 39 39 SER CB C 39 64.840 64.840 63.255 1.585 25155 2731 1 4 . 1 1 39 39 SER H H 39 8.330 8.330 8.684 -0.354 25155 2732 1 4 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.496 -0.496 25155 2733 1 4 . 1 1 40 40 PRO C C 40 176.620 176.620 178.204 -1.584 25155 2734 1 4 . 1 1 40 40 PRO CA C 40 63.870 63.870 65.064 -1.194 25155 2735 1 4 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.767 -0.407 25155 2736 1 4 . 1 1 41 41 LYS N N 41 120.913 120.913 119.291 1.622 25155 2737 1 4 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.169 -0.273 25155 2738 1 4 . 1 1 41 41 LYS C C 41 179.580 179.580 178.712 0.868 25155 2739 1 4 . 1 1 41 41 LYS CA C 41 58.000 58.000 58.517 -0.517 25155 2740 1 4 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.457 0.643 25155 2741 1 4 . 1 1 42 42 LEU N N 42 118.206 118.206 121.062 -2.856 25155 2742 1 4 . 1 1 42 42 LEU HA H 42 4.025 4.025 3.937 0.088 25155 2743 1 4 . 1 1 42 42 LEU C C 42 178.630 178.630 178.695 -0.065 25155 2744 1 4 . 1 1 42 42 LEU CA C 42 57.030 57.030 57.621 -0.591 25155 2745 1 4 . 1 1 42 42 LEU CB C 42 41.820 41.820 41.135 0.685 25155 2746 1 4 . 1 1 42 42 LEU H H 42 7.598 7.598 7.566 0.032 25155 2747 1 4 . 1 1 43 43 MET N N 43 118.913 118.913 116.799 2.114 25155 2748 1 4 . 1 1 43 43 MET HA H 43 3.760 3.760 4.218 -0.458 25155 2749 1 4 . 1 1 43 43 MET C C 43 177.710 177.710 177.832 -0.122 25155 2750 1 4 . 1 1 43 43 MET CA C 43 59.864 59.864 58.364 1.500 25155 2751 1 4 . 1 1 43 43 MET CB C 43 32.680 32.680 31.984 0.696 25155 2752 1 4 . 1 1 43 43 MET H H 43 8.180 8.180 8.076 0.104 25155 2753 1 4 . 1 1 44 44 GLU N N 44 110.906 110.906 117.663 -6.757 25155 2754 1 4 . 1 1 44 44 GLU HA H 44 3.732 3.732 4.110 -0.378 25155 2755 1 4 . 1 1 44 44 GLU C C 44 178.120 178.120 178.881 -0.761 25155 2756 1 4 . 1 1 44 44 GLU CA C 44 59.450 59.450 58.931 0.519 25155 2757 1 4 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.662 0.138 25155 2758 1 4 . 1 1 45 45 GLN N N 45 115.770 115.770 118.099 -2.329 25155 2759 1 4 . 1 1 45 45 GLN HA H 45 4.190 4.190 3.976 0.214 25155 2760 1 4 . 1 1 45 45 GLN C C 45 175.480 175.480 176.248 -0.768 25155 2761 1 4 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.354 -1.254 25155 2762 1 4 . 1 1 45 45 GLN CB C 45 28.490 28.490 28.756 -0.266 25155 2763 1 4 . 1 1 45 45 GLN H H 45 7.517 7.517 7.481 0.036 25155 2764 1 4 . 1 1 46 46 TYR N N 46 117.840 117.840 117.306 0.534 25155 2765 1 4 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.515 0.145 25155 2766 1 4 . 1 1 46 46 TYR C C 46 175.480 175.480 176.504 -1.024 25155 2767 1 4 . 1 1 46 46 TYR CA C 46 58.827 58.827 58.073 0.754 25155 2768 1 4 . 1 1 46 46 TYR CB C 46 41.720 41.720 38.570 3.150 25155 2769 1 4 . 1 1 46 46 TYR H H 46 6.955 6.955 7.330 -0.375 25155 2770 1 4 . 1 1 47 47 ASP N N 47 121.540 121.540 122.930 -1.390 25155 2771 1 4 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.622 0.074 25155 2772 1 4 . 1 1 47 47 ASP C C 47 175.677 175.677 175.767 -0.090 25155 2773 1 4 . 1 1 47 47 ASP CA C 47 56.812 56.812 56.886 -0.074 25155 2774 1 4 . 1 1 47 47 ASP CB C 47 42.978 42.978 41.685 1.293 25155 2775 1 4 . 1 1 48 48 VAL N N 48 118.666 118.666 116.989 1.677 25155 2776 1 4 . 1 1 48 48 VAL HA H 48 5.057 5.057 5.005 0.052 25155 2777 1 4 . 1 1 48 48 VAL C C 48 174.180 174.180 174.428 -0.248 25155 2778 1 4 . 1 1 48 48 VAL CA C 48 60.000 60.000 60.449 -0.449 25155 2779 1 4 . 1 1 48 48 VAL CB C 48 36.200 36.200 33.389 2.811 25155 2780 1 4 . 1 1 48 48 VAL H H 48 7.631 7.631 8.051 -0.420 25155 2781 1 4 . 1 1 49 49 LEU N N 49 128.300 128.300 128.438 -0.138 25155 2782 1 4 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.076 0.524 25155 2783 1 4 . 1 1 49 49 LEU C C 49 174.810 174.810 174.996 -0.186 25155 2784 1 4 . 1 1 49 49 LEU CA C 49 52.230 52.230 54.020 -1.790 25155 2785 1 4 . 1 1 49 49 LEU CB C 49 45.400 45.400 45.557 -0.157 25155 2786 1 4 . 1 1 49 49 LEU H H 49 9.469 9.469 8.988 0.481 25155 2787 1 4 . 1 1 50 50 ILE N N 50 124.400 124.400 127.623 -3.223 25155 2788 1 4 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.589 1.061 25155 2789 1 4 . 1 1 50 50 ILE C C 50 175.286 175.286 174.363 0.923 25155 2790 1 4 . 1 1 50 50 ILE CA C 50 59.900 59.900 61.322 -1.421 25155 2791 1 4 . 1 1 50 50 ILE CB C 50 40.200 40.200 39.720 0.480 25155 2792 1 4 . 1 1 50 50 ILE H H 50 9.213 9.213 9.299 -0.086 25155 2793 1 4 . 1 1 51 51 LEU N N 51 127.410 127.410 128.570 -1.160 25155 2794 1 4 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.163 1.907 25155 2795 1 4 . 1 1 51 51 LEU C C 51 174.540 174.540 175.492 -0.952 25155 2796 1 4 . 1 1 51 51 LEU CA C 51 52.950 52.950 53.338 -0.388 25155 2797 1 4 . 1 1 51 51 LEU CB C 51 43.190 43.190 43.200 -0.010 25155 2798 1 4 . 1 1 51 51 LEU H H 51 9.256 9.256 8.836 0.420 25155 2799 1 4 . 1 1 52 52 GLY N N 52 108.290 108.290 111.063 -2.773 25155 2800 1 4 . 1 1 52 52 GLY C C 52 174.330 174.330 171.447 2.883 25155 2801 1 4 . 1 1 52 52 GLY CA C 52 44.040 44.040 43.238 0.802 25155 2802 1 4 . 1 1 52 52 GLY H H 52 8.949 8.949 8.661 0.288 25155 2803 1 4 . 1 1 53 53 ILE N N 53 124.912 124.912 122.377 2.535 25155 2804 1 4 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.438 -0.263 25155 2805 1 4 . 1 1 53 53 ILE C C 53 174.470 174.470 173.056 1.414 25155 2806 1 4 . 1 1 53 53 ILE CA C 53 55.850 55.850 57.503 -1.653 25155 2807 1 4 . 1 1 53 53 ILE CB C 53 42.800 42.800 42.097 0.703 25155 2808 1 4 . 1 1 53 53 ILE H H 53 8.612 8.612 7.331 1.281 25155 2809 1 4 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.897 -0.085 25155 2810 1 4 . 1 1 54 54 PRO C C 54 174.565 174.565 175.981 -1.416 25155 2811 1 4 . 1 1 54 54 PRO CA C 54 61.850 61.850 61.734 0.116 25155 2812 1 4 . 1 1 54 54 PRO CB C 54 32.400 32.400 32.119 0.281 25155 2813 1 4 . 1 1 55 55 THR N N 55 116.040 116.040 121.458 -5.418 25155 2814 1 4 . 1 1 55 55 THR HA H 55 4.522 4.522 4.366 0.156 25155 2815 1 4 . 1 1 55 55 THR C C 55 173.990 173.990 173.956 0.034 25155 2816 1 4 . 1 1 55 55 THR CA C 55 62.845 62.845 63.167 -0.322 25155 2817 1 4 . 1 1 55 55 THR CB C 55 70.795 70.795 69.432 1.363 25155 2818 1 4 . 1 1 55 55 THR H H 55 7.663 7.663 8.830 -1.167 25155 2819 1 4 . 1 1 56 56 TRP N N 56 130.540 130.540 129.393 1.147 25155 2820 1 4 . 1 1 56 56 TRP CA C 56 54.800 54.800 58.492 -3.692 25155 2821 1 4 . 1 1 56 56 TRP H H 56 9.075 9.075 8.382 0.693 25155 2822 1 4 . 1 1 58 58 PHE HA H 58 4.540 4.540 2.764 1.776 25155 2823 1 4 . 1 1 58 58 PHE C C 58 177.070 177.070 173.751 3.319 25155 2824 1 4 . 1 1 58 58 PHE CA C 58 55.460 55.460 57.598 -2.138 25155 2825 1 4 . 1 1 58 58 PHE CB C 58 41.200 41.200 37.251 3.949 25155 2826 1 4 . 1 1 59 59 GLY N N 59 109.796 109.796 106.703 3.093 25155 2827 1 4 . 1 1 59 59 GLY CA C 59 45.763 45.763 44.907 0.856 25155 2828 1 4 . 1 1 59 59 GLY H H 59 8.392 8.392 7.621 0.771 25155 2829 1 4 . 1 1 60 60 GLU C C 60 175.660 175.660 175.260 0.400 25155 2830 1 4 . 1 1 61 61 ILE N N 61 122.380 122.380 121.203 1.177 25155 2831 1 4 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.519 0.921 25155 2832 1 4 . 1 1 61 61 ILE CA C 61 62.100 62.100 62.594 -0.494 25155 2833 1 4 . 1 1 61 61 ILE CB C 61 38.750 38.750 37.344 1.406 25155 2834 1 4 . 1 1 61 61 ILE H H 61 8.436 8.436 8.380 0.056 25155 2835 1 4 . 1 1 62 62 GLN CB C 62 30.570 30.570 29.106 1.464 25155 2836 1 4 . 1 1 63 63 GLU HA H 63 4.030 4.030 3.882 0.148 25155 2837 1 4 . 1 1 63 63 GLU C C 63 177.134 177.134 177.615 -0.481 25155 2838 1 4 . 1 1 63 63 GLU CA C 63 60.520 60.520 60.287 0.233 25155 2839 1 4 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.796 -0.146 25155 2840 1 4 . 1 1 64 64 ASP N N 64 119.630 119.630 118.999 0.631 25155 2841 1 4 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.416 0.176 25155 2842 1 4 . 1 1 64 64 ASP C C 64 178.680 178.680 177.675 1.005 25155 2843 1 4 . 1 1 64 64 ASP CA C 64 57.823 57.823 56.696 1.127 25155 2844 1 4 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.642 0.458 25155 2845 1 4 . 1 1 65 65 TRP N N 65 120.535 120.535 120.092 0.443 25155 2846 1 4 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.517 -0.192 25155 2847 1 4 . 1 1 65 65 TRP C C 65 178.684 178.684 177.932 0.752 25155 2848 1 4 . 1 1 65 65 TRP CA C 65 60.500 60.500 60.598 -0.098 25155 2849 1 4 . 1 1 65 65 TRP CB C 65 30.100 30.100 31.014 -0.914 25155 2850 1 4 . 1 1 65 65 TRP H H 65 7.416 7.416 7.661 -0.245 25155 2851 1 4 . 1 1 66 66 GLU N N 66 120.760 120.760 120.445 0.315 25155 2852 1 4 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.209 -0.389 25155 2853 1 4 . 1 1 66 66 GLU C C 66 178.860 178.860 178.876 -0.016 25155 2854 1 4 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.741 0.359 25155 2855 1 4 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.533 -0.523 25155 2856 1 4 . 1 1 67 67 ALA N N 67 118.972 118.972 121.791 -2.819 25155 2857 1 4 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.204 0.043 25155 2858 1 4 . 1 1 67 67 ALA C C 67 179.610 179.610 178.926 0.684 25155 2859 1 4 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.909 -0.309 25155 2860 1 4 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.856 -0.068 25155 2861 1 4 . 1 1 67 67 ALA H H 67 7.690 7.690 8.478 -0.788 25155 2862 1 4 . 1 1 68 68 VAL N N 68 107.530 107.530 111.299 -3.769 25155 2863 1 4 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.384 0.326 25155 2864 1 4 . 1 1 68 68 VAL C C 68 176.800 176.800 177.029 -0.229 25155 2865 1 4 . 1 1 68 68 VAL CA C 68 60.060 60.060 62.631 -2.571 25155 2866 1 4 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.475 0.125 25155 2867 1 4 . 1 1 68 68 VAL H H 68 7.240 7.240 7.470 -0.230 25155 2868 1 4 . 1 1 69 69 TRP N N 69 126.960 126.960 125.254 1.706 25155 2869 1 4 . 1 1 69 69 TRP HA H 69 4.182 4.182 4.164 0.018 25155 2870 1 4 . 1 1 69 69 TRP C C 69 178.640 178.640 176.793 1.847 25155 2871 1 4 . 1 1 69 69 TRP CA C 69 61.300 61.300 62.539 -1.239 25155 2872 1 4 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.546 2.024 25155 2873 1 4 . 1 1 69 69 TRP H H 69 7.810 7.810 8.048 -0.238 25155 2874 1 4 . 1 1 70 70 ASP N N 70 114.644 114.644 115.703 -1.059 25155 2875 1 4 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.165 0.354 25155 2876 1 4 . 1 1 70 70 ASP C C 70 178.685 178.685 178.247 0.438 25155 2877 1 4 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.164 -0.164 25155 2878 1 4 . 1 1 70 70 ASP CB C 70 39.810 39.810 41.021 -1.211 25155 2879 1 4 . 1 1 71 71 GLN N N 71 120.100 120.100 117.371 2.729 25155 2880 1 4 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.230 -0.040 25155 2881 1 4 . 1 1 71 71 GLN C C 71 178.870 178.870 178.167 0.703 25155 2882 1 4 . 1 1 71 71 GLN CA C 71 57.617 57.617 57.351 0.266 25155 2883 1 4 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.591 -0.771 25155 2884 1 4 . 1 1 71 71 GLN H H 71 7.980 7.980 7.897 0.083 25155 2885 1 4 . 1 1 72 72 LEU N N 72 117.535 117.535 120.725 -3.190 25155 2886 1 4 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.947 -0.150 25155 2887 1 4 . 1 1 72 72 LEU C C 72 178.308 178.308 178.830 -0.522 25155 2888 1 4 . 1 1 72 72 LEU CA C 72 57.340 57.340 57.367 -0.028 25155 2889 1 4 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.265 0.435 25155 2890 1 4 . 1 1 72 72 LEU H H 72 7.435 7.435 7.863 -0.428 25155 2891 1 4 . 1 1 73 73 ASP N N 73 115.534 115.534 119.631 -4.097 25155 2892 1 4 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.336 -0.186 25155 2893 1 4 . 1 1 73 73 ASP C C 73 177.553 177.553 176.891 0.662 25155 2894 1 4 . 1 1 73 73 ASP CA C 73 57.350 57.350 56.777 0.573 25155 2895 1 4 . 1 1 73 73 ASP CB C 73 40.040 40.040 40.633 -0.593 25155 2896 1 4 . 1 1 74 74 ASP N N 74 117.300 117.300 119.065 -1.765 25155 2897 1 4 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.538 0.168 25155 2898 1 4 . 1 1 74 74 ASP C C 74 176.424 176.424 176.958 -0.534 25155 2899 1 4 . 1 1 74 74 ASP CA C 74 54.170 54.170 55.068 -0.898 25155 2900 1 4 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.427 0.393 25155 2901 1 4 . 1 1 75 75 LEU N N 75 118.500 118.500 120.191 -1.691 25155 2902 1 4 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.183 0.112 25155 2903 1 4 . 1 1 75 75 LEU C C 75 176.800 176.800 176.506 0.294 25155 2904 1 4 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.908 -0.508 25155 2905 1 4 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.135 1.145 25155 2906 1 4 . 1 1 75 75 LEU H H 75 6.966 6.966 7.284 -0.318 25155 2907 1 4 . 1 1 76 76 ASN N N 76 123.040 123.040 120.007 3.033 25155 2908 1 4 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.714 0.148 25155 2909 1 4 . 1 1 76 76 ASN C C 76 174.927 174.927 174.304 0.623 25155 2910 1 4 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.566 -1.685 25155 2911 1 4 . 1 1 76 76 ASN CB C 76 37.510 37.510 39.067 -1.557 25155 2912 1 4 . 1 1 76 76 ASN H H 76 9.882 9.882 9.076 0.806 25155 2913 1 4 . 1 1 77 77 LEU N N 77 123.614 123.614 123.875 -0.261 25155 2914 1 4 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.621 -0.251 25155 2915 1 4 . 1 1 77 77 LEU C C 77 175.110 175.110 176.199 -1.089 25155 2916 1 4 . 1 1 77 77 LEU CA C 77 52.200 52.200 54.091 -1.891 25155 2917 1 4 . 1 1 77 77 LEU CB C 77 42.786 42.786 43.104 -0.318 25155 2918 1 4 . 1 1 77 77 LEU H H 77 8.700 8.700 8.526 0.174 25155 2919 1 4 . 1 1 78 78 GLU N N 78 120.822 120.822 121.484 -0.662 25155 2920 1 4 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.323 -0.423 25155 2921 1 4 . 1 1 78 78 GLU C C 78 178.670 178.670 178.035 0.635 25155 2922 1 4 . 1 1 78 78 GLU CA C 78 58.700 58.700 58.056 0.644 25155 2923 1 4 . 1 1 78 78 GLU CB C 78 29.467 29.467 29.479 -0.012 25155 2924 1 4 . 1 1 79 79 GLY N N 79 113.160 113.160 113.737 -0.577 25155 2925 1 4 . 1 1 79 79 GLY C C 79 174.523 174.523 173.705 0.818 25155 2926 1 4 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.444 -0.024 25155 2927 1 4 . 1 1 79 79 GLY H H 79 8.450 8.450 8.919 -0.469 25155 2928 1 4 . 1 1 80 80 LYS N N 80 120.283 120.283 120.095 0.188 25155 2929 1 4 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.359 -0.001 25155 2930 1 4 . 1 1 80 80 LYS C C 80 175.304 175.304 176.101 -0.797 25155 2931 1 4 . 1 1 80 80 LYS CA C 80 56.890 56.890 56.202 0.688 25155 2932 1 4 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.602 -0.482 25155 2933 1 4 . 1 1 81 81 ILE N N 81 122.288 122.288 122.366 -0.078 25155 2934 1 4 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.397 0.409 25155 2935 1 4 . 1 1 81 81 ILE C C 81 174.750 174.750 175.620 -0.870 25155 2936 1 4 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.595 -1.775 25155 2937 1 4 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.276 0.574 25155 2938 1 4 . 1 1 81 81 ILE H H 81 7.405 7.405 8.094 -0.689 25155 2939 1 4 . 1 1 82 82 VAL N N 82 127.793 127.793 126.591 1.202 25155 2940 1 4 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.149 0.131 25155 2941 1 4 . 1 1 82 82 VAL C C 82 172.680 172.680 174.381 -1.701 25155 2942 1 4 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.210 -0.110 25155 2943 1 4 . 1 1 82 82 VAL CB C 82 35.280 35.280 35.734 -0.454 25155 2944 1 4 . 1 1 82 82 VAL H H 82 8.800 8.800 9.141 -0.341 25155 2945 1 4 . 1 1 83 83 ALA N N 83 130.911 130.911 129.647 1.264 25155 2946 1 4 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.678 -0.289 25155 2947 1 4 . 1 1 83 83 ALA C C 83 175.870 175.870 176.327 -0.457 25155 2948 1 4 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.668 0.332 25155 2949 1 4 . 1 1 83 83 ALA CB C 83 23.722 23.722 21.907 1.815 25155 2950 1 4 . 1 1 83 83 ALA H H 83 9.252 9.252 9.046 0.206 25155 2951 1 4 . 1 1 84 84 LEU N N 84 124.269 124.269 123.372 0.897 25155 2952 1 4 . 1 1 84 84 LEU HA H 84 5.508 5.508 4.997 0.511 25155 2953 1 4 . 1 1 84 84 LEU C C 84 175.490 175.490 175.774 -0.284 25155 2954 1 4 . 1 1 84 84 LEU CA C 84 53.670 53.670 54.254 -0.584 25155 2955 1 4 . 1 1 84 84 LEU CB C 84 45.000 45.000 44.907 0.092 25155 2956 1 4 . 1 1 84 84 LEU H H 84 10.378 10.378 8.580 1.798 25155 2957 1 4 . 1 1 85 85 TYR N N 85 115.826 115.826 119.973 -4.147 25155 2958 1 4 . 1 1 85 85 TYR HA H 85 4.950 4.950 5.292 -0.342 25155 2959 1 4 . 1 1 85 85 TYR C C 85 172.661 172.661 173.496 -0.835 25155 2960 1 4 . 1 1 85 85 TYR CA C 85 55.853 55.853 55.625 0.228 25155 2961 1 4 . 1 1 85 85 TYR CB C 85 43.200 43.200 41.394 1.806 25155 2962 1 4 . 1 1 85 85 TYR H H 85 9.200 9.200 8.626 0.574 25155 2963 1 4 . 1 1 86 86 GLY N N 86 106.802 106.802 105.436 1.366 25155 2964 1 4 . 1 1 86 86 GLY C C 86 170.348 170.348 170.994 -0.646 25155 2965 1 4 . 1 1 86 86 GLY CA C 86 44.687 44.687 44.586 0.101 25155 2966 1 4 . 1 1 86 86 GLY H H 86 8.752 8.752 8.386 0.366 25155 2967 1 4 . 1 1 87 87 LEU N N 87 120.860 120.860 119.299 1.561 25155 2968 1 4 . 1 1 87 87 LEU HA H 87 5.476 5.476 5.070 0.406 25155 2969 1 4 . 1 1 87 87 LEU C C 87 177.720 177.720 174.615 3.105 25155 2970 1 4 . 1 1 87 87 LEU CA C 87 52.630 52.630 52.469 0.161 25155 2971 1 4 . 1 1 87 87 LEU CB C 87 45.900 45.900 45.648 0.252 25155 2972 1 4 . 1 1 87 87 LEU H H 87 6.320 6.320 7.785 -1.465 25155 2973 1 4 . 1 1 88 88 GLY N N 88 109.910 109.910 108.956 0.954 25155 2974 1 4 . 1 1 88 88 GLY C C 88 171.386 171.386 171.600 -0.214 25155 2975 1 4 . 1 1 88 88 GLY CA C 88 45.710 45.710 45.153 0.557 25155 2976 1 4 . 1 1 88 88 GLY H H 88 8.320 8.320 8.267 0.053 25155 2977 1 4 . 1 1 89 89 ASP N N 89 121.580 121.580 119.619 1.961 25155 2978 1 4 . 1 1 89 89 ASP HA H 89 5.190 5.190 5.341 -0.151 25155 2979 1 4 . 1 1 89 89 ASP C C 89 176.608 176.608 177.616 -1.008 25155 2980 1 4 . 1 1 89 89 ASP CA C 89 52.200 52.200 52.030 0.170 25155 2981 1 4 . 1 1 89 89 ASP CB C 89 41.900 41.900 42.053 -0.153 25155 2982 1 4 . 1 1 90 90 GLN N N 90 123.900 123.900 126.048 -2.148 25155 2983 1 4 . 1 1 90 90 GLN HA H 90 3.645 3.645 3.745 -0.100 25155 2984 1 4 . 1 1 90 90 GLN C C 90 173.523 173.523 177.893 -4.370 25155 2985 1 4 . 1 1 90 90 GLN CA C 90 58.706 58.706 57.750 0.956 25155 2986 1 4 . 1 1 90 90 GLN CB C 90 28.800 28.800 28.738 0.062 25155 2987 1 4 . 1 1 90 90 GLN H H 90 8.726 8.726 9.512 -0.786 25155 2988 1 4 . 1 1 91 91 LEU N N 91 117.080 117.080 119.895 -2.815 25155 2989 1 4 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.072 0.398 25155 2990 1 4 . 1 1 91 91 LEU C C 91 179.840 179.840 177.484 2.356 25155 2991 1 4 . 1 1 91 91 LEU CA C 91 55.800 55.800 55.255 0.545 25155 2992 1 4 . 1 1 91 91 LEU CB C 91 41.640 41.640 41.242 0.398 25155 2993 1 4 . 1 1 91 91 LEU H H 91 7.092 7.092 8.563 -1.471 25155 2994 1 4 . 1 1 92 92 GLY N N 92 110.460 110.460 106.060 4.400 25155 2995 1 4 . 1 1 92 92 GLY C C 92 174.824 174.824 174.357 0.467 25155 2996 1 4 . 1 1 92 92 GLY CA C 92 46.390 46.390 44.946 1.444 25155 2997 1 4 . 1 1 92 92 GLY H H 92 9.243 9.243 7.806 1.437 25155 2998 1 4 . 1 1 93 93 TYR N N 93 118.140 118.140 116.231 1.909 25155 2999 1 4 . 1 1 93 93 TYR HA H 93 5.173 5.173 3.964 1.209 25155 3000 1 4 . 1 1 93 93 TYR C C 93 177.805 177.805 176.293 1.512 25155 3001 1 4 . 1 1 93 93 TYR CA C 93 57.430 57.430 59.036 -1.606 25155 3002 1 4 . 1 1 93 93 TYR CB C 93 39.300 39.300 35.137 4.163 25155 3003 1 4 . 1 1 93 93 TYR H H 93 7.252 7.252 7.190 0.062 25155 3004 1 4 . 1 1 94 94 GLY N N 94 112.455 112.455 104.081 8.374 25155 3005 1 4 . 1 1 94 94 GLY C C 94 177.740 177.740 175.072 2.668 25155 3006 1 4 . 1 1 94 94 GLY CA C 94 49.880 49.880 45.851 4.029 25155 3007 1 4 . 1 1 94 94 GLY H H 94 8.154 8.154 8.570 -0.416 25155 3008 1 4 . 1 1 95 95 GLU N N 95 123.040 123.040 120.263 2.777 25155 3009 1 4 . 1 1 95 95 GLU HA H 95 4.000 4.000 4.305 -0.305 25155 3010 1 4 . 1 1 95 95 GLU C C 95 175.145 175.145 177.471 -2.326 25155 3011 1 4 . 1 1 95 95 GLU CA C 95 57.950 57.950 58.160 -0.210 25155 3012 1 4 . 1 1 95 95 GLU CB C 95 27.400 27.400 29.886 -2.486 25155 3013 1 4 . 1 1 96 96 TRP N N 96 118.000 118.000 117.462 0.538 25155 3014 1 4 . 1 1 96 96 TRP HA H 96 5.213 5.213 4.923 0.290 25155 3015 1 4 . 1 1 96 96 TRP C C 96 176.616 176.616 175.746 0.870 25155 3016 1 4 . 1 1 96 96 TRP CA C 96 57.120 57.120 56.619 0.501 25155 3017 1 4 . 1 1 96 96 TRP CB C 96 29.970 29.970 30.624 -0.654 25155 3018 1 4 . 1 1 96 96 TRP H H 96 7.785 7.785 7.442 0.343 25155 3019 1 4 . 1 1 97 97 PHE N N 97 123.268 123.268 121.760 1.508 25155 3020 1 4 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.361 0.299 25155 3021 1 4 . 1 1 97 97 PHE CA C 97 58.742 58.742 58.780 -0.038 25155 3022 1 4 . 1 1 97 97 PHE CB C 97 40.835 40.835 39.915 0.920 25155 3023 1 4 . 1 1 97 97 PHE H H 97 7.054 7.054 8.071 -1.017 25155 3024 1 4 . 1 1 98 98 LEU HA H 98 3.440 3.440 3.487 -0.047 25155 3025 1 4 . 1 1 98 98 LEU C C 98 176.613 176.613 176.866 -0.253 25155 3026 1 4 . 1 1 98 98 LEU CA C 98 56.000 56.000 55.057 0.943 25155 3027 1 4 . 1 1 98 98 LEU CB C 98 38.600 38.600 39.093 -0.493 25155 3028 1 4 . 1 1 98 98 LEU H H 98 8.584 8.584 8.252 0.332 25155 3029 1 4 . 1 1 99 99 ASP N N 99 123.268 123.268 120.124 3.144 25155 3030 1 4 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.290 -0.325 25155 3031 1 4 . 1 1 99 99 ASP C C 99 178.876 178.876 176.985 1.891 25155 3032 1 4 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.460 1.800 25155 3033 1 4 . 1 1 99 99 ASP CB C 99 40.350 40.350 41.176 -0.826 25155 3034 1 4 . 1 1 100 100 ALA N N 100 119.124 119.124 121.136 -2.012 25155 3035 1 4 . 1 1 100 100 ALA HA H 100 3.822 3.822 4.113 -0.291 25155 3036 1 4 . 1 1 100 100 ALA C C 100 178.490 178.490 179.179 -0.689 25155 3037 1 4 . 1 1 100 100 ALA CA C 100 55.100 55.100 54.564 0.536 25155 3038 1 4 . 1 1 100 100 ALA CB C 100 19.700 19.700 18.152 1.548 25155 3039 1 4 . 1 1 100 100 ALA H H 100 8.400 8.400 7.765 0.635 25155 3040 1 4 . 1 1 101 101 LEU N N 101 118.687 118.687 120.596 -1.909 25155 3041 1 4 . 1 1 101 101 LEU HA H 101 3.674 3.674 3.953 -0.279 25155 3042 1 4 . 1 1 101 101 LEU C C 101 179.050 179.050 178.617 0.433 25155 3043 1 4 . 1 1 101 101 LEU CA C 101 57.800 57.800 57.186 0.614 25155 3044 1 4 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.556 1.094 25155 3045 1 4 . 1 1 101 101 LEU H H 101 6.518 6.518 7.479 -0.961 25155 3046 1 4 . 1 1 102 102 GLY N N 102 104.410 104.410 106.583 -2.173 25155 3047 1 4 . 1 1 102 102 GLY C C 102 176.056 176.056 176.046 0.010 25155 3048 1 4 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.261 0.489 25155 3049 1 4 . 1 1 102 102 GLY H H 102 7.712 7.712 8.026 -0.314 25155 3050 1 4 . 1 1 103 103 MET N N 103 120.550 120.550 121.694 -1.144 25155 3051 1 4 . 1 1 103 103 MET HA H 103 4.256 4.256 4.344 -0.088 25155 3052 1 4 . 1 1 103 103 MET C C 103 179.650 179.650 178.521 1.129 25155 3053 1 4 . 1 1 103 103 MET CA C 103 59.450 59.450 59.588 -0.138 25155 3054 1 4 . 1 1 103 103 MET CB C 103 32.300 32.300 32.773 -0.473 25155 3055 1 4 . 1 1 103 103 MET H H 103 8.485 8.485 8.147 0.338 25155 3056 1 4 . 1 1 104 104 LEU N N 104 123.480 123.480 120.696 2.784 25155 3057 1 4 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.307 -0.246 25155 3058 1 4 . 1 1 104 104 LEU C C 104 177.750 177.750 178.564 -0.814 25155 3059 1 4 . 1 1 104 104 LEU CA C 104 58.100 58.100 57.704 0.396 25155 3060 1 4 . 1 1 104 104 LEU CB C 104 41.450 41.450 41.295 0.155 25155 3061 1 4 . 1 1 104 104 LEU H H 104 8.392 8.392 8.296 0.096 25155 3062 1 4 . 1 1 105 105 HIS N N 105 119.570 119.570 120.519 -0.949 25155 3063 1 4 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.131 -0.279 25155 3064 1 4 . 1 1 105 105 HIS C C 105 177.550 177.550 177.067 0.483 25155 3065 1 4 . 1 1 105 105 HIS CA C 105 61.000 61.000 60.900 0.100 25155 3066 1 4 . 1 1 105 105 HIS CB C 105 28.820 28.820 30.218 -1.398 25155 3067 1 4 . 1 1 105 105 HIS H H 105 8.247 8.247 8.579 -0.332 25155 3068 1 4 . 1 1 106 106 ASP N N 106 119.780 119.780 119.263 0.517 25155 3069 1 4 . 1 1 106 106 ASP HA H 106 4.333 4.333 4.262 0.071 25155 3070 1 4 . 1 1 106 106 ASP C C 106 179.410 179.410 178.452 0.958 25155 3071 1 4 . 1 1 106 106 ASP CA C 106 57.800 57.800 57.315 0.485 25155 3072 1 4 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.072 -0.472 25155 3073 1 4 . 1 1 107 107 LYS N N 107 121.660 121.660 119.502 2.158 25155 3074 1 4 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.046 0.054 25155 3075 1 4 . 1 1 107 107 LYS C C 107 178.316 178.316 179.121 -0.805 25155 3076 1 4 . 1 1 107 107 LYS CA C 107 58.750 58.750 59.170 -0.420 25155 3077 1 4 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.622 -0.772 25155 3078 1 4 . 1 1 108 108 LEU N N 108 116.050 116.050 117.928 -1.878 25155 3079 1 4 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.380 -0.370 25155 3080 1 4 . 1 1 108 108 LEU C C 108 179.050 179.050 178.892 0.158 25155 3081 1 4 . 1 1 108 108 LEU CA C 108 56.240 56.240 56.452 -0.212 25155 3082 1 4 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.165 -0.365 25155 3083 1 4 . 1 1 108 108 LEU H H 108 8.072 8.072 8.105 -0.033 25155 3084 1 4 . 1 1 109 109 SER N N 109 116.280 116.280 115.640 0.640 25155 3085 1 4 . 1 1 109 109 SER HA H 109 4.300 4.300 4.314 -0.014 25155 3086 1 4 . 1 1 109 109 SER C C 109 175.848 175.848 176.268 -0.420 25155 3087 1 4 . 1 1 109 109 SER CA C 109 62.410 62.410 61.749 0.661 25155 3088 1 4 . 1 1 109 109 SER CB C 109 62.850 62.850 63.017 -0.167 25155 3089 1 4 . 1 1 109 109 SER H H 109 8.366 8.366 8.283 0.083 25155 3090 1 4 . 1 1 110 110 THR N N 110 110.416 110.416 112.933 -2.517 25155 3091 1 4 . 1 1 110 110 THR HA H 110 4.614 4.614 4.340 0.274 25155 3092 1 4 . 1 1 110 110 THR C C 110 175.675 175.675 175.385 0.290 25155 3093 1 4 . 1 1 110 110 THR CA C 110 62.030 62.030 64.082 -2.052 25155 3094 1 4 . 1 1 110 110 THR CB C 110 68.810 68.810 68.794 0.016 25155 3095 1 4 . 1 1 110 110 THR H H 110 7.185 7.185 7.978 -0.793 25155 3096 1 4 . 1 1 111 111 LYS N N 111 120.090 120.090 121.065 -0.975 25155 3097 1 4 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.476 0.037 25155 3098 1 4 . 1 1 111 111 LYS C C 111 176.814 176.814 176.676 0.138 25155 3099 1 4 . 1 1 111 111 LYS CA C 111 55.730 55.730 55.540 0.190 25155 3100 1 4 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.537 -1.607 25155 3101 1 4 . 1 1 112 112 GLY N N 112 107.540 107.540 108.225 -0.685 25155 3102 1 4 . 1 1 112 112 GLY C C 112 176.223 176.223 174.479 1.744 25155 3103 1 4 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.542 1.384 25155 3104 1 4 . 1 1 112 112 GLY H H 112 8.315 8.315 7.604 0.711 25155 3105 1 4 . 1 1 113 113 VAL N N 113 113.536 113.536 116.382 -2.846 25155 3106 1 4 . 1 1 113 113 VAL HA H 113 4.494 4.494 4.284 0.210 25155 3107 1 4 . 1 1 113 113 VAL C C 113 174.560 174.560 174.902 -0.342 25155 3108 1 4 . 1 1 113 113 VAL CA C 113 59.550 59.550 60.963 -1.413 25155 3109 1 4 . 1 1 113 113 VAL CB C 113 32.800 32.800 31.919 0.881 25155 3110 1 4 . 1 1 113 113 VAL H H 113 6.835 6.835 7.064 -0.229 25155 3111 1 4 . 1 1 114 114 LYS N N 114 122.920 122.920 121.679 1.241 25155 3112 1 4 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.419 0.075 25155 3113 1 4 . 1 1 114 114 LYS C C 114 174.925 174.925 174.746 0.179 25155 3114 1 4 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.153 0.127 25155 3115 1 4 . 1 1 114 114 LYS CB C 114 33.630 33.630 34.722 -1.093 25155 3116 1 4 . 1 1 115 115 PHE N N 115 123.140 123.140 123.398 -0.258 25155 3117 1 4 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.504 0.196 25155 3118 1 4 . 1 1 115 115 PHE C C 115 177.580 177.580 176.474 1.106 25155 3119 1 4 . 1 1 115 115 PHE CA C 115 58.677 58.677 57.060 1.617 25155 3120 1 4 . 1 1 115 115 PHE CB C 115 41.120 41.120 40.459 0.661 25155 3121 1 4 . 1 1 115 115 PHE H H 115 8.506 8.506 8.509 -0.003 25155 3122 1 4 . 1 1 116 116 VAL N N 116 115.737 115.737 116.651 -0.914 25155 3123 1 4 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.647 -0.169 25155 3124 1 4 . 1 1 116 116 VAL C C 116 175.300 175.300 175.931 -0.631 25155 3125 1 4 . 1 1 116 116 VAL CA C 116 58.877 58.877 60.192 -1.315 25155 3126 1 4 . 1 1 116 116 VAL CB C 116 34.120 34.120 34.671 -0.551 25155 3127 1 4 . 1 1 116 116 VAL H H 116 8.860 8.860 9.051 -0.191 25155 3128 1 4 . 1 1 117 117 GLY N N 117 108.137 108.137 110.428 -2.291 25155 3129 1 4 . 1 1 117 117 GLY C C 117 176.110 176.110 174.866 1.244 25155 3130 1 4 . 1 1 117 117 GLY CA C 117 47.500 47.500 45.656 1.845 25155 3131 1 4 . 1 1 117 117 GLY H H 117 9.838 9.838 9.512 0.326 25155 3132 1 4 . 1 1 118 118 TYR N N 118 120.380 120.380 119.487 0.893 25155 3133 1 4 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.654 0.316 25155 3134 1 4 . 1 1 118 118 TYR C C 118 177.630 177.630 175.228 2.402 25155 3135 1 4 . 1 1 118 118 TYR CA C 118 55.800 55.800 58.196 -2.396 25155 3136 1 4 . 1 1 118 118 TYR CB C 118 35.970 35.970 38.943 -2.973 25155 3137 1 4 . 1 1 118 118 TYR H H 118 8.652 8.652 8.017 0.635 25155 3138 1 4 . 1 1 119 119 TRP N N 119 126.040 126.040 121.607 4.433 25155 3139 1 4 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.187 0.834 25155 3140 1 4 . 1 1 119 119 TRP C C 119 173.000 173.000 173.584 -0.584 25155 3141 1 4 . 1 1 119 119 TRP CA C 119 53.820 53.820 54.734 -0.914 25155 3142 1 4 . 1 1 119 119 TRP CB C 119 36.050 36.050 33.618 2.432 25155 3143 1 4 . 1 1 119 119 TRP H H 119 8.070 8.070 8.602 -0.532 25155 3144 1 4 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.829 -0.045 25155 3145 1 4 . 1 1 120 120 PRO C C 120 176.870 176.870 176.608 0.262 25155 3146 1 4 . 1 1 120 120 PRO CA C 120 63.780 63.780 62.824 0.956 25155 3147 1 4 . 1 1 120 120 PRO CB C 120 31.990 31.990 32.428 -0.438 25155 3148 1 4 . 1 1 121 121 THR N N 121 109.310 109.310 113.700 -4.390 25155 3149 1 4 . 1 1 121 121 THR HA H 121 4.073 4.073 3.342 0.731 25155 3150 1 4 . 1 1 121 121 THR C C 121 176.324 176.324 175.503 0.821 25155 3151 1 4 . 1 1 121 121 THR CA C 121 61.250 61.250 63.288 -2.038 25155 3152 1 4 . 1 1 121 121 THR CB C 121 69.730 69.730 68.587 1.143 25155 3153 1 4 . 1 1 121 121 THR H H 121 7.370 7.370 8.430 -1.060 25155 3154 1 4 . 1 1 122 122 GLU N N 122 123.937 123.937 121.162 2.775 25155 3155 1 4 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.033 0.191 25155 3156 1 4 . 1 1 122 122 GLU C C 122 177.737 177.737 177.948 -0.211 25155 3157 1 4 . 1 1 122 122 GLU CA C 122 58.200 58.200 57.699 0.501 25155 3158 1 4 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.725 0.075 25155 3159 1 4 . 1 1 123 123 GLY N N 123 114.563 114.563 110.719 3.844 25155 3160 1 4 . 1 1 123 123 GLY C C 123 173.783 173.783 173.217 0.566 25155 3161 1 4 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.483 -0.103 25155 3162 1 4 . 1 1 123 123 GLY H H 123 9.144 9.144 8.975 0.169 25155 3163 1 4 . 1 1 124 124 TYR N N 124 118.800 118.800 119.682 -0.882 25155 3164 1 4 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.912 0.306 25155 3165 1 4 . 1 1 124 124 TYR C C 124 175.673 175.673 173.569 2.104 25155 3166 1 4 . 1 1 124 124 TYR CA C 124 56.950 56.950 56.858 0.092 25155 3167 1 4 . 1 1 124 124 TYR CB C 124 41.100 41.100 41.369 -0.269 25155 3168 1 4 . 1 1 124 124 TYR H H 124 7.895 7.895 7.585 0.310 25155 3169 1 4 . 1 1 125 125 GLU N N 125 124.790 124.790 122.165 2.625 25155 3170 1 4 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.155 0.530 25155 3171 1 4 . 1 1 125 125 GLU C C 125 172.877 172.877 174.566 -1.689 25155 3172 1 4 . 1 1 125 125 GLU CA C 125 55.700 55.700 54.989 0.712 25155 3173 1 4 . 1 1 125 125 GLU CB C 125 31.340 31.340 32.740 -1.400 25155 3174 1 4 . 1 1 126 126 PHE N N 126 118.670 118.670 118.050 0.620 25155 3175 1 4 . 1 1 126 126 PHE HA H 126 4.841 4.841 5.191 -0.350 25155 3176 1 4 . 1 1 126 126 PHE C C 126 173.800 173.800 174.346 -0.546 25155 3177 1 4 . 1 1 126 126 PHE CA C 126 56.950 56.950 56.718 0.233 25155 3178 1 4 . 1 1 126 126 PHE CB C 126 40.300 40.300 40.795 -0.495 25155 3179 1 4 . 1 1 126 126 PHE H H 126 7.645 7.645 7.401 0.244 25155 3180 1 4 . 1 1 127 127 THR N N 127 107.038 107.038 113.650 -6.612 25155 3181 1 4 . 1 1 127 127 THR HA H 127 4.370 4.370 4.415 -0.045 25155 3182 1 4 . 1 1 127 127 THR C C 127 175.100 175.100 174.704 0.396 25155 3183 1 4 . 1 1 127 127 THR CA C 127 61.080 61.080 61.786 -0.706 25155 3184 1 4 . 1 1 127 127 THR CB C 127 70.500 70.500 69.964 0.536 25155 3185 1 4 . 1 1 127 127 THR H H 127 7.306 7.306 8.370 -1.063 25155 3186 1 4 . 1 1 128 128 SER N N 128 118.150 118.150 119.882 -1.732 25155 3187 1 4 . 1 1 128 128 SER HA H 128 4.650 4.650 4.641 0.009 25155 3188 1 4 . 1 1 128 128 SER C C 128 175.760 175.760 173.385 2.375 25155 3189 1 4 . 1 1 128 128 SER CA C 128 55.813 55.813 57.542 -1.729 25155 3190 1 4 . 1 1 128 128 SER CB C 128 65.300 65.300 64.333 0.967 25155 3191 1 4 . 1 1 128 128 SER H H 128 7.354 7.354 7.974 -0.620 25155 3192 1 4 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.527 0.237 25155 3193 1 4 . 1 1 129 129 PRO C C 129 178.860 178.860 178.317 0.543 25155 3194 1 4 . 1 1 129 129 PRO CA C 129 62.728 62.728 64.023 -1.295 25155 3195 1 4 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.400 -0.000 25155 3196 1 4 . 1 1 130 130 LYS N N 130 122.158 122.158 119.420 2.738 25155 3197 1 4 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.113 0.097 25155 3198 1 4 . 1 1 130 130 LYS C C 130 176.890 176.890 175.557 1.333 25155 3199 1 4 . 1 1 130 130 LYS CA C 130 61.375 61.375 60.233 1.142 25155 3200 1 4 . 1 1 130 130 LYS CB C 130 30.350 30.350 30.973 -0.623 25155 3201 1 4 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.385 0.148 25155 3202 1 4 . 1 1 131 131 PRO C C 131 173.810 173.810 175.833 -2.023 25155 3203 1 4 . 1 1 131 131 PRO CA C 131 64.510 64.510 63.525 0.985 25155 3204 1 4 . 1 1 131 131 PRO CB C 131 31.745 31.745 31.793 -0.048 25155 3205 1 4 . 1 1 132 132 VAL N N 132 114.480 114.480 113.546 0.934 25155 3206 1 4 . 1 1 132 132 VAL HA H 132 5.158 5.158 5.088 0.070 25155 3207 1 4 . 1 1 132 132 VAL C C 132 175.137 175.137 174.184 0.953 25155 3208 1 4 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.241 0.559 25155 3209 1 4 . 1 1 132 132 VAL CB C 132 34.780 34.780 35.454 -0.674 25155 3210 1 4 . 1 1 132 132 VAL H H 132 6.716 6.716 7.562 -0.846 25155 3211 1 4 . 1 1 133 133 ILE N N 133 120.670 120.670 113.251 7.419 25155 3212 1 4 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.599 -0.207 25155 3213 1 4 . 1 1 133 133 ILE C C 133 175.485 175.485 175.329 0.156 25155 3214 1 4 . 1 1 133 133 ILE CA C 133 60.000 60.000 59.226 0.774 25155 3215 1 4 . 1 1 133 133 ILE CB C 133 42.020 42.020 41.273 0.747 25155 3216 1 4 . 1 1 133 133 ILE H H 133 8.740 8.740 7.639 1.101 25155 3217 1 4 . 1 1 134 134 ALA N N 134 122.454 122.454 121.799 0.655 25155 3218 1 4 . 1 1 134 134 ALA HA H 134 3.953 3.953 4.001 -0.048 25155 3219 1 4 . 1 1 134 134 ALA C C 134 178.387 178.387 176.477 1.910 25155 3220 1 4 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.230 -0.180 25155 3221 1 4 . 1 1 134 134 ALA CB C 134 16.982 16.982 17.241 -0.260 25155 3222 1 4 . 1 1 134 134 ALA H H 134 8.490 8.490 8.659 -0.169 25155 3223 1 4 . 1 1 135 135 ASP N N 135 117.310 117.310 116.222 1.088 25155 3224 1 4 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.345 -0.101 25155 3225 1 4 . 1 1 135 135 ASP C C 135 176.390 176.390 175.834 0.556 25155 3226 1 4 . 1 1 135 135 ASP CA C 135 55.120 55.120 54.708 0.412 25155 3227 1 4 . 1 1 135 135 ASP CB C 135 39.865 39.865 39.900 -0.035 25155 3228 1 4 . 1 1 136 136 GLY N N 136 104.336 104.336 105.771 -1.435 25155 3229 1 4 . 1 1 136 136 GLY C C 136 174.940 174.940 174.567 0.373 25155 3230 1 4 . 1 1 136 136 GLY CA C 136 45.150 45.150 45.239 -0.089 25155 3231 1 4 . 1 1 136 136 GLY H H 136 7.592 7.592 8.046 -0.454 25155 3232 1 4 . 1 1 137 137 GLN N N 137 118.675 118.675 118.857 -0.182 25155 3233 1 4 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.650 -0.588 25155 3234 1 4 . 1 1 137 137 GLN C C 137 176.420 176.420 175.003 1.417 25155 3235 1 4 . 1 1 137 137 GLN CA C 137 57.760 57.760 56.372 1.388 25155 3236 1 4 . 1 1 137 137 GLN CB C 137 30.400 30.400 31.594 -1.194 25155 3237 1 4 . 1 1 137 137 GLN H H 137 7.843 7.843 8.370 -0.527 25155 3238 1 4 . 1 1 138 138 LEU N N 138 118.160 118.160 119.100 -0.940 25155 3239 1 4 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.964 -0.003 25155 3240 1 4 . 1 1 138 138 LEU C C 138 175.700 175.700 176.343 -0.643 25155 3241 1 4 . 1 1 138 138 LEU CA C 138 53.705 53.705 53.491 0.214 25155 3242 1 4 . 1 1 138 138 LEU CB C 138 46.480 46.480 44.834 1.645 25155 3243 1 4 . 1 1 138 138 LEU H H 138 7.356 7.356 7.379 -0.023 25155 3244 1 4 . 1 1 139 139 PHE N N 139 119.060 119.060 121.951 -2.891 25155 3245 1 4 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.473 0.871 25155 3246 1 4 . 1 1 139 139 PHE C C 139 178.850 178.850 176.369 2.481 25155 3247 1 4 . 1 1 139 139 PHE CA C 139 56.670 56.670 58.624 -1.954 25155 3248 1 4 . 1 1 139 139 PHE CB C 139 43.652 43.652 38.311 5.341 25155 3249 1 4 . 1 1 139 139 PHE H H 139 10.026 10.026 8.785 1.241 25155 3250 1 4 . 1 1 140 140 VAL N N 140 109.905 109.905 110.236 -0.331 25155 3251 1 4 . 1 1 140 140 VAL HA H 140 3.500 3.500 2.172 1.328 25155 3252 1 4 . 1 1 140 140 VAL C C 140 172.860 172.860 173.869 -1.009 25155 3253 1 4 . 1 1 140 140 VAL CA C 140 61.812 61.812 62.614 -0.802 25155 3254 1 4 . 1 1 140 140 VAL CB C 140 30.250 30.250 29.455 0.795 25155 3255 1 4 . 1 1 140 140 VAL H H 140 7.550 7.550 7.496 0.054 25155 3256 1 4 . 1 1 141 141 GLY N N 141 106.600 106.600 104.030 2.570 25155 3257 1 4 . 1 1 141 141 GLY C C 141 171.350 171.350 172.641 -1.291 25155 3258 1 4 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.542 0.918 25155 3259 1 4 . 1 1 141 141 GLY H H 141 7.052 7.052 7.182 -0.130 25155 3260 1 4 . 1 1 142 142 LEU N N 142 117.820 117.820 119.645 -1.825 25155 3261 1 4 . 1 1 142 142 LEU HA H 142 4.962 4.962 4.358 0.604 25155 3262 1 4 . 1 1 142 142 LEU CA C 142 55.600 55.600 54.427 1.173 25155 3263 1 4 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.913 -4.983 25155 3264 1 4 . 1 1 142 142 LEU H H 142 7.643 7.643 8.551 -0.908 25155 3265 1 4 . 1 1 143 143 ALA HA H 143 4.220 4.220 3.983 0.237 25155 3266 1 4 . 1 1 143 143 ALA C C 143 175.505 175.505 175.342 0.163 25155 3267 1 4 . 1 1 143 143 ALA CA C 143 49.600 49.600 50.391 -0.791 25155 3268 1 4 . 1 1 143 143 ALA CB C 143 23.330 23.330 19.050 4.280 25155 3269 1 4 . 1 1 144 144 LEU N N 144 124.960 124.960 121.353 3.607 25155 3270 1 4 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.405 0.375 25155 3271 1 4 . 1 1 144 144 LEU C C 144 174.700 174.700 174.806 -0.106 25155 3272 1 4 . 1 1 144 144 LEU CA C 144 52.790 52.790 53.457 -0.667 25155 3273 1 4 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.733 -0.433 25155 3274 1 4 . 1 1 144 144 LEU H H 144 8.583 8.583 7.502 1.081 25155 3275 1 4 . 1 1 145 145 ASP N N 145 119.100 119.100 118.907 0.193 25155 3276 1 4 . 1 1 145 145 ASP HA H 145 5.422 5.422 5.430 -0.008 25155 3277 1 4 . 1 1 145 145 ASP C C 145 176.180 176.180 175.462 0.718 25155 3278 1 4 . 1 1 145 145 ASP CA C 145 53.600 53.600 52.695 0.905 25155 3279 1 4 . 1 1 145 145 ASP CB C 145 43.180 43.180 44.802 -1.622 25155 3280 1 4 . 1 1 147 147 THR HA H 147 4.093 4.093 4.644 -0.551 25155 3281 1 4 . 1 1 147 147 THR C C 147 175.858 175.858 174.949 0.909 25155 3282 1 4 . 1 1 147 147 THR CA C 147 66.400 66.400 64.016 2.384 25155 3283 1 4 . 1 1 147 147 THR CB C 147 69.400 69.400 70.585 -1.185 25155 3284 1 4 . 1 1 147 147 THR H H 147 8.745 8.745 8.771 -0.026 25155 3285 1 4 . 1 1 148 148 ASN N N 148 115.408 115.408 117.081 -1.673 25155 3286 1 4 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.820 0.190 25155 3287 1 4 . 1 1 148 148 ASN C C 148 175.750 175.750 176.215 -0.465 25155 3288 1 4 . 1 1 148 148 ASN CA C 148 53.400 53.400 53.941 -0.540 25155 3289 1 4 . 1 1 148 148 ASN CB C 148 41.900 41.900 40.053 1.847 25155 3290 1 4 . 1 1 148 148 ASN H H 148 8.975 8.975 8.824 0.151 25155 3291 1 4 . 1 1 149 149 GLN N N 149 117.900 117.900 118.367 -0.467 25155 3292 1 4 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.404 0.532 25155 3293 1 4 . 1 1 149 149 GLN C C 149 178.280 178.280 176.288 1.992 25155 3294 1 4 . 1 1 149 149 GLN CA C 149 53.730 53.730 54.891 -1.161 25155 3295 1 4 . 1 1 149 149 GLN CB C 149 29.790 29.790 29.982 -0.192 25155 3296 1 4 . 1 1 149 149 GLN H H 149 7.430 7.430 8.811 -1.381 25155 3297 1 4 . 1 1 150 150 TYR N N 150 121.060 121.060 120.032 1.028 25155 3298 1 4 . 1 1 150 150 TYR HA H 150 4.671 4.671 4.357 0.314 25155 3299 1 4 . 1 1 150 150 TYR C C 150 178.680 178.680 176.307 2.373 25155 3300 1 4 . 1 1 150 150 TYR CA C 150 57.930 57.930 59.636 -1.706 25155 3301 1 4 . 1 1 150 150 TYR CB C 150 38.860 38.860 37.314 1.546 25155 3302 1 4 . 1 1 150 150 TYR H H 150 8.115 8.115 7.974 0.141 25155 3303 1 4 . 1 1 151 151 ASP N N 151 121.175 121.175 120.157 1.018 25155 3304 1 4 . 1 1 151 151 ASP CA C 151 57.000 57.000 56.282 0.717 25155 3305 1 4 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.443 1.558 25155 3306 1 4 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.235 0.355 25155 3307 1 4 . 1 1 152 152 LEU C C 152 178.300 178.300 177.886 0.414 25155 3308 1 4 . 1 1 152 152 LEU CA C 152 54.788 54.788 55.956 -1.168 25155 3309 1 4 . 1 1 152 152 LEU CB C 152 42.200 42.200 41.896 0.304 25155 3310 1 4 . 1 1 153 153 SER N N 153 116.170 116.170 116.028 0.142 25155 3311 1 4 . 1 1 153 153 SER HA H 153 3.911 3.911 3.962 -0.051 25155 3312 1 4 . 1 1 153 153 SER CA C 153 63.400 63.400 62.103 1.297 25155 3313 1 4 . 1 1 153 153 SER CB C 153 63.200 63.200 62.805 0.395 25155 3314 1 4 . 1 1 153 153 SER H H 153 7.378 7.378 7.738 -0.360 25155 3315 1 4 . 1 1 154 154 ASP N N 154 121.640 121.640 121.079 0.561 25155 3316 1 4 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.332 -0.092 25155 3317 1 4 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.358 1.942 25155 3318 1 4 . 1 1 154 154 ASP CB C 154 40.000 40.000 40.993 -0.993 25155 3319 1 4 . 1 1 155 155 GLU HA H 155 4.170 4.170 4.054 0.116 25155 3320 1 4 . 1 1 155 155 GLU C C 155 179.420 179.420 179.075 0.345 25155 3321 1 4 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.110 0.090 25155 3322 1 4 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.478 0.002 25155 3323 1 4 . 1 1 156 156 ARG N N 156 121.230 121.230 119.092 2.138 25155 3324 1 4 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.295 -0.019 25155 3325 1 4 . 1 1 156 156 ARG C C 156 177.350 177.350 179.388 -2.038 25155 3326 1 4 . 1 1 156 156 ARG CA C 156 59.950 59.950 59.475 0.475 25155 3327 1 4 . 1 1 156 156 ARG CB C 156 31.100 31.100 30.212 0.888 25155 3328 1 4 . 1 1 157 157 ILE N N 157 118.190 118.190 120.229 -2.039 25155 3329 1 4 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.636 -0.206 25155 3330 1 4 . 1 1 157 157 ILE C C 157 178.480 178.480 177.761 0.719 25155 3331 1 4 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.597 0.963 25155 3332 1 4 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.817 0.663 25155 3333 1 4 . 1 1 157 157 ILE H H 157 8.705 8.705 8.360 0.345 25155 3334 1 4 . 1 1 158 158 GLN N N 158 119.975 119.975 120.444 -0.469 25155 3335 1 4 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.900 0.056 25155 3336 1 4 . 1 1 158 158 GLN C C 158 178.730 178.730 178.305 0.425 25155 3337 1 4 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.282 1.418 25155 3338 1 4 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.300 0.182 25155 3339 1 4 . 1 1 158 158 GLN H H 158 8.262 8.262 8.472 -0.210 25155 3340 1 4 . 1 1 159 159 SER N N 159 115.466 115.466 115.504 -0.038 25155 3341 1 4 . 1 1 159 159 SER HA H 159 4.446 4.446 4.273 0.173 25155 3342 1 4 . 1 1 159 159 SER C C 159 177.320 177.320 176.811 0.509 25155 3343 1 4 . 1 1 159 159 SER CA C 159 63.500 63.500 61.130 2.370 25155 3344 1 4 . 1 1 159 159 SER CB C 159 63.818 63.818 63.238 0.580 25155 3345 1 4 . 1 1 159 159 SER H H 159 8.440 8.440 8.338 0.102 25155 3346 1 4 . 1 1 160 160 TRP N N 160 126.784 126.784 125.118 1.666 25155 3347 1 4 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.436 0.018 25155 3348 1 4 . 1 1 160 160 TRP C C 160 177.934 177.934 177.586 0.348 25155 3349 1 4 . 1 1 160 160 TRP CA C 160 62.745 62.745 61.989 0.756 25155 3350 1 4 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.378 -0.028 25155 3351 1 4 . 1 1 160 160 TRP H H 160 9.243 9.243 7.807 1.436 25155 3352 1 4 . 1 1 161 161 CYS N N 161 116.395 116.395 118.943 -2.548 25155 3353 1 4 . 1 1 161 161 CYS HA H 161 3.886 3.886 3.647 0.239 25155 3354 1 4 . 1 1 161 161 CYS C C 161 176.245 176.245 177.063 -0.818 25155 3355 1 4 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.794 0.506 25155 3356 1 4 . 1 1 161 161 CYS CB C 161 27.723 27.723 27.143 0.580 25155 3357 1 4 . 1 1 161 161 CYS H H 161 8.845 8.845 9.104 -0.259 25155 3358 1 4 . 1 1 162 162 GLU N N 162 118.030 118.030 119.316 -1.286 25155 3359 1 4 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.856 0.064 25155 3360 1 4 . 1 1 162 162 GLU C C 162 178.700 178.700 178.735 -0.035 25155 3361 1 4 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.474 0.326 25155 3362 1 4 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.252 0.249 25155 3363 1 4 . 1 1 163 163 GLN N N 163 120.650 120.650 119.642 1.008 25155 3364 1 4 . 1 1 163 163 GLN HA H 163 4.173 4.173 4.046 0.127 25155 3365 1 4 . 1 1 163 163 GLN C C 163 179.700 179.700 178.562 1.138 25155 3366 1 4 . 1 1 163 163 GLN CA C 163 59.688 59.688 58.962 0.726 25155 3367 1 4 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.808 0.092 25155 3368 1 4 . 1 1 163 163 GLN H H 163 8.148 8.148 7.807 0.341 25155 3369 1 4 . 1 1 164 164 ILE N N 164 114.836 114.836 116.668 -1.832 25155 3370 1 4 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.691 0.369 25155 3371 1 4 . 1 1 164 164 ILE C C 164 178.676 178.676 177.653 1.023 25155 3372 1 4 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.361 1.800 25155 3373 1 4 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.326 0.304 25155 3374 1 4 . 1 1 164 164 ILE H H 164 8.958 8.958 8.236 0.722 25155 3375 1 4 . 1 1 165 165 LEU N N 165 123.700 123.700 120.336 3.364 25155 3376 1 4 . 1 1 165 165 LEU HA H 165 4.100 4.100 4.076 0.024 25155 3377 1 4 . 1 1 165 165 LEU C C 165 180.548 180.548 178.313 2.235 25155 3378 1 4 . 1 1 165 165 LEU CA C 165 58.150 58.150 58.002 0.149 25155 3379 1 4 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.375 -0.245 25155 3380 1 4 . 1 1 165 165 LEU H H 165 7.830 7.830 7.624 0.206 25155 3381 1 4 . 1 1 166 166 ASN N N 166 120.160 120.160 118.129 2.031 25155 3382 1 4 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.333 0.237 25155 3383 1 4 . 1 1 166 166 ASN C C 166 175.690 175.690 177.263 -1.573 25155 3384 1 4 . 1 1 166 166 ASN CA C 166 55.946 55.946 56.579 -0.633 25155 3385 1 4 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.539 -0.059 25155 3386 1 4 . 1 1 166 166 ASN H H 166 7.706 7.706 7.945 -0.239 25155 3387 1 4 . 1 1 167 167 GLU N N 167 121.286 121.286 121.063 0.223 25155 3388 1 4 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.481 -0.377 25155 3389 1 4 . 1 1 167 167 GLU C C 167 180.520 180.520 179.046 1.474 25155 3390 1 4 . 1 1 167 167 GLU CA C 167 59.920 59.920 58.601 1.319 25155 3391 1 4 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.826 1.099 25155 3392 1 4 . 1 1 168 168 MET N N 168 118.622 118.622 116.149 2.473 25155 3393 1 4 . 1 1 168 168 MET HA H 168 3.996 3.996 4.548 -0.552 25155 3394 1 4 . 1 1 168 168 MET C C 168 176.856 176.856 177.555 -0.699 25155 3395 1 4 . 1 1 168 168 MET CA C 168 59.500 59.500 58.336 1.164 25155 3396 1 4 . 1 1 168 168 MET CB C 168 33.700 33.700 32.979 0.721 25155 3397 1 4 . 1 1 168 168 MET H H 168 8.723 8.723 8.261 0.462 25155 3398 1 4 . 1 1 169 169 ALA N N 169 121.760 121.760 122.747 -0.987 25155 3399 1 4 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.278 -0.122 25155 3400 1 4 . 1 1 169 169 ALA C C 169 179.790 179.790 180.114 -0.324 25155 3401 1 4 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.224 0.576 25155 3402 1 4 . 1 1 169 169 ALA CB C 169 18.220 18.220 19.011 -0.791 25155 3403 1 4 . 1 1 169 169 ALA H H 169 7.494 7.494 7.606 -0.112 25155 3404 1 4 . 1 1 170 170 GLU N N 170 116.970 116.970 119.082 -2.112 25155 3405 1 4 . 1 1 170 170 GLU HA H 170 4.091 4.091 4.073 0.018 25155 3406 1 4 . 1 1 170 170 GLU C C 170 177.745 177.745 178.770 -1.025 25155 3407 1 4 . 1 1 170 170 GLU CA C 170 58.000 58.000 58.885 -0.885 25155 3408 1 4 . 1 1 170 170 GLU CB C 170 29.730 29.730 29.210 0.520 25155 3409 1 4 . 1 1 171 171 HIS N N 171 118.150 118.150 120.121 -1.971 25155 3410 1 4 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.353 0.117 25155 3411 1 4 . 1 1 171 171 HIS C C 171 175.848 175.848 176.186 -0.338 25155 3412 1 4 . 1 1 171 171 HIS CA C 171 57.600 57.600 58.559 -0.959 25155 3413 1 4 . 1 1 171 171 HIS CB C 171 30.800 30.800 29.812 0.988 25155 3414 1 4 . 1 1 171 171 HIS H H 171 7.717 7.717 7.972 -0.255 25155 3415 1 4 . 1 1 172 172 TYR N N 172 119.483 119.483 118.341 1.142 25155 3416 1 4 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.372 0.219 25155 3417 1 4 . 1 1 172 172 TYR C C 172 174.590 174.590 175.789 -1.199 25155 3418 1 4 . 1 1 172 172 TYR CA C 172 57.813 57.813 58.219 -0.406 25155 3419 1 4 . 1 1 172 172 TYR CB C 172 38.900 38.900 38.801 0.099 25155 3420 1 4 . 1 1 172 172 TYR H H 172 7.778 7.778 7.850 -0.072 25155 3421 1 5 . 1 1 2 2 ASN N N 2 122.966 122.966 120.282 2.684 25155 3422 1 5 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.285 -0.110 25155 3423 1 5 . 1 1 2 2 ASN C C 2 175.200 175.200 174.661 0.539 25155 3424 1 5 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.551 0.369 25155 3425 1 5 . 1 1 2 2 ASN CB C 2 40.000 40.000 42.479 -2.479 25155 3426 1 5 . 1 1 2 2 ASN H H 2 9.392 9.392 9.139 0.253 25155 3427 1 5 . 1 1 3 3 MET N N 3 120.660 120.660 121.519 -0.859 25155 3428 1 5 . 1 1 3 3 MET HA H 3 5.565 5.565 5.152 0.413 25155 3429 1 5 . 1 1 3 3 MET C C 3 174.200 174.200 175.274 -1.074 25155 3430 1 5 . 1 1 3 3 MET CA C 3 54.550 54.550 54.179 0.371 25155 3431 1 5 . 1 1 3 3 MET CB C 3 34.100 34.100 35.380 -1.280 25155 3432 1 5 . 1 1 3 3 MET H H 3 8.745 8.745 8.852 -0.107 25155 3433 1 5 . 1 1 4 4 GLY N N 4 115.792 115.792 109.957 5.835 25155 3434 1 5 . 1 1 4 4 GLY C C 4 170.444 170.444 171.793 -1.349 25155 3435 1 5 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.303 -0.416 25155 3436 1 5 . 1 1 4 4 GLY H H 4 8.989 8.989 9.037 -0.048 25155 3437 1 5 . 1 1 5 5 LEU N N 5 131.175 131.175 128.287 2.888 25155 3438 1 5 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.234 1.088 25155 3439 1 5 . 1 1 5 5 LEU C C 5 175.700 175.700 174.526 1.174 25155 3440 1 5 . 1 1 5 5 LEU CA C 5 53.320 53.320 52.927 0.393 25155 3441 1 5 . 1 1 5 5 LEU CB C 5 44.700 44.700 43.179 1.521 25155 3442 1 5 . 1 1 5 5 LEU H H 5 8.917 8.917 8.800 0.117 25155 3443 1 5 . 1 1 6 6 PHE N N 6 125.990 125.990 125.207 0.783 25155 3444 1 5 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.741 -0.003 25155 3445 1 5 . 1 1 6 6 PHE C C 6 174.358 174.358 173.328 1.030 25155 3446 1 5 . 1 1 6 6 PHE CA C 6 55.480 55.480 54.614 0.866 25155 3447 1 5 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.378 -0.328 25155 3448 1 5 . 1 1 6 6 PHE H H 6 9.225 9.225 8.914 0.311 25155 3449 1 5 . 1 1 7 7 TYR N N 7 118.040 118.040 119.282 -1.242 25155 3450 1 5 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.693 0.236 25155 3451 1 5 . 1 1 7 7 TYR C C 7 171.690 171.690 176.312 -4.622 25155 3452 1 5 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.950 -1.490 25155 3453 1 5 . 1 1 7 7 TYR CB C 7 40.800 40.800 43.166 -2.366 25155 3454 1 5 . 1 1 7 7 TYR H H 7 8.235 8.235 8.611 -0.376 25155 3455 1 5 . 1 1 8 8 GLY N N 8 106.640 106.640 108.128 -1.488 25155 3456 1 5 . 1 1 8 8 GLY C C 8 171.682 171.682 174.698 -3.016 25155 3457 1 5 . 1 1 8 8 GLY CA C 8 44.050 44.050 44.221 -0.171 25155 3458 1 5 . 1 1 8 8 GLY H H 8 6.996 6.996 8.833 -1.837 25155 3459 1 5 . 1 1 9 9 SER N N 9 118.164 118.164 114.342 3.822 25155 3460 1 5 . 1 1 9 9 SER C C 9 174.560 174.560 174.882 -0.322 25155 3461 1 5 . 1 1 9 9 SER CA C 9 57.140 57.140 59.993 -2.853 25155 3462 1 5 . 1 1 9 9 SER H H 9 9.680 9.680 8.447 1.233 25155 3463 1 5 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.909 -0.279 25155 3464 1 5 . 1 1 17 17 ALA C C 17 177.740 177.740 179.132 -1.392 25155 3465 1 5 . 1 1 17 17 ALA CA C 17 54.900 54.900 55.075 -0.175 25155 3466 1 5 . 1 1 17 17 ALA CB C 17 17.790 17.790 17.929 -0.139 25155 3467 1 5 . 1 1 17 17 ALA H H 17 8.055 8.055 8.154 -0.099 25155 3468 1 5 . 1 1 18 18 ALA N N 18 120.026 120.026 120.511 -0.485 25155 3469 1 5 . 1 1 18 18 ALA HA H 18 3.713 3.713 4.224 -0.511 25155 3470 1 5 . 1 1 18 18 ALA C C 18 179.040 179.040 179.753 -0.713 25155 3471 1 5 . 1 1 18 18 ALA CA C 18 54.860 54.860 55.432 -0.572 25155 3472 1 5 . 1 1 18 18 ALA CB C 18 18.200 18.200 18.244 -0.044 25155 3473 1 5 . 1 1 18 18 ALA H H 18 7.015 7.015 7.842 -0.827 25155 3474 1 5 . 1 1 19 19 GLU N N 19 116.656 116.656 118.549 -1.893 25155 3475 1 5 . 1 1 19 19 GLU HA H 19 3.580 3.580 4.077 -0.497 25155 3476 1 5 . 1 1 19 19 GLU C C 19 178.487 178.487 179.433 -0.946 25155 3477 1 5 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.461 0.209 25155 3478 1 5 . 1 1 19 19 GLU CB C 19 29.400 29.400 29.250 0.149 25155 3479 1 5 . 1 1 20 20 LYS N N 20 120.100 120.100 120.108 -0.008 25155 3480 1 5 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.077 0.269 25155 3481 1 5 . 1 1 20 20 LYS C C 20 175.330 175.330 179.227 -3.897 25155 3482 1 5 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.407 -2.307 25155 3483 1 5 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.480 0.520 25155 3484 1 5 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.686 -0.221 25155 3485 1 5 . 1 1 21 21 ILE C C 21 177.680 177.680 178.020 -0.340 25155 3486 1 5 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.507 0.133 25155 3487 1 5 . 1 1 21 21 ILE CB C 21 38.030 38.030 38.041 -0.011 25155 3488 1 5 . 1 1 21 21 ILE H H 21 8.220 8.220 8.560 -0.340 25155 3489 1 5 . 1 1 22 22 ARG N N 22 119.433 119.433 118.333 1.100 25155 3490 1 5 . 1 1 22 22 ARG HA H 22 3.550 3.550 3.963 -0.413 25155 3491 1 5 . 1 1 22 22 ARG C C 22 177.268 177.268 178.259 -0.991 25155 3492 1 5 . 1 1 22 22 ARG CA C 22 59.760 59.760 59.295 0.465 25155 3493 1 5 . 1 1 22 22 ARG CB C 22 28.900 28.900 29.524 -0.624 25155 3494 1 5 . 1 1 23 23 ASP N N 23 118.945 118.945 120.107 -1.162 25155 3495 1 5 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.437 -0.095 25155 3496 1 5 . 1 1 23 23 ASP C C 23 178.470 178.470 178.691 -0.221 25155 3497 1 5 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.173 0.277 25155 3498 1 5 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.924 -0.554 25155 3499 1 5 . 1 1 24 24 ILE N N 24 121.200 121.200 119.227 1.973 25155 3500 1 5 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.799 -0.065 25155 3501 1 5 . 1 1 24 24 ILE C C 24 178.297 178.297 177.892 0.405 25155 3502 1 5 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.490 0.010 25155 3503 1 5 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.479 0.261 25155 3504 1 5 . 1 1 24 24 ILE H H 24 8.160 8.160 7.962 0.198 25155 3505 1 5 . 1 1 25 25 ILE N N 25 121.166 121.166 117.663 3.503 25155 3506 1 5 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.811 -0.168 25155 3507 1 5 . 1 1 25 25 ILE C C 25 176.825 176.825 176.753 0.072 25155 3508 1 5 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.222 2.668 25155 3509 1 5 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.777 -1.027 25155 3510 1 5 . 1 1 25 25 ILE H H 25 8.480 8.480 7.791 0.689 25155 3511 1 5 . 1 1 26 26 GLY N N 26 109.050 109.050 105.016 4.034 25155 3512 1 5 . 1 1 26 26 GLY C C 26 173.800 173.800 172.587 1.213 25155 3513 1 5 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.492 -0.092 25155 3514 1 5 . 1 1 26 26 GLY H H 26 7.945 7.945 7.810 0.135 25155 3515 1 5 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.429 -0.066 25155 3516 1 5 . 1 1 27 27 PRO C C 27 177.157 177.157 176.742 0.415 25155 3517 1 5 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.897 0.633 25155 3518 1 5 . 1 1 27 27 PRO CB C 27 32.000 32.000 32.033 -0.033 25155 3519 1 5 . 1 1 28 28 GLU N N 28 116.510 116.510 116.764 -0.254 25155 3520 1 5 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.214 0.046 25155 3521 1 5 . 1 1 28 28 GLU C C 28 177.000 177.000 177.021 -0.021 25155 3522 1 5 . 1 1 28 28 GLU CA C 28 57.680 57.680 57.850 -0.170 25155 3523 1 5 . 1 1 28 28 GLU CB C 28 28.620 28.620 29.192 -0.572 25155 3524 1 5 . 1 1 29 29 LEU N N 29 120.334 120.334 112.829 7.505 25155 3525 1 5 . 1 1 29 29 LEU HA H 29 4.650 4.650 4.989 -0.339 25155 3526 1 5 . 1 1 29 29 LEU C C 29 175.676 175.676 174.930 0.746 25155 3527 1 5 . 1 1 29 29 LEU CA C 29 55.924 55.924 54.834 1.089 25155 3528 1 5 . 1 1 29 29 LEU CB C 29 44.880 44.880 44.273 0.607 25155 3529 1 5 . 1 1 29 29 LEU H H 29 7.924 7.924 7.536 0.388 25155 3530 1 5 . 1 1 30 30 VAL N N 30 118.900 118.900 120.213 -1.313 25155 3531 1 5 . 1 1 30 30 VAL HA H 30 4.639 4.639 5.023 -0.384 25155 3532 1 5 . 1 1 30 30 VAL C C 30 174.368 174.368 175.541 -1.173 25155 3533 1 5 . 1 1 30 30 VAL CA C 30 61.110 61.110 60.224 0.886 25155 3534 1 5 . 1 1 30 30 VAL CB C 30 34.500 34.500 35.038 -0.538 25155 3535 1 5 . 1 1 30 30 VAL H H 30 7.486 7.486 7.382 0.104 25155 3536 1 5 . 1 1 31 31 THR N N 31 124.000 124.000 119.475 4.525 25155 3537 1 5 . 1 1 31 31 THR HA H 31 4.331 4.331 4.721 -0.390 25155 3538 1 5 . 1 1 31 31 THR C C 31 172.670 172.670 172.900 -0.230 25155 3539 1 5 . 1 1 31 31 THR CA C 31 61.784 61.784 60.800 0.984 25155 3540 1 5 . 1 1 31 31 THR CB C 31 70.483 70.483 71.305 -0.822 25155 3541 1 5 . 1 1 31 31 THR H H 31 7.947 7.947 8.805 -0.858 25155 3542 1 5 . 1 1 32 32 LEU N N 32 127.408 127.408 125.426 1.982 25155 3543 1 5 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.835 -0.198 25155 3544 1 5 . 1 1 32 32 LEU C C 32 176.425 176.425 176.410 0.015 25155 3545 1 5 . 1 1 32 32 LEU CA C 32 54.760 54.760 54.289 0.470 25155 3546 1 5 . 1 1 32 32 LEU CB C 32 43.809 43.809 43.562 0.247 25155 3547 1 5 . 1 1 32 32 LEU H H 32 8.614 8.614 8.501 0.113 25155 3548 1 5 . 1 1 33 33 HIS N N 33 120.230 120.230 121.994 -1.764 25155 3549 1 5 . 1 1 33 33 HIS HA H 33 4.420 4.420 5.040 -0.620 25155 3550 1 5 . 1 1 33 33 HIS C C 33 171.914 171.914 173.198 -1.284 25155 3551 1 5 . 1 1 33 33 HIS CA C 33 55.300 55.300 55.202 0.098 25155 3552 1 5 . 1 1 33 33 HIS CB C 33 32.050 32.050 33.648 -1.598 25155 3553 1 5 . 1 1 33 33 HIS H H 33 9.130 9.130 9.005 0.125 25155 3554 1 5 . 1 1 34 34 ASN N N 34 123.987 123.987 125.616 -1.629 25155 3555 1 5 . 1 1 34 34 ASN HA H 34 3.600 3.600 5.356 -1.756 25155 3556 1 5 . 1 1 34 34 ASN C C 34 177.930 177.930 175.395 2.535 25155 3557 1 5 . 1 1 34 34 ASN CA C 34 51.730 51.730 52.126 -0.396 25155 3558 1 5 . 1 1 34 34 ASN CB C 34 38.747 38.747 40.255 -1.508 25155 3559 1 5 . 1 1 34 34 ASN H H 34 8.759 8.759 9.138 -0.379 25155 3560 1 5 . 1 1 35 35 LEU N N 35 128.751 128.751 126.349 2.402 25155 3561 1 5 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.490 -0.200 25155 3562 1 5 . 1 1 35 35 LEU C C 35 177.363 177.363 178.104 -0.741 25155 3563 1 5 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.549 0.001 25155 3564 1 5 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.770 0.992 25155 3565 1 5 . 1 1 35 35 LEU H H 35 8.758 8.758 8.903 -0.145 25155 3566 1 5 . 1 1 36 36 LYS N N 36 120.870 120.870 118.830 2.040 25155 3567 1 5 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.121 -0.188 25155 3568 1 5 . 1 1 36 36 LYS C C 36 176.540 176.540 177.198 -0.658 25155 3569 1 5 . 1 1 36 36 LYS CA C 36 59.260 59.260 58.315 0.945 25155 3570 1 5 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.658 0.142 25155 3571 1 5 . 1 1 37 37 ASP N N 37 115.288 115.288 116.456 -1.168 25155 3572 1 5 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.702 0.045 25155 3573 1 5 . 1 1 37 37 ASP C C 37 175.500 175.500 175.665 -0.165 25155 3574 1 5 . 1 1 37 37 ASP CA C 37 54.805 54.805 54.668 0.137 25155 3575 1 5 . 1 1 37 37 ASP CB C 37 44.650 44.650 43.562 1.088 25155 3576 1 5 . 1 1 38 38 ASP N N 38 121.550 121.550 122.051 -0.501 25155 3577 1 5 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.757 0.108 25155 3578 1 5 . 1 1 38 38 ASP C C 38 174.895 174.895 176.145 -1.250 25155 3579 1 5 . 1 1 38 38 ASP CA C 38 52.840 52.840 54.534 -1.694 25155 3580 1 5 . 1 1 38 38 ASP CB C 38 42.240 42.240 41.327 0.913 25155 3581 1 5 . 1 1 39 39 SER N N 39 115.170 115.170 119.505 -4.335 25155 3582 1 5 . 1 1 39 39 SER HA H 39 4.600 4.600 4.627 -0.027 25155 3583 1 5 . 1 1 39 39 SER C C 39 174.930 174.930 174.664 0.266 25155 3584 1 5 . 1 1 39 39 SER CA C 39 54.786 54.786 56.969 -2.183 25155 3585 1 5 . 1 1 39 39 SER CB C 39 64.840 64.840 63.196 1.644 25155 3586 1 5 . 1 1 39 39 SER H H 39 8.330 8.330 8.681 -0.351 25155 3587 1 5 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.428 -0.428 25155 3588 1 5 . 1 1 40 40 PRO C C 40 176.620 176.620 178.130 -1.510 25155 3589 1 5 . 1 1 40 40 PRO CA C 40 63.870 63.870 65.005 -1.135 25155 3590 1 5 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.706 -0.346 25155 3591 1 5 . 1 1 41 41 LYS N N 41 120.913 120.913 119.277 1.636 25155 3592 1 5 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.136 -0.240 25155 3593 1 5 . 1 1 41 41 LYS C C 41 179.580 179.580 178.714 0.866 25155 3594 1 5 . 1 1 41 41 LYS CA C 41 58.000 58.000 58.653 -0.653 25155 3595 1 5 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.352 0.748 25155 3596 1 5 . 1 1 42 42 LEU N N 42 118.206 118.206 120.271 -2.065 25155 3597 1 5 . 1 1 42 42 LEU HA H 42 4.025 4.025 4.040 -0.015 25155 3598 1 5 . 1 1 42 42 LEU C C 42 178.630 178.630 178.302 0.328 25155 3599 1 5 . 1 1 42 42 LEU CA C 42 57.030 57.030 57.206 -0.176 25155 3600 1 5 . 1 1 42 42 LEU CB C 42 41.820 41.820 41.121 0.699 25155 3601 1 5 . 1 1 42 42 LEU H H 42 7.598 7.598 7.733 -0.135 25155 3602 1 5 . 1 1 43 43 MET N N 43 118.913 118.913 117.035 1.878 25155 3603 1 5 . 1 1 43 43 MET HA H 43 3.760 3.760 4.139 -0.379 25155 3604 1 5 . 1 1 43 43 MET C C 43 177.710 177.710 178.029 -0.319 25155 3605 1 5 . 1 1 43 43 MET CA C 43 59.864 59.864 58.512 1.352 25155 3606 1 5 . 1 1 43 43 MET CB C 43 32.680 32.680 31.958 0.722 25155 3607 1 5 . 1 1 43 43 MET H H 43 8.180 8.180 8.152 0.028 25155 3608 1 5 . 1 1 44 44 GLU N N 44 110.906 110.906 118.487 -7.581 25155 3609 1 5 . 1 1 44 44 GLU HA H 44 3.732 3.732 4.013 -0.281 25155 3610 1 5 . 1 1 44 44 GLU C C 44 178.120 178.120 178.791 -0.671 25155 3611 1 5 . 1 1 44 44 GLU CA C 44 59.450 59.450 59.040 0.410 25155 3612 1 5 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.345 0.455 25155 3613 1 5 . 1 1 45 45 GLN N N 45 115.770 115.770 117.627 -1.857 25155 3614 1 5 . 1 1 45 45 GLN HA H 45 4.190 4.190 3.949 0.241 25155 3615 1 5 . 1 1 45 45 GLN C C 45 175.480 175.480 176.548 -1.068 25155 3616 1 5 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.270 -1.170 25155 3617 1 5 . 1 1 45 45 GLN CB C 45 28.490 28.490 28.708 -0.218 25155 3618 1 5 . 1 1 45 45 GLN H H 45 7.517 7.517 7.435 0.082 25155 3619 1 5 . 1 1 46 46 TYR N N 46 117.840 117.840 118.069 -0.229 25155 3620 1 5 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.440 0.220 25155 3621 1 5 . 1 1 46 46 TYR C C 46 175.480 175.480 176.215 -0.735 25155 3622 1 5 . 1 1 46 46 TYR CA C 46 58.827 58.827 57.970 0.857 25155 3623 1 5 . 1 1 46 46 TYR CB C 46 41.720 41.720 38.651 3.069 25155 3624 1 5 . 1 1 46 46 TYR H H 46 6.955 6.955 7.206 -0.251 25155 3625 1 5 . 1 1 47 47 ASP N N 47 121.540 121.540 121.844 -0.304 25155 3626 1 5 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.729 -0.033 25155 3627 1 5 . 1 1 47 47 ASP C C 47 175.677 175.677 175.838 -0.161 25155 3628 1 5 . 1 1 47 47 ASP CA C 47 56.812 56.812 57.106 -0.294 25155 3629 1 5 . 1 1 47 47 ASP CB C 47 42.978 42.978 41.939 1.039 25155 3630 1 5 . 1 1 48 48 VAL N N 48 118.666 118.666 118.093 0.573 25155 3631 1 5 . 1 1 48 48 VAL HA H 48 5.057 5.057 5.027 0.030 25155 3632 1 5 . 1 1 48 48 VAL C C 48 174.180 174.180 174.081 0.099 25155 3633 1 5 . 1 1 48 48 VAL CA C 48 60.000 60.000 60.242 -0.242 25155 3634 1 5 . 1 1 48 48 VAL CB C 48 36.200 36.200 35.167 1.033 25155 3635 1 5 . 1 1 48 48 VAL H H 48 7.631 7.631 8.005 -0.374 25155 3636 1 5 . 1 1 49 49 LEU N N 49 128.300 128.300 128.223 0.077 25155 3637 1 5 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.181 0.419 25155 3638 1 5 . 1 1 49 49 LEU C C 49 174.810 174.810 175.169 -0.359 25155 3639 1 5 . 1 1 49 49 LEU CA C 49 52.230 52.230 53.732 -1.502 25155 3640 1 5 . 1 1 49 49 LEU CB C 49 45.400 45.400 44.913 0.486 25155 3641 1 5 . 1 1 49 49 LEU H H 49 9.469 9.469 8.903 0.566 25155 3642 1 5 . 1 1 50 50 ILE N N 50 124.400 124.400 127.831 -3.431 25155 3643 1 5 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.348 1.302 25155 3644 1 5 . 1 1 50 50 ILE C C 50 175.286 175.286 174.228 1.058 25155 3645 1 5 . 1 1 50 50 ILE CA C 50 59.900 59.900 61.434 -1.534 25155 3646 1 5 . 1 1 50 50 ILE CB C 50 40.200 40.200 39.129 1.071 25155 3647 1 5 . 1 1 50 50 ILE H H 50 9.213 9.213 9.255 -0.042 25155 3648 1 5 . 1 1 51 51 LEU N N 51 127.410 127.410 129.000 -1.590 25155 3649 1 5 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.091 1.979 25155 3650 1 5 . 1 1 51 51 LEU C C 51 174.540 174.540 175.614 -1.074 25155 3651 1 5 . 1 1 51 51 LEU CA C 51 52.950 52.950 53.470 -0.520 25155 3652 1 5 . 1 1 51 51 LEU CB C 51 43.190 43.190 42.405 0.785 25155 3653 1 5 . 1 1 51 51 LEU H H 51 9.256 9.256 8.738 0.518 25155 3654 1 5 . 1 1 52 52 GLY N N 52 108.290 108.290 111.662 -3.372 25155 3655 1 5 . 1 1 52 52 GLY C C 52 174.330 174.330 171.704 2.626 25155 3656 1 5 . 1 1 52 52 GLY CA C 52 44.040 44.040 43.503 0.537 25155 3657 1 5 . 1 1 52 52 GLY H H 52 8.949 8.949 8.380 0.569 25155 3658 1 5 . 1 1 53 53 ILE N N 53 124.912 124.912 123.561 1.351 25155 3659 1 5 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.538 -0.363 25155 3660 1 5 . 1 1 53 53 ILE C C 53 174.470 174.470 172.826 1.644 25155 3661 1 5 . 1 1 53 53 ILE CA C 53 55.850 55.850 58.102 -2.252 25155 3662 1 5 . 1 1 53 53 ILE CB C 53 42.800 42.800 42.127 0.673 25155 3663 1 5 . 1 1 53 53 ILE H H 53 8.612 8.612 7.376 1.236 25155 3664 1 5 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.567 0.245 25155 3665 1 5 . 1 1 54 54 PRO C C 54 174.565 174.565 175.607 -1.042 25155 3666 1 5 . 1 1 54 54 PRO CA C 54 61.850 61.850 62.313 -0.463 25155 3667 1 5 . 1 1 54 54 PRO CB C 54 32.400 32.400 31.966 0.434 25155 3668 1 5 . 1 1 55 55 THR N N 55 116.040 116.040 117.674 -1.634 25155 3669 1 5 . 1 1 55 55 THR HA H 55 4.522 4.522 4.482 0.040 25155 3670 1 5 . 1 1 55 55 THR C C 55 173.990 173.990 173.181 0.809 25155 3671 1 5 . 1 1 55 55 THR CA C 55 62.845 62.845 61.750 1.095 25155 3672 1 5 . 1 1 55 55 THR CB C 55 70.795 70.795 71.370 -0.575 25155 3673 1 5 . 1 1 55 55 THR H H 55 7.663 7.663 7.879 -0.216 25155 3674 1 5 . 1 1 56 56 TRP N N 56 130.540 130.540 125.126 5.414 25155 3675 1 5 . 1 1 56 56 TRP CA C 56 54.800 54.800 57.008 -2.208 25155 3676 1 5 . 1 1 56 56 TRP H H 56 9.075 9.075 8.471 0.604 25155 3677 1 5 . 1 1 58 58 PHE HA H 58 4.540 4.540 4.457 0.083 25155 3678 1 5 . 1 1 58 58 PHE C C 58 177.070 177.070 176.845 0.225 25155 3679 1 5 . 1 1 58 58 PHE CA C 58 55.460 55.460 58.464 -3.004 25155 3680 1 5 . 1 1 58 58 PHE CB C 58 41.200 41.200 39.432 1.768 25155 3681 1 5 . 1 1 59 59 GLY N N 59 109.796 109.796 114.901 -5.105 25155 3682 1 5 . 1 1 59 59 GLY CA C 59 45.763 45.763 44.843 0.920 25155 3683 1 5 . 1 1 59 59 GLY H H 59 8.392 8.392 8.009 0.383 25155 3684 1 5 . 1 1 60 60 GLU C C 60 175.660 175.660 175.682 -0.022 25155 3685 1 5 . 1 1 61 61 ILE N N 61 122.380 122.380 122.543 -0.163 25155 3686 1 5 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.524 0.916 25155 3687 1 5 . 1 1 61 61 ILE CA C 61 62.100 62.100 62.181 -0.081 25155 3688 1 5 . 1 1 61 61 ILE CB C 61 38.750 38.750 37.455 1.295 25155 3689 1 5 . 1 1 61 61 ILE H H 61 8.436 8.436 8.231 0.205 25155 3690 1 5 . 1 1 62 62 GLN CB C 62 30.570 30.570 29.530 1.040 25155 3691 1 5 . 1 1 63 63 GLU HA H 63 4.030 4.030 4.053 -0.023 25155 3692 1 5 . 1 1 63 63 GLU C C 63 177.134 177.134 178.018 -0.884 25155 3693 1 5 . 1 1 63 63 GLU CA C 63 60.520 60.520 60.002 0.518 25155 3694 1 5 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.663 -0.013 25155 3695 1 5 . 1 1 64 64 ASP N N 64 119.630 119.630 117.985 1.645 25155 3696 1 5 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.601 -0.009 25155 3697 1 5 . 1 1 64 64 ASP C C 64 178.680 178.680 177.509 1.171 25155 3698 1 5 . 1 1 64 64 ASP CA C 64 57.823 57.823 56.473 1.350 25155 3699 1 5 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.672 0.428 25155 3700 1 5 . 1 1 65 65 TRP N N 65 120.535 120.535 122.347 -1.812 25155 3701 1 5 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.714 -0.389 25155 3702 1 5 . 1 1 65 65 TRP C C 65 178.684 178.684 177.216 1.468 25155 3703 1 5 . 1 1 65 65 TRP CA C 65 60.500 60.500 60.282 0.218 25155 3704 1 5 . 1 1 65 65 TRP CB C 65 30.100 30.100 31.758 -1.658 25155 3705 1 5 . 1 1 65 65 TRP H H 65 7.416 7.416 7.917 -0.501 25155 3706 1 5 . 1 1 66 66 GLU N N 66 120.760 120.760 120.953 -0.193 25155 3707 1 5 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.281 -0.461 25155 3708 1 5 . 1 1 66 66 GLU C C 66 178.860 178.860 178.933 -0.073 25155 3709 1 5 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.852 0.248 25155 3710 1 5 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.576 -0.566 25155 3711 1 5 . 1 1 67 67 ALA N N 67 118.972 118.972 121.553 -2.581 25155 3712 1 5 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.244 0.003 25155 3713 1 5 . 1 1 67 67 ALA C C 67 179.610 179.610 178.970 0.640 25155 3714 1 5 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.846 -0.246 25155 3715 1 5 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.909 -0.121 25155 3716 1 5 . 1 1 67 67 ALA H H 67 7.690 7.690 8.544 -0.854 25155 3717 1 5 . 1 1 68 68 VAL N N 68 107.530 107.530 110.605 -3.075 25155 3718 1 5 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.270 0.440 25155 3719 1 5 . 1 1 68 68 VAL C C 68 176.800 176.800 177.205 -0.405 25155 3720 1 5 . 1 1 68 68 VAL CA C 68 60.060 60.060 62.281 -2.221 25155 3721 1 5 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.673 -0.073 25155 3722 1 5 . 1 1 68 68 VAL H H 68 7.240 7.240 7.464 -0.224 25155 3723 1 5 . 1 1 69 69 TRP N N 69 126.960 126.960 125.509 1.451 25155 3724 1 5 . 1 1 69 69 TRP HA H 69 4.182 4.182 4.002 0.180 25155 3725 1 5 . 1 1 69 69 TRP C C 69 178.640 178.640 176.801 1.839 25155 3726 1 5 . 1 1 69 69 TRP CA C 69 61.300 61.300 62.553 -1.254 25155 3727 1 5 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.349 2.221 25155 3728 1 5 . 1 1 69 69 TRP H H 69 7.810 7.810 8.412 -0.602 25155 3729 1 5 . 1 1 70 70 ASP N N 70 114.644 114.644 116.619 -1.975 25155 3730 1 5 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.168 0.351 25155 3731 1 5 . 1 1 70 70 ASP C C 70 178.685 178.685 178.188 0.497 25155 3732 1 5 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.482 -0.482 25155 3733 1 5 . 1 1 70 70 ASP CB C 70 39.810 39.810 40.979 -1.169 25155 3734 1 5 . 1 1 71 71 GLN N N 71 120.100 120.100 117.010 3.090 25155 3735 1 5 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.240 -0.050 25155 3736 1 5 . 1 1 71 71 GLN C C 71 178.870 178.870 178.215 0.655 25155 3737 1 5 . 1 1 71 71 GLN CA C 71 57.617 57.617 57.104 0.513 25155 3738 1 5 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.548 -0.728 25155 3739 1 5 . 1 1 71 71 GLN H H 71 7.980 7.980 7.903 0.077 25155 3740 1 5 . 1 1 72 72 LEU N N 72 117.535 117.535 120.735 -3.200 25155 3741 1 5 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.952 -0.155 25155 3742 1 5 . 1 1 72 72 LEU C C 72 178.308 178.308 178.177 0.131 25155 3743 1 5 . 1 1 72 72 LEU CA C 72 57.340 57.340 57.331 0.009 25155 3744 1 5 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.305 0.395 25155 3745 1 5 . 1 1 72 72 LEU H H 72 7.435 7.435 7.711 -0.276 25155 3746 1 5 . 1 1 73 73 ASP N N 73 115.534 115.534 118.866 -3.332 25155 3747 1 5 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.405 -0.255 25155 3748 1 5 . 1 1 73 73 ASP C C 73 177.553 177.553 176.756 0.797 25155 3749 1 5 . 1 1 73 73 ASP CA C 73 57.350 57.350 56.618 0.732 25155 3750 1 5 . 1 1 73 73 ASP CB C 73 40.040 40.040 41.166 -1.126 25155 3751 1 5 . 1 1 74 74 ASP N N 74 117.300 117.300 119.518 -2.218 25155 3752 1 5 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.541 0.165 25155 3753 1 5 . 1 1 74 74 ASP C C 74 176.424 176.424 177.050 -0.626 25155 3754 1 5 . 1 1 74 74 ASP CA C 74 54.170 54.170 54.728 -0.558 25155 3755 1 5 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.350 0.470 25155 3756 1 5 . 1 1 75 75 LEU N N 75 118.500 118.500 120.280 -1.780 25155 3757 1 5 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.186 0.109 25155 3758 1 5 . 1 1 75 75 LEU C C 75 176.800 176.800 176.212 0.588 25155 3759 1 5 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.916 -0.516 25155 3760 1 5 . 1 1 75 75 LEU CB C 75 43.280 43.280 41.973 1.307 25155 3761 1 5 . 1 1 75 75 LEU H H 75 6.966 6.966 7.355 -0.389 25155 3762 1 5 . 1 1 76 76 ASN N N 76 123.040 123.040 121.619 1.421 25155 3763 1 5 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.637 0.225 25155 3764 1 5 . 1 1 76 76 ASN C C 76 174.927 174.927 173.864 1.063 25155 3765 1 5 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.270 -1.389 25155 3766 1 5 . 1 1 76 76 ASN CB C 76 37.510 37.510 37.708 -0.198 25155 3767 1 5 . 1 1 76 76 ASN H H 76 9.882 9.882 8.922 0.960 25155 3768 1 5 . 1 1 77 77 LEU N N 77 123.614 123.614 119.476 4.138 25155 3769 1 5 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.810 -0.440 25155 3770 1 5 . 1 1 77 77 LEU C C 77 175.110 175.110 174.183 0.927 25155 3771 1 5 . 1 1 77 77 LEU CA C 77 52.200 52.200 54.475 -2.276 25155 3772 1 5 . 1 1 77 77 LEU CB C 77 42.786 42.786 44.500 -1.714 25155 3773 1 5 . 1 1 77 77 LEU H H 77 8.700 8.700 7.520 1.180 25155 3774 1 5 . 1 1 78 78 GLU N N 78 120.822 120.822 121.891 -1.069 25155 3775 1 5 . 1 1 78 78 GLU HA H 78 3.900 3.900 5.042 -1.142 25155 3776 1 5 . 1 1 78 78 GLU C C 78 178.670 178.670 177.021 1.649 25155 3777 1 5 . 1 1 78 78 GLU CA C 78 58.700 58.700 54.693 4.007 25155 3778 1 5 . 1 1 78 78 GLU CB C 78 29.467 29.467 33.184 -3.717 25155 3779 1 5 . 1 1 79 79 GLY N N 79 113.160 113.160 111.808 1.352 25155 3780 1 5 . 1 1 79 79 GLY C C 79 174.523 174.523 173.573 0.950 25155 3781 1 5 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.849 -0.429 25155 3782 1 5 . 1 1 79 79 GLY H H 79 8.450 8.450 8.294 0.156 25155 3783 1 5 . 1 1 80 80 LYS N N 80 120.283 120.283 118.948 1.335 25155 3784 1 5 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.341 0.017 25155 3785 1 5 . 1 1 80 80 LYS C C 80 175.304 175.304 175.603 -0.299 25155 3786 1 5 . 1 1 80 80 LYS CA C 80 56.890 56.890 55.848 1.042 25155 3787 1 5 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.513 -0.393 25155 3788 1 5 . 1 1 81 81 ILE N N 81 122.288 122.288 120.544 1.744 25155 3789 1 5 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.230 0.576 25155 3790 1 5 . 1 1 81 81 ILE C C 81 174.750 174.750 175.251 -0.501 25155 3791 1 5 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.561 -1.741 25155 3792 1 5 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.062 0.788 25155 3793 1 5 . 1 1 81 81 ILE H H 81 7.405 7.405 7.791 -0.386 25155 3794 1 5 . 1 1 82 82 VAL N N 82 127.793 127.793 126.994 0.799 25155 3795 1 5 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.153 0.127 25155 3796 1 5 . 1 1 82 82 VAL C C 82 172.680 172.680 174.235 -1.555 25155 3797 1 5 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.492 -0.392 25155 3798 1 5 . 1 1 82 82 VAL CB C 82 35.280 35.280 36.006 -0.726 25155 3799 1 5 . 1 1 82 82 VAL H H 82 8.800 8.800 8.958 -0.158 25155 3800 1 5 . 1 1 83 83 ALA N N 83 130.911 130.911 128.243 2.668 25155 3801 1 5 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.878 -0.489 25155 3802 1 5 . 1 1 83 83 ALA C C 83 175.870 175.870 176.119 -0.249 25155 3803 1 5 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.178 0.822 25155 3804 1 5 . 1 1 83 83 ALA CB C 83 23.722 23.722 22.720 1.002 25155 3805 1 5 . 1 1 83 83 ALA H H 83 9.252 9.252 9.052 0.200 25155 3806 1 5 . 1 1 84 84 LEU N N 84 124.269 124.269 121.250 3.019 25155 3807 1 5 . 1 1 84 84 LEU HA H 84 5.508 5.508 5.258 0.250 25155 3808 1 5 . 1 1 84 84 LEU C C 84 175.490 175.490 175.428 0.062 25155 3809 1 5 . 1 1 84 84 LEU CA C 84 53.670 53.670 54.521 -0.851 25155 3810 1 5 . 1 1 84 84 LEU CB C 84 45.000 45.000 45.937 -0.937 25155 3811 1 5 . 1 1 84 84 LEU H H 84 10.378 10.378 8.795 1.583 25155 3812 1 5 . 1 1 85 85 TYR N N 85 115.826 115.826 119.149 -3.323 25155 3813 1 5 . 1 1 85 85 TYR HA H 85 4.950 4.950 5.120 -0.170 25155 3814 1 5 . 1 1 85 85 TYR C C 85 172.661 172.661 173.056 -0.395 25155 3815 1 5 . 1 1 85 85 TYR CA C 85 55.853 55.853 55.996 -0.143 25155 3816 1 5 . 1 1 85 85 TYR CB C 85 43.200 43.200 40.239 2.961 25155 3817 1 5 . 1 1 85 85 TYR H H 85 9.200 9.200 8.115 1.085 25155 3818 1 5 . 1 1 86 86 GLY N N 86 106.802 106.802 105.017 1.785 25155 3819 1 5 . 1 1 86 86 GLY C C 86 170.348 170.348 171.180 -0.832 25155 3820 1 5 . 1 1 86 86 GLY CA C 86 44.687 44.687 44.798 -0.111 25155 3821 1 5 . 1 1 86 86 GLY H H 86 8.752 8.752 7.804 0.948 25155 3822 1 5 . 1 1 87 87 LEU N N 87 120.860 120.860 115.776 5.084 25155 3823 1 5 . 1 1 87 87 LEU HA H 87 5.476 5.476 5.070 0.406 25155 3824 1 5 . 1 1 87 87 LEU C C 87 177.720 177.720 175.587 2.133 25155 3825 1 5 . 1 1 87 87 LEU CA C 87 52.630 52.630 52.586 0.044 25155 3826 1 5 . 1 1 87 87 LEU CB C 87 45.900 45.900 44.055 1.845 25155 3827 1 5 . 1 1 87 87 LEU H H 87 6.320 6.320 8.013 -1.693 25155 3828 1 5 . 1 1 88 88 GLY N N 88 109.910 109.910 106.656 3.254 25155 3829 1 5 . 1 1 88 88 GLY C C 88 171.386 171.386 171.913 -0.527 25155 3830 1 5 . 1 1 88 88 GLY CA C 88 45.710 45.710 44.354 1.356 25155 3831 1 5 . 1 1 88 88 GLY H H 88 8.320 8.320 7.909 0.411 25155 3832 1 5 . 1 1 89 89 ASP N N 89 121.580 121.580 118.928 2.652 25155 3833 1 5 . 1 1 89 89 ASP HA H 89 5.190 5.190 5.341 -0.151 25155 3834 1 5 . 1 1 89 89 ASP C C 89 176.608 176.608 177.517 -0.909 25155 3835 1 5 . 1 1 89 89 ASP CA C 89 52.200 52.200 53.071 -0.871 25155 3836 1 5 . 1 1 89 89 ASP CB C 89 41.900 41.900 43.569 -1.669 25155 3837 1 5 . 1 1 90 90 GLN N N 90 123.900 123.900 125.728 -1.828 25155 3838 1 5 . 1 1 90 90 GLN HA H 90 3.645 3.645 4.351 -0.706 25155 3839 1 5 . 1 1 90 90 GLN C C 90 173.523 173.523 176.481 -2.958 25155 3840 1 5 . 1 1 90 90 GLN CA C 90 58.706 58.706 57.982 0.724 25155 3841 1 5 . 1 1 90 90 GLN CB C 90 28.800 28.800 29.078 -0.278 25155 3842 1 5 . 1 1 90 90 GLN H H 90 8.726 8.726 9.329 -0.603 25155 3843 1 5 . 1 1 91 91 LEU N N 91 117.080 117.080 119.117 -2.037 25155 3844 1 5 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.078 0.392 25155 3845 1 5 . 1 1 91 91 LEU C C 91 179.840 179.840 178.946 0.894 25155 3846 1 5 . 1 1 91 91 LEU CA C 91 55.800 55.800 55.658 0.142 25155 3847 1 5 . 1 1 91 91 LEU CB C 91 41.640 41.640 41.484 0.156 25155 3848 1 5 . 1 1 91 91 LEU H H 91 7.092 7.092 8.831 -1.739 25155 3849 1 5 . 1 1 92 92 GLY N N 92 110.460 110.460 105.736 4.724 25155 3850 1 5 . 1 1 92 92 GLY C C 92 174.824 174.824 173.679 1.145 25155 3851 1 5 . 1 1 92 92 GLY CA C 92 46.390 46.390 44.602 1.788 25155 3852 1 5 . 1 1 92 92 GLY H H 92 9.243 9.243 7.843 1.399 25155 3853 1 5 . 1 1 93 93 TYR N N 93 118.140 118.140 116.867 1.273 25155 3854 1 5 . 1 1 93 93 TYR HA H 93 5.173 5.173 3.814 1.359 25155 3855 1 5 . 1 1 93 93 TYR C C 93 177.805 177.805 176.929 0.876 25155 3856 1 5 . 1 1 93 93 TYR CA C 93 57.430 57.430 58.940 -1.510 25155 3857 1 5 . 1 1 93 93 TYR CB C 93 39.300 39.300 35.237 4.063 25155 3858 1 5 . 1 1 93 93 TYR H H 93 7.252 7.252 7.242 0.011 25155 3859 1 5 . 1 1 94 94 GLY N N 94 112.455 112.455 104.252 8.203 25155 3860 1 5 . 1 1 94 94 GLY C C 94 177.740 177.740 175.014 2.726 25155 3861 1 5 . 1 1 94 94 GLY CA C 94 49.880 49.880 45.161 4.719 25155 3862 1 5 . 1 1 94 94 GLY H H 94 8.154 8.154 8.226 -0.072 25155 3863 1 5 . 1 1 95 95 GLU N N 95 123.040 123.040 120.421 2.619 25155 3864 1 5 . 1 1 95 95 GLU HA H 95 4.000 4.000 4.146 -0.146 25155 3865 1 5 . 1 1 95 95 GLU C C 95 175.145 175.145 177.862 -2.717 25155 3866 1 5 . 1 1 95 95 GLU CA C 95 57.950 57.950 58.548 -0.598 25155 3867 1 5 . 1 1 95 95 GLU CB C 95 27.400 27.400 29.813 -2.413 25155 3868 1 5 . 1 1 96 96 TRP N N 96 118.000 118.000 117.745 0.255 25155 3869 1 5 . 1 1 96 96 TRP HA H 96 5.213 5.213 4.786 0.427 25155 3870 1 5 . 1 1 96 96 TRP C C 96 176.616 176.616 175.885 0.731 25155 3871 1 5 . 1 1 96 96 TRP CA C 96 57.120 57.120 56.470 0.650 25155 3872 1 5 . 1 1 96 96 TRP CB C 96 29.970 29.970 29.641 0.329 25155 3873 1 5 . 1 1 96 96 TRP H H 96 7.785 7.785 7.306 0.479 25155 3874 1 5 . 1 1 97 97 PHE N N 97 123.268 123.268 116.014 7.254 25155 3875 1 5 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.781 -0.121 25155 3876 1 5 . 1 1 97 97 PHE CA C 97 58.742 58.742 54.768 3.974 25155 3877 1 5 . 1 1 97 97 PHE CB C 97 40.835 40.835 39.667 1.167 25155 3878 1 5 . 1 1 97 97 PHE H H 97 7.054 7.054 7.459 -0.405 25155 3879 1 5 . 1 1 98 98 LEU HA H 98 3.440 3.440 3.677 -0.237 25155 3880 1 5 . 1 1 98 98 LEU C C 98 176.613 176.613 178.049 -1.436 25155 3881 1 5 . 1 1 98 98 LEU CA C 98 56.000 56.000 55.562 0.438 25155 3882 1 5 . 1 1 98 98 LEU CB C 98 38.600 38.600 39.886 -1.286 25155 3883 1 5 . 1 1 98 98 LEU H H 98 8.584 8.584 8.627 -0.043 25155 3884 1 5 . 1 1 99 99 ASP N N 99 123.268 123.268 119.990 3.278 25155 3885 1 5 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.327 -0.362 25155 3886 1 5 . 1 1 99 99 ASP C C 99 178.876 178.876 176.755 2.121 25155 3887 1 5 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.211 2.049 25155 3888 1 5 . 1 1 99 99 ASP CB C 99 40.350 40.350 40.988 -0.638 25155 3889 1 5 . 1 1 100 100 ALA N N 100 119.124 119.124 121.377 -2.253 25155 3890 1 5 . 1 1 100 100 ALA HA H 100 3.822 3.822 4.057 -0.235 25155 3891 1 5 . 1 1 100 100 ALA C C 100 178.490 178.490 179.481 -0.991 25155 3892 1 5 . 1 1 100 100 ALA CA C 100 55.100 55.100 54.605 0.495 25155 3893 1 5 . 1 1 100 100 ALA CB C 100 19.700 19.700 18.204 1.496 25155 3894 1 5 . 1 1 100 100 ALA H H 100 8.400 8.400 7.640 0.760 25155 3895 1 5 . 1 1 101 101 LEU N N 101 118.687 118.687 120.086 -1.399 25155 3896 1 5 . 1 1 101 101 LEU HA H 101 3.674 3.674 4.016 -0.342 25155 3897 1 5 . 1 1 101 101 LEU C C 101 179.050 179.050 179.157 -0.107 25155 3898 1 5 . 1 1 101 101 LEU CA C 101 57.800 57.800 58.059 -0.259 25155 3899 1 5 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.402 1.248 25155 3900 1 5 . 1 1 101 101 LEU H H 101 6.518 6.518 7.966 -1.448 25155 3901 1 5 . 1 1 102 102 GLY N N 102 104.410 104.410 106.955 -2.545 25155 3902 1 5 . 1 1 102 102 GLY C C 102 176.056 176.056 176.157 -0.101 25155 3903 1 5 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.250 0.500 25155 3904 1 5 . 1 1 102 102 GLY H H 102 7.712 7.712 7.639 0.073 25155 3905 1 5 . 1 1 103 103 MET N N 103 120.550 120.550 121.770 -1.220 25155 3906 1 5 . 1 1 103 103 MET HA H 103 4.256 4.256 4.397 -0.141 25155 3907 1 5 . 1 1 103 103 MET C C 103 179.650 179.650 178.587 1.063 25155 3908 1 5 . 1 1 103 103 MET CA C 103 59.450 59.450 59.648 -0.198 25155 3909 1 5 . 1 1 103 103 MET CB C 103 32.300 32.300 32.815 -0.515 25155 3910 1 5 . 1 1 103 103 MET H H 103 8.485 8.485 7.960 0.525 25155 3911 1 5 . 1 1 104 104 LEU N N 104 123.480 123.480 120.395 3.085 25155 3912 1 5 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.402 -0.341 25155 3913 1 5 . 1 1 104 104 LEU C C 104 177.750 177.750 178.825 -1.075 25155 3914 1 5 . 1 1 104 104 LEU CA C 104 58.100 58.100 57.818 0.282 25155 3915 1 5 . 1 1 104 104 LEU CB C 104 41.450 41.450 41.072 0.378 25155 3916 1 5 . 1 1 104 104 LEU H H 104 8.392 8.392 8.030 0.362 25155 3917 1 5 . 1 1 105 105 HIS N N 105 119.570 119.570 120.289 -0.719 25155 3918 1 5 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.110 -0.258 25155 3919 1 5 . 1 1 105 105 HIS C C 105 177.550 177.550 177.083 0.467 25155 3920 1 5 . 1 1 105 105 HIS CA C 105 61.000 61.000 60.919 0.081 25155 3921 1 5 . 1 1 105 105 HIS CB C 105 28.820 28.820 30.186 -1.366 25155 3922 1 5 . 1 1 105 105 HIS H H 105 8.247 8.247 8.778 -0.531 25155 3923 1 5 . 1 1 106 106 ASP N N 106 119.780 119.780 119.426 0.354 25155 3924 1 5 . 1 1 106 106 ASP HA H 106 4.333 4.333 4.346 -0.013 25155 3925 1 5 . 1 1 106 106 ASP C C 106 179.410 179.410 178.333 1.077 25155 3926 1 5 . 1 1 106 106 ASP CA C 106 57.800 57.800 57.286 0.514 25155 3927 1 5 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.152 -0.552 25155 3928 1 5 . 1 1 107 107 LYS N N 107 121.660 121.660 118.716 2.944 25155 3929 1 5 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.074 0.026 25155 3930 1 5 . 1 1 107 107 LYS C C 107 178.316 178.316 178.640 -0.324 25155 3931 1 5 . 1 1 107 107 LYS CA C 107 58.750 58.750 59.032 -0.282 25155 3932 1 5 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.579 -0.729 25155 3933 1 5 . 1 1 108 108 LEU N N 108 116.050 116.050 118.266 -2.216 25155 3934 1 5 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.398 -0.388 25155 3935 1 5 . 1 1 108 108 LEU C C 108 179.050 179.050 178.214 0.836 25155 3936 1 5 . 1 1 108 108 LEU CA C 108 56.240 56.240 55.752 0.488 25155 3937 1 5 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.324 -0.524 25155 3938 1 5 . 1 1 108 108 LEU H H 108 8.072 8.072 7.656 0.416 25155 3939 1 5 . 1 1 109 109 SER N N 109 116.280 116.280 115.829 0.451 25155 3940 1 5 . 1 1 109 109 SER HA H 109 4.300 4.300 4.326 -0.026 25155 3941 1 5 . 1 1 109 109 SER C C 109 175.848 175.848 176.537 -0.689 25155 3942 1 5 . 1 1 109 109 SER CA C 109 62.410 62.410 61.636 0.774 25155 3943 1 5 . 1 1 109 109 SER CB C 109 62.850 62.850 63.253 -0.403 25155 3944 1 5 . 1 1 109 109 SER H H 109 8.366 8.366 8.073 0.293 25155 3945 1 5 . 1 1 110 110 THR N N 110 110.416 110.416 112.477 -2.061 25155 3946 1 5 . 1 1 110 110 THR HA H 110 4.614 4.614 4.314 0.300 25155 3947 1 5 . 1 1 110 110 THR C C 110 175.675 175.675 175.163 0.512 25155 3948 1 5 . 1 1 110 110 THR CA C 110 62.030 62.030 64.207 -2.177 25155 3949 1 5 . 1 1 110 110 THR CB C 110 68.810 68.810 68.715 0.095 25155 3950 1 5 . 1 1 110 110 THR H H 110 7.185 7.185 8.042 -0.857 25155 3951 1 5 . 1 1 111 111 LYS N N 111 120.090 120.090 120.420 -0.330 25155 3952 1 5 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.412 0.101 25155 3953 1 5 . 1 1 111 111 LYS C C 111 176.814 176.814 176.735 0.079 25155 3954 1 5 . 1 1 111 111 LYS CA C 111 55.730 55.730 55.624 0.106 25155 3955 1 5 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.276 -1.347 25155 3956 1 5 . 1 1 112 112 GLY N N 112 107.540 107.540 107.563 -0.023 25155 3957 1 5 . 1 1 112 112 GLY C C 112 176.223 176.223 173.946 2.277 25155 3958 1 5 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.438 1.488 25155 3959 1 5 . 1 1 112 112 GLY H H 112 8.315 8.315 7.639 0.676 25155 3960 1 5 . 1 1 113 113 VAL N N 113 113.536 113.536 114.227 -0.691 25155 3961 1 5 . 1 1 113 113 VAL HA H 113 4.494 4.494 4.127 0.367 25155 3962 1 5 . 1 1 113 113 VAL C C 113 174.560 174.560 174.649 -0.089 25155 3963 1 5 . 1 1 113 113 VAL CA C 113 59.550 59.550 61.081 -1.531 25155 3964 1 5 . 1 1 113 113 VAL CB C 113 32.800 32.800 32.193 0.607 25155 3965 1 5 . 1 1 113 113 VAL H H 113 6.835 6.835 6.879 -0.044 25155 3966 1 5 . 1 1 114 114 LYS N N 114 122.920 122.920 121.517 1.403 25155 3967 1 5 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.321 0.173 25155 3968 1 5 . 1 1 114 114 LYS C C 114 174.925 174.925 174.684 0.241 25155 3969 1 5 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.507 -0.227 25155 3970 1 5 . 1 1 114 114 LYS CB C 114 33.630 33.630 33.642 -0.013 25155 3971 1 5 . 1 1 115 115 PHE N N 115 123.140 123.140 123.622 -0.482 25155 3972 1 5 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.322 0.378 25155 3973 1 5 . 1 1 115 115 PHE C C 115 177.580 177.580 176.332 1.248 25155 3974 1 5 . 1 1 115 115 PHE CA C 115 58.677 58.677 56.580 2.097 25155 3975 1 5 . 1 1 115 115 PHE CB C 115 41.120 41.120 40.032 1.088 25155 3976 1 5 . 1 1 115 115 PHE H H 115 8.506 8.506 8.441 0.065 25155 3977 1 5 . 1 1 116 116 VAL N N 116 115.737 115.737 117.916 -2.179 25155 3978 1 5 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.372 0.106 25155 3979 1 5 . 1 1 116 116 VAL C C 116 175.300 175.300 176.199 -0.899 25155 3980 1 5 . 1 1 116 116 VAL CA C 116 58.877 58.877 59.963 -1.086 25155 3981 1 5 . 1 1 116 116 VAL CB C 116 34.120 34.120 33.621 0.499 25155 3982 1 5 . 1 1 116 116 VAL H H 116 8.860 8.860 8.962 -0.102 25155 3983 1 5 . 1 1 117 117 GLY N N 117 108.137 108.137 110.081 -1.944 25155 3984 1 5 . 1 1 117 117 GLY C C 117 176.110 176.110 175.102 1.008 25155 3985 1 5 . 1 1 117 117 GLY CA C 117 47.500 47.500 45.580 1.920 25155 3986 1 5 . 1 1 117 117 GLY H H 117 9.838 9.838 9.473 0.365 25155 3987 1 5 . 1 1 118 118 TYR N N 118 120.380 120.380 120.202 0.178 25155 3988 1 5 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.727 0.243 25155 3989 1 5 . 1 1 118 118 TYR C C 118 177.630 177.630 175.821 1.809 25155 3990 1 5 . 1 1 118 118 TYR CA C 118 55.800 55.800 57.912 -2.112 25155 3991 1 5 . 1 1 118 118 TYR CB C 118 35.970 35.970 38.838 -2.868 25155 3992 1 5 . 1 1 118 118 TYR H H 118 8.652 8.652 8.059 0.593 25155 3993 1 5 . 1 1 119 119 TRP N N 119 126.040 126.040 123.182 2.858 25155 3994 1 5 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.124 0.897 25155 3995 1 5 . 1 1 119 119 TRP C C 119 173.000 173.000 173.703 -0.703 25155 3996 1 5 . 1 1 119 119 TRP CA C 119 53.820 53.820 53.820 -0.000 25155 3997 1 5 . 1 1 119 119 TRP CB C 119 36.050 36.050 33.454 2.596 25155 3998 1 5 . 1 1 119 119 TRP H H 119 8.070 8.070 8.444 -0.374 25155 3999 1 5 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.413 0.371 25155 4000 1 5 . 1 1 120 120 PRO C C 120 176.870 176.870 176.219 0.651 25155 4001 1 5 . 1 1 120 120 PRO CA C 120 63.780 63.780 63.017 0.763 25155 4002 1 5 . 1 1 120 120 PRO CB C 120 31.990 31.990 31.920 0.070 25155 4003 1 5 . 1 1 121 121 THR N N 121 109.310 109.310 112.761 -3.451 25155 4004 1 5 . 1 1 121 121 THR HA H 121 4.073 4.073 3.898 0.175 25155 4005 1 5 . 1 1 121 121 THR C C 121 176.324 176.324 175.551 0.773 25155 4006 1 5 . 1 1 121 121 THR CA C 121 61.250 61.250 63.333 -2.083 25155 4007 1 5 . 1 1 121 121 THR CB C 121 69.730 69.730 68.738 0.992 25155 4008 1 5 . 1 1 121 121 THR H H 121 7.370 7.370 8.412 -1.042 25155 4009 1 5 . 1 1 122 122 GLU N N 122 123.937 123.937 121.762 2.175 25155 4010 1 5 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.046 0.178 25155 4011 1 5 . 1 1 122 122 GLU C C 122 177.737 177.737 177.796 -0.059 25155 4012 1 5 . 1 1 122 122 GLU CA C 122 58.200 58.200 57.702 0.498 25155 4013 1 5 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.442 0.358 25155 4014 1 5 . 1 1 123 123 GLY N N 123 114.563 114.563 111.773 2.790 25155 4015 1 5 . 1 1 123 123 GLY C C 123 173.783 173.783 173.604 0.179 25155 4016 1 5 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.445 -0.065 25155 4017 1 5 . 1 1 123 123 GLY H H 123 9.144 9.144 8.955 0.189 25155 4018 1 5 . 1 1 124 124 TYR N N 124 118.800 118.800 120.299 -1.499 25155 4019 1 5 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.803 0.415 25155 4020 1 5 . 1 1 124 124 TYR C C 124 175.673 175.673 174.909 0.764 25155 4021 1 5 . 1 1 124 124 TYR CA C 124 56.950 56.950 57.225 -0.275 25155 4022 1 5 . 1 1 124 124 TYR CB C 124 41.100 41.100 40.343 0.757 25155 4023 1 5 . 1 1 124 124 TYR H H 124 7.895 7.895 7.930 -0.035 25155 4024 1 5 . 1 1 125 125 GLU N N 125 124.790 124.790 124.613 0.177 25155 4025 1 5 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.472 0.213 25155 4026 1 5 . 1 1 125 125 GLU C C 125 172.877 172.877 175.484 -2.607 25155 4027 1 5 . 1 1 125 125 GLU CA C 125 55.700 55.700 55.587 0.113 25155 4028 1 5 . 1 1 125 125 GLU CB C 125 31.340 31.340 29.304 2.036 25155 4029 1 5 . 1 1 126 126 PHE N N 126 118.670 118.670 120.051 -1.381 25155 4030 1 5 . 1 1 126 126 PHE HA H 126 4.841 4.841 4.768 0.073 25155 4031 1 5 . 1 1 126 126 PHE C C 126 173.800 173.800 173.665 0.135 25155 4032 1 5 . 1 1 126 126 PHE CA C 126 56.950 56.950 57.151 -0.201 25155 4033 1 5 . 1 1 126 126 PHE CB C 126 40.300 40.300 40.946 -0.646 25155 4034 1 5 . 1 1 126 126 PHE H H 126 7.645 7.645 7.861 -0.216 25155 4035 1 5 . 1 1 127 127 THR N N 127 107.038 107.038 114.007 -6.969 25155 4036 1 5 . 1 1 127 127 THR HA H 127 4.370 4.370 4.220 0.150 25155 4037 1 5 . 1 1 127 127 THR C C 127 175.100 175.100 172.760 2.340 25155 4038 1 5 . 1 1 127 127 THR CA C 127 61.080 61.080 60.642 0.438 25155 4039 1 5 . 1 1 127 127 THR CB C 127 70.500 70.500 69.939 0.561 25155 4040 1 5 . 1 1 127 127 THR H H 127 7.306 7.306 8.103 -0.797 25155 4041 1 5 . 1 1 128 128 SER N N 128 118.150 118.150 116.023 2.127 25155 4042 1 5 . 1 1 128 128 SER HA H 128 4.650 4.650 4.363 0.287 25155 4043 1 5 . 1 1 128 128 SER C C 128 175.760 175.760 173.129 2.631 25155 4044 1 5 . 1 1 128 128 SER CA C 128 55.813 55.813 58.366 -2.553 25155 4045 1 5 . 1 1 128 128 SER CB C 128 65.300 65.300 63.399 1.901 25155 4046 1 5 . 1 1 128 128 SER H H 128 7.354 7.354 8.304 -0.950 25155 4047 1 5 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.455 0.308 25155 4048 1 5 . 1 1 129 129 PRO C C 129 178.860 178.860 178.238 0.622 25155 4049 1 5 . 1 1 129 129 PRO CA C 129 62.728 62.728 64.194 -1.466 25155 4050 1 5 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.468 -0.068 25155 4051 1 5 . 1 1 130 130 LYS N N 130 122.158 122.158 119.922 2.236 25155 4052 1 5 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.185 0.025 25155 4053 1 5 . 1 1 130 130 LYS C C 130 176.890 176.890 175.717 1.173 25155 4054 1 5 . 1 1 130 130 LYS CA C 130 61.375 61.375 60.082 1.293 25155 4055 1 5 . 1 1 130 130 LYS CB C 130 30.350 30.350 31.015 -0.665 25155 4056 1 5 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.481 0.052 25155 4057 1 5 . 1 1 131 131 PRO C C 131 173.810 173.810 175.596 -1.786 25155 4058 1 5 . 1 1 131 131 PRO CA C 131 64.510 64.510 63.446 1.064 25155 4059 1 5 . 1 1 131 131 PRO CB C 131 31.745 31.745 31.824 -0.079 25155 4060 1 5 . 1 1 132 132 VAL N N 132 114.480 114.480 114.361 0.119 25155 4061 1 5 . 1 1 132 132 VAL HA H 132 5.158 5.158 4.841 0.317 25155 4062 1 5 . 1 1 132 132 VAL C C 132 175.137 175.137 174.893 0.244 25155 4063 1 5 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.454 0.346 25155 4064 1 5 . 1 1 132 132 VAL CB C 132 34.780 34.780 34.986 -0.206 25155 4065 1 5 . 1 1 132 132 VAL H H 132 6.716 6.716 7.543 -0.827 25155 4066 1 5 . 1 1 133 133 ILE N N 133 120.670 120.670 118.160 2.510 25155 4067 1 5 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.323 0.069 25155 4068 1 5 . 1 1 133 133 ILE C C 133 175.485 175.485 176.100 -0.615 25155 4069 1 5 . 1 1 133 133 ILE CA C 133 60.000 60.000 60.472 -0.472 25155 4070 1 5 . 1 1 133 133 ILE CB C 133 42.020 42.020 38.586 3.434 25155 4071 1 5 . 1 1 133 133 ILE H H 133 8.740 8.740 8.407 0.333 25155 4072 1 5 . 1 1 134 134 ALA N N 134 122.454 122.454 123.560 -1.106 25155 4073 1 5 . 1 1 134 134 ALA HA H 134 3.953 3.953 3.989 -0.036 25155 4074 1 5 . 1 1 134 134 ALA C C 134 178.387 178.387 177.641 0.746 25155 4075 1 5 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.515 -0.465 25155 4076 1 5 . 1 1 134 134 ALA CB C 134 16.982 16.982 18.022 -1.040 25155 4077 1 5 . 1 1 134 134 ALA H H 134 8.490 8.490 8.560 -0.070 25155 4078 1 5 . 1 1 135 135 ASP N N 135 117.310 117.310 123.075 -5.765 25155 4079 1 5 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.556 -0.312 25155 4080 1 5 . 1 1 135 135 ASP C C 135 176.390 176.390 176.488 -0.098 25155 4081 1 5 . 1 1 135 135 ASP CA C 135 55.120 55.120 52.991 2.129 25155 4082 1 5 . 1 1 135 135 ASP CB C 135 39.865 39.865 39.087 0.777 25155 4083 1 5 . 1 1 136 136 GLY N N 136 104.336 104.336 110.951 -6.615 25155 4084 1 5 . 1 1 136 136 GLY C C 136 174.940 174.940 175.779 -0.839 25155 4085 1 5 . 1 1 136 136 GLY CA C 136 45.150 45.150 46.041 -0.891 25155 4086 1 5 . 1 1 136 136 GLY H H 136 7.592 7.592 8.034 -0.442 25155 4087 1 5 . 1 1 137 137 GLN N N 137 118.675 118.675 117.452 1.223 25155 4088 1 5 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.190 -0.128 25155 4089 1 5 . 1 1 137 137 GLN C C 137 176.420 176.420 175.548 0.872 25155 4090 1 5 . 1 1 137 137 GLN CA C 137 57.760 57.760 57.136 0.624 25155 4091 1 5 . 1 1 137 137 GLN CB C 137 30.400 30.400 29.633 0.767 25155 4092 1 5 . 1 1 137 137 GLN H H 137 7.843 7.843 7.936 -0.093 25155 4093 1 5 . 1 1 138 138 LEU N N 138 118.160 118.160 117.265 0.895 25155 4094 1 5 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.331 0.630 25155 4095 1 5 . 1 1 138 138 LEU C C 138 175.700 175.700 173.993 1.707 25155 4096 1 5 . 1 1 138 138 LEU CA C 138 53.705 53.705 54.622 -0.917 25155 4097 1 5 . 1 1 138 138 LEU CB C 138 46.480 46.480 45.718 0.762 25155 4098 1 5 . 1 1 138 138 LEU H H 138 7.356 7.356 7.127 0.229 25155 4099 1 5 . 1 1 139 139 PHE N N 139 119.060 119.060 121.774 -2.714 25155 4100 1 5 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.820 0.524 25155 4101 1 5 . 1 1 139 139 PHE C C 139 178.850 178.850 177.587 1.263 25155 4102 1 5 . 1 1 139 139 PHE CA C 139 56.670 56.670 57.729 -1.059 25155 4103 1 5 . 1 1 139 139 PHE CB C 139 43.652 43.652 39.612 4.040 25155 4104 1 5 . 1 1 139 139 PHE H H 139 10.026 10.026 9.042 0.984 25155 4105 1 5 . 1 1 140 140 VAL N N 140 109.905 109.905 117.738 -7.833 25155 4106 1 5 . 1 1 140 140 VAL HA H 140 3.500 3.500 2.952 0.548 25155 4107 1 5 . 1 1 140 140 VAL C C 140 172.860 172.860 175.037 -2.177 25155 4108 1 5 . 1 1 140 140 VAL CA C 140 61.812 61.812 62.551 -0.739 25155 4109 1 5 . 1 1 140 140 VAL CB C 140 30.250 30.250 30.475 -0.225 25155 4110 1 5 . 1 1 140 140 VAL H H 140 7.550 7.550 8.487 -0.937 25155 4111 1 5 . 1 1 141 141 GLY N N 141 106.600 106.600 106.362 0.238 25155 4112 1 5 . 1 1 141 141 GLY C C 141 171.350 171.350 172.673 -1.323 25155 4113 1 5 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.191 1.269 25155 4114 1 5 . 1 1 141 141 GLY H H 141 7.052 7.052 7.320 -0.268 25155 4115 1 5 . 1 1 142 142 LEU N N 142 117.820 117.820 119.729 -1.909 25155 4116 1 5 . 1 1 142 142 LEU HA H 142 4.962 4.962 3.768 1.194 25155 4117 1 5 . 1 1 142 142 LEU CA C 142 55.600 55.600 54.467 1.133 25155 4118 1 5 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.339 -4.409 25155 4119 1 5 . 1 1 142 142 LEU H H 142 7.643 7.643 8.099 -0.456 25155 4120 1 5 . 1 1 143 143 ALA HA H 143 4.220 4.220 4.057 0.163 25155 4121 1 5 . 1 1 143 143 ALA C C 143 175.505 175.505 175.727 -0.222 25155 4122 1 5 . 1 1 143 143 ALA CA C 143 49.600 49.600 50.002 -0.402 25155 4123 1 5 . 1 1 143 143 ALA CB C 143 23.330 23.330 18.440 4.890 25155 4124 1 5 . 1 1 144 144 LEU N N 144 124.960 124.960 124.248 0.712 25155 4125 1 5 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.437 0.343 25155 4126 1 5 . 1 1 144 144 LEU C C 144 174.700 174.700 175.021 -0.321 25155 4127 1 5 . 1 1 144 144 LEU CA C 144 52.790 52.790 53.219 -0.429 25155 4128 1 5 . 1 1 144 144 LEU CB C 144 45.300 45.300 43.889 1.411 25155 4129 1 5 . 1 1 144 144 LEU H H 144 8.583 8.583 8.271 0.312 25155 4130 1 5 . 1 1 145 145 ASP N N 145 119.100 119.100 119.570 -0.470 25155 4131 1 5 . 1 1 145 145 ASP HA H 145 5.422 5.422 5.176 0.246 25155 4132 1 5 . 1 1 145 145 ASP C C 145 176.180 176.180 175.162 1.018 25155 4133 1 5 . 1 1 145 145 ASP CA C 145 53.600 53.600 53.344 0.256 25155 4134 1 5 . 1 1 145 145 ASP CB C 145 43.180 43.180 44.016 -0.836 25155 4135 1 5 . 1 1 147 147 THR HA H 147 4.093 4.093 4.349 -0.256 25155 4136 1 5 . 1 1 147 147 THR C C 147 175.858 175.858 175.710 0.148 25155 4137 1 5 . 1 1 147 147 THR CA C 147 66.400 66.400 65.253 1.147 25155 4138 1 5 . 1 1 147 147 THR CB C 147 69.400 69.400 69.769 -0.369 25155 4139 1 5 . 1 1 147 147 THR H H 147 8.745 8.745 8.934 -0.189 25155 4140 1 5 . 1 1 148 148 ASN N N 148 115.408 115.408 118.174 -2.766 25155 4141 1 5 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.989 0.021 25155 4142 1 5 . 1 1 148 148 ASN C C 148 175.750 175.750 175.217 0.533 25155 4143 1 5 . 1 1 148 148 ASN CA C 148 53.400 53.400 54.257 -0.857 25155 4144 1 5 . 1 1 148 148 ASN CB C 148 41.900 41.900 40.620 1.280 25155 4145 1 5 . 1 1 148 148 ASN H H 148 8.975 8.975 8.912 0.063 25155 4146 1 5 . 1 1 149 149 GLN N N 149 117.900 117.900 118.957 -1.057 25155 4147 1 5 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.572 0.364 25155 4148 1 5 . 1 1 149 149 GLN C C 149 178.280 178.280 174.909 3.371 25155 4149 1 5 . 1 1 149 149 GLN CA C 149 53.730 53.730 55.886 -2.156 25155 4150 1 5 . 1 1 149 149 GLN CB C 149 29.790 29.790 31.003 -1.212 25155 4151 1 5 . 1 1 149 149 GLN H H 149 7.430 7.430 7.990 -0.560 25155 4152 1 5 . 1 1 150 150 TYR N N 150 121.060 121.060 121.872 -0.812 25155 4153 1 5 . 1 1 150 150 TYR HA H 150 4.671 4.671 4.496 0.175 25155 4154 1 5 . 1 1 150 150 TYR C C 150 178.680 178.680 175.924 2.756 25155 4155 1 5 . 1 1 150 150 TYR CA C 150 57.930 57.930 60.189 -2.259 25155 4156 1 5 . 1 1 150 150 TYR CB C 150 38.860 38.860 40.229 -1.369 25155 4157 1 5 . 1 1 150 150 TYR H H 150 8.115 8.115 8.631 -0.516 25155 4158 1 5 . 1 1 151 151 ASP N N 151 121.175 121.175 121.881 -0.706 25155 4159 1 5 . 1 1 151 151 ASP CA C 151 57.000 57.000 56.627 0.373 25155 4160 1 5 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.657 1.343 25155 4161 1 5 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.581 0.009 25155 4162 1 5 . 1 1 152 152 LEU C C 152 178.300 178.300 177.534 0.766 25155 4163 1 5 . 1 1 152 152 LEU CA C 152 54.788 54.788 55.801 -1.013 25155 4164 1 5 . 1 1 152 152 LEU CB C 152 42.200 42.200 42.036 0.164 25155 4165 1 5 . 1 1 153 153 SER N N 153 116.170 116.170 119.099 -2.929 25155 4166 1 5 . 1 1 153 153 SER HA H 153 3.911 3.911 3.972 -0.061 25155 4167 1 5 . 1 1 153 153 SER CA C 153 63.400 63.400 62.539 0.861 25155 4168 1 5 . 1 1 153 153 SER CB C 153 63.200 63.200 62.717 0.483 25155 4169 1 5 . 1 1 153 153 SER H H 153 7.378 7.378 7.503 -0.125 25155 4170 1 5 . 1 1 154 154 ASP N N 154 121.640 121.640 120.835 0.805 25155 4171 1 5 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.242 -0.002 25155 4172 1 5 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.809 1.491 25155 4173 1 5 . 1 1 154 154 ASP CB C 154 40.000 40.000 40.804 -0.804 25155 4174 1 5 . 1 1 155 155 GLU HA H 155 4.170 4.170 3.987 0.183 25155 4175 1 5 . 1 1 155 155 GLU C C 155 179.420 179.420 178.906 0.514 25155 4176 1 5 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.373 -0.173 25155 4177 1 5 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.453 0.027 25155 4178 1 5 . 1 1 156 156 ARG N N 156 121.230 121.230 119.033 2.197 25155 4179 1 5 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.161 0.115 25155 4180 1 5 . 1 1 156 156 ARG C C 156 177.350 177.350 179.116 -1.766 25155 4181 1 5 . 1 1 156 156 ARG CA C 156 59.950 59.950 59.558 0.392 25155 4182 1 5 . 1 1 156 156 ARG CB C 156 31.100 31.100 30.051 1.049 25155 4183 1 5 . 1 1 157 157 ILE N N 157 118.190 118.190 119.776 -1.586 25155 4184 1 5 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.619 -0.189 25155 4185 1 5 . 1 1 157 157 ILE C C 157 178.480 178.480 177.925 0.555 25155 4186 1 5 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.588 0.972 25155 4187 1 5 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.776 0.704 25155 4188 1 5 . 1 1 157 157 ILE H H 157 8.705 8.705 8.242 0.463 25155 4189 1 5 . 1 1 158 158 GLN N N 158 119.975 119.975 120.479 -0.504 25155 4190 1 5 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.879 0.077 25155 4191 1 5 . 1 1 158 158 GLN C C 158 178.730 178.730 178.286 0.444 25155 4192 1 5 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.235 1.465 25155 4193 1 5 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.310 0.172 25155 4194 1 5 . 1 1 158 158 GLN H H 158 8.262 8.262 8.554 -0.292 25155 4195 1 5 . 1 1 159 159 SER N N 159 115.466 115.466 115.898 -0.432 25155 4196 1 5 . 1 1 159 159 SER HA H 159 4.446 4.446 4.268 0.178 25155 4197 1 5 . 1 1 159 159 SER C C 159 177.320 177.320 176.924 0.396 25155 4198 1 5 . 1 1 159 159 SER CA C 159 63.500 63.500 61.315 2.185 25155 4199 1 5 . 1 1 159 159 SER CB C 159 63.818 63.818 63.270 0.548 25155 4200 1 5 . 1 1 159 159 SER H H 159 8.440 8.440 8.444 -0.004 25155 4201 1 5 . 1 1 160 160 TRP N N 160 126.784 126.784 125.230 1.554 25155 4202 1 5 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.507 -0.053 25155 4203 1 5 . 1 1 160 160 TRP C C 160 177.934 177.934 177.569 0.365 25155 4204 1 5 . 1 1 160 160 TRP CA C 160 62.745 62.745 62.253 0.492 25155 4205 1 5 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.201 0.149 25155 4206 1 5 . 1 1 160 160 TRP H H 160 9.243 9.243 8.178 1.065 25155 4207 1 5 . 1 1 161 161 CYS N N 161 116.395 116.395 118.476 -2.081 25155 4208 1 5 . 1 1 161 161 CYS HA H 161 3.886 3.886 3.532 0.354 25155 4209 1 5 . 1 1 161 161 CYS C C 161 176.245 176.245 177.011 -0.766 25155 4210 1 5 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.576 0.724 25155 4211 1 5 . 1 1 161 161 CYS CB C 161 27.723 27.723 27.131 0.592 25155 4212 1 5 . 1 1 161 161 CYS H H 161 8.845 8.845 8.926 -0.081 25155 4213 1 5 . 1 1 162 162 GLU N N 162 118.030 118.030 119.509 -1.479 25155 4214 1 5 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.832 0.088 25155 4215 1 5 . 1 1 162 162 GLU C C 162 178.700 178.700 178.683 0.017 25155 4216 1 5 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.509 0.291 25155 4217 1 5 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.253 0.247 25155 4218 1 5 . 1 1 163 163 GLN N N 163 120.650 120.650 119.607 1.043 25155 4219 1 5 . 1 1 163 163 GLN HA H 163 4.173 4.173 4.051 0.122 25155 4220 1 5 . 1 1 163 163 GLN C C 163 179.700 179.700 178.523 1.177 25155 4221 1 5 . 1 1 163 163 GLN CA C 163 59.688 59.688 58.991 0.697 25155 4222 1 5 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.821 0.079 25155 4223 1 5 . 1 1 163 163 GLN H H 163 8.148 8.148 7.911 0.237 25155 4224 1 5 . 1 1 164 164 ILE N N 164 114.836 114.836 116.653 -1.817 25155 4225 1 5 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.682 0.378 25155 4226 1 5 . 1 1 164 164 ILE C C 164 178.676 178.676 177.646 1.030 25155 4227 1 5 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.356 1.804 25155 4228 1 5 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.293 0.337 25155 4229 1 5 . 1 1 164 164 ILE H H 164 8.958 8.958 8.309 0.649 25155 4230 1 5 . 1 1 165 165 LEU N N 165 123.700 123.700 120.197 3.503 25155 4231 1 5 . 1 1 165 165 LEU HA H 165 4.100 4.100 4.092 0.008 25155 4232 1 5 . 1 1 165 165 LEU C C 165 180.548 180.548 178.315 2.233 25155 4233 1 5 . 1 1 165 165 LEU CA C 165 58.150 58.150 57.890 0.260 25155 4234 1 5 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.372 -0.242 25155 4235 1 5 . 1 1 165 165 LEU H H 165 7.830 7.830 7.569 0.261 25155 4236 1 5 . 1 1 166 166 ASN N N 166 120.160 120.160 118.407 1.753 25155 4237 1 5 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.319 0.251 25155 4238 1 5 . 1 1 166 166 ASN C C 166 175.690 175.690 177.188 -1.498 25155 4239 1 5 . 1 1 166 166 ASN CA C 166 55.946 55.946 56.536 -0.590 25155 4240 1 5 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.454 0.026 25155 4241 1 5 . 1 1 166 166 ASN H H 166 7.706 7.706 7.950 -0.244 25155 4242 1 5 . 1 1 167 167 GLU N N 167 121.286 121.286 121.032 0.254 25155 4243 1 5 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.077 0.027 25155 4244 1 5 . 1 1 167 167 GLU C C 167 180.520 180.520 179.098 1.422 25155 4245 1 5 . 1 1 167 167 GLU CA C 167 59.920 59.920 58.993 0.927 25155 4246 1 5 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.753 1.172 25155 4247 1 5 . 1 1 168 168 MET N N 168 118.622 118.622 116.391 2.231 25155 4248 1 5 . 1 1 168 168 MET HA H 168 3.996 3.996 4.295 -0.299 25155 4249 1 5 . 1 1 168 168 MET C C 168 176.856 176.856 177.681 -0.825 25155 4250 1 5 . 1 1 168 168 MET CA C 168 59.500 59.500 59.060 0.440 25155 4251 1 5 . 1 1 168 168 MET CB C 168 33.700 33.700 32.605 1.095 25155 4252 1 5 . 1 1 168 168 MET H H 168 8.723 8.723 8.327 0.396 25155 4253 1 5 . 1 1 169 169 ALA N N 169 121.760 121.760 123.481 -1.721 25155 4254 1 5 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.229 -0.073 25155 4255 1 5 . 1 1 169 169 ALA C C 169 179.790 179.790 179.760 0.030 25155 4256 1 5 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.772 0.028 25155 4257 1 5 . 1 1 169 169 ALA CB C 169 18.220 18.220 18.416 -0.196 25155 4258 1 5 . 1 1 169 169 ALA H H 169 7.494 7.494 7.439 0.055 25155 4259 1 5 . 1 1 170 170 GLU N N 170 116.970 116.970 117.997 -1.027 25155 4260 1 5 . 1 1 170 170 GLU HA H 170 4.091 4.091 4.012 0.079 25155 4261 1 5 . 1 1 170 170 GLU C C 170 177.745 177.745 178.310 -0.565 25155 4262 1 5 . 1 1 170 170 GLU CA C 170 58.000 58.000 58.845 -0.845 25155 4263 1 5 . 1 1 170 170 GLU CB C 170 29.730 29.730 29.592 0.138 25155 4264 1 5 . 1 1 171 171 HIS N N 171 118.150 118.150 117.005 1.145 25155 4265 1 5 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.357 0.113 25155 4266 1 5 . 1 1 171 171 HIS C C 171 175.848 175.848 176.876 -1.028 25155 4267 1 5 . 1 1 171 171 HIS CA C 171 57.600 57.600 58.361 -0.761 25155 4268 1 5 . 1 1 171 171 HIS CB C 171 30.800 30.800 30.135 0.665 25155 4269 1 5 . 1 1 171 171 HIS H H 171 7.717 7.717 7.724 -0.007 25155 4270 1 5 . 1 1 172 172 TYR N N 172 119.483 119.483 118.560 0.923 25155 4271 1 5 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.348 0.243 25155 4272 1 5 . 1 1 172 172 TYR C C 172 174.590 174.590 176.309 -1.719 25155 4273 1 5 . 1 1 172 172 TYR CA C 172 57.813 57.813 59.046 -1.233 25155 4274 1 5 . 1 1 172 172 TYR CB C 172 38.900 38.900 38.715 0.185 25155 4275 1 5 . 1 1 172 172 TYR H H 172 7.778 7.778 7.782 -0.004 25155 4276 1 6 . 1 1 2 2 ASN N N 2 122.966 122.966 119.077 3.889 25155 4277 1 6 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.228 -0.053 25155 4278 1 6 . 1 1 2 2 ASN C C 2 175.200 175.200 173.536 1.664 25155 4279 1 6 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.380 0.540 25155 4280 1 6 . 1 1 2 2 ASN CB C 2 40.000 40.000 41.160 -1.160 25155 4281 1 6 . 1 1 2 2 ASN H H 2 9.392 9.392 8.253 1.139 25155 4282 1 6 . 1 1 3 3 MET N N 3 120.660 120.660 116.995 3.665 25155 4283 1 6 . 1 1 3 3 MET HA H 3 5.565 5.565 5.156 0.409 25155 4284 1 6 . 1 1 3 3 MET C C 3 174.200 174.200 175.439 -1.239 25155 4285 1 6 . 1 1 3 3 MET CA C 3 54.550 54.550 54.706 -0.156 25155 4286 1 6 . 1 1 3 3 MET CB C 3 34.100 34.100 36.475 -2.375 25155 4287 1 6 . 1 1 3 3 MET H H 3 8.745 8.745 9.032 -0.287 25155 4288 1 6 . 1 1 4 4 GLY N N 4 115.792 115.792 110.002 5.790 25155 4289 1 6 . 1 1 4 4 GLY C C 4 170.444 170.444 171.808 -1.364 25155 4290 1 6 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.207 -0.320 25155 4291 1 6 . 1 1 4 4 GLY H H 4 8.989 8.989 9.052 -0.063 25155 4292 1 6 . 1 1 5 5 LEU N N 5 131.175 131.175 125.507 5.668 25155 4293 1 6 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.422 0.900 25155 4294 1 6 . 1 1 5 5 LEU C C 5 175.700 175.700 174.654 1.046 25155 4295 1 6 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.498 -0.178 25155 4296 1 6 . 1 1 5 5 LEU CB C 5 44.700 44.700 43.961 0.739 25155 4297 1 6 . 1 1 5 5 LEU H H 5 8.917 8.917 8.321 0.596 25155 4298 1 6 . 1 1 6 6 PHE N N 6 125.990 125.990 125.500 0.490 25155 4299 1 6 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.784 -0.046 25155 4300 1 6 . 1 1 6 6 PHE C C 6 174.358 174.358 173.370 0.988 25155 4301 1 6 . 1 1 6 6 PHE CA C 6 55.480 55.480 54.923 0.557 25155 4302 1 6 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.735 -0.685 25155 4303 1 6 . 1 1 6 6 PHE H H 6 9.225 9.225 9.255 -0.030 25155 4304 1 6 . 1 1 7 7 TYR N N 7 118.040 118.040 117.171 0.869 25155 4305 1 6 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.645 0.284 25155 4306 1 6 . 1 1 7 7 TYR C C 7 171.690 171.690 173.980 -2.290 25155 4307 1 6 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.468 -1.008 25155 4308 1 6 . 1 1 7 7 TYR CB C 7 40.800 40.800 41.123 -0.323 25155 4309 1 6 . 1 1 7 7 TYR H H 7 8.235 8.235 8.170 0.065 25155 4310 1 6 . 1 1 8 8 GLY N N 8 106.640 106.640 108.346 -1.706 25155 4311 1 6 . 1 1 8 8 GLY C C 8 171.682 171.682 173.161 -1.479 25155 4312 1 6 . 1 1 8 8 GLY CA C 8 44.050 44.050 45.086 -1.036 25155 4313 1 6 . 1 1 8 8 GLY H H 8 6.996 6.996 8.908 -1.912 25155 4314 1 6 . 1 1 9 9 SER N N 9 118.164 118.164 119.048 -0.884 25155 4315 1 6 . 1 1 9 9 SER C C 9 174.560 174.560 174.497 0.063 25155 4316 1 6 . 1 1 9 9 SER CA C 9 57.140 57.140 57.981 -0.841 25155 4317 1 6 . 1 1 9 9 SER H H 9 9.680 9.680 8.668 1.012 25155 4318 1 6 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.902 -0.272 25155 4319 1 6 . 1 1 17 17 ALA C C 17 177.740 177.740 178.403 -0.663 25155 4320 1 6 . 1 1 17 17 ALA CA C 17 54.900 54.900 55.155 -0.255 25155 4321 1 6 . 1 1 17 17 ALA CB C 17 17.790 17.790 18.771 -0.981 25155 4322 1 6 . 1 1 17 17 ALA H H 17 8.055 8.055 7.758 0.297 25155 4323 1 6 . 1 1 18 18 ALA N N 18 120.026 120.026 120.822 -0.796 25155 4324 1 6 . 1 1 18 18 ALA HA H 18 3.713 3.713 3.939 -0.226 25155 4325 1 6 . 1 1 18 18 ALA C C 18 179.040 179.040 179.509 -0.469 25155 4326 1 6 . 1 1 18 18 ALA CA C 18 54.860 54.860 55.080 -0.220 25155 4327 1 6 . 1 1 18 18 ALA CB C 18 18.200 18.200 17.850 0.350 25155 4328 1 6 . 1 1 18 18 ALA H H 18 7.015 7.015 7.594 -0.579 25155 4329 1 6 . 1 1 19 19 GLU N N 19 116.656 116.656 118.111 -1.455 25155 4330 1 6 . 1 1 19 19 GLU HA H 19 3.580 3.580 3.975 -0.395 25155 4331 1 6 . 1 1 19 19 GLU C C 19 178.487 178.487 179.429 -0.942 25155 4332 1 6 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.577 0.093 25155 4333 1 6 . 1 1 19 19 GLU CB C 19 29.400 29.400 29.231 0.169 25155 4334 1 6 . 1 1 20 20 LYS N N 20 120.100 120.100 120.327 -0.227 25155 4335 1 6 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.079 0.267 25155 4336 1 6 . 1 1 20 20 LYS C C 20 175.330 175.330 179.082 -3.752 25155 4337 1 6 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.280 -2.180 25155 4338 1 6 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.544 0.456 25155 4339 1 6 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.727 -0.262 25155 4340 1 6 . 1 1 21 21 ILE C C 21 177.680 177.680 178.011 -0.331 25155 4341 1 6 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.538 0.102 25155 4342 1 6 . 1 1 21 21 ILE CB C 21 38.030 38.030 38.010 0.020 25155 4343 1 6 . 1 1 21 21 ILE H H 21 8.220 8.220 8.566 -0.346 25155 4344 1 6 . 1 1 22 22 ARG N N 22 119.433 119.433 118.517 0.916 25155 4345 1 6 . 1 1 22 22 ARG HA H 22 3.550 3.550 4.061 -0.511 25155 4346 1 6 . 1 1 22 22 ARG C C 22 177.268 177.268 178.270 -1.002 25155 4347 1 6 . 1 1 22 22 ARG CA C 22 59.760 59.760 58.677 1.083 25155 4348 1 6 . 1 1 22 22 ARG CB C 22 28.900 28.900 29.036 -0.136 25155 4349 1 6 . 1 1 23 23 ASP N N 23 118.945 118.945 120.009 -1.064 25155 4350 1 6 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.429 -0.087 25155 4351 1 6 . 1 1 23 23 ASP C C 23 178.470 178.470 178.591 -0.121 25155 4352 1 6 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.210 0.240 25155 4353 1 6 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.915 -0.545 25155 4354 1 6 . 1 1 24 24 ILE N N 24 121.200 121.200 119.231 1.969 25155 4355 1 6 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.824 -0.090 25155 4356 1 6 . 1 1 24 24 ILE C C 24 178.297 178.297 177.924 0.373 25155 4357 1 6 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.570 -0.070 25155 4358 1 6 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.545 0.195 25155 4359 1 6 . 1 1 24 24 ILE H H 24 8.160 8.160 7.896 0.264 25155 4360 1 6 . 1 1 25 25 ILE N N 25 121.166 121.166 117.855 3.311 25155 4361 1 6 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.896 -0.253 25155 4362 1 6 . 1 1 25 25 ILE C C 25 176.825 176.825 176.671 0.154 25155 4363 1 6 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.239 2.651 25155 4364 1 6 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.834 -1.084 25155 4365 1 6 . 1 1 25 25 ILE H H 25 8.480 8.480 8.104 0.376 25155 4366 1 6 . 1 1 26 26 GLY N N 26 109.050 109.050 104.789 4.261 25155 4367 1 6 . 1 1 26 26 GLY C C 26 173.800 173.800 172.570 1.230 25155 4368 1 6 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.543 -0.143 25155 4369 1 6 . 1 1 26 26 GLY H H 26 7.945 7.945 7.702 0.243 25155 4370 1 6 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.507 -0.144 25155 4371 1 6 . 1 1 27 27 PRO C C 27 177.157 177.157 177.036 0.121 25155 4372 1 6 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.710 0.820 25155 4373 1 6 . 1 1 27 27 PRO CB C 27 32.000 32.000 32.263 -0.263 25155 4374 1 6 . 1 1 28 28 GLU N N 28 116.510 116.510 116.662 -0.152 25155 4375 1 6 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.253 0.007 25155 4376 1 6 . 1 1 28 28 GLU C C 28 177.000 177.000 177.280 -0.280 25155 4377 1 6 . 1 1 28 28 GLU CA C 28 57.680 57.680 57.287 0.393 25155 4378 1 6 . 1 1 28 28 GLU CB C 28 28.620 28.620 29.099 -0.479 25155 4379 1 6 . 1 1 29 29 LEU N N 29 120.334 120.334 114.022 6.312 25155 4380 1 6 . 1 1 29 29 LEU HA H 29 4.650 4.650 4.792 -0.142 25155 4381 1 6 . 1 1 29 29 LEU C C 29 175.676 175.676 175.158 0.518 25155 4382 1 6 . 1 1 29 29 LEU CA C 29 55.924 55.924 54.762 1.162 25155 4383 1 6 . 1 1 29 29 LEU CB C 29 44.880 44.880 43.815 1.065 25155 4384 1 6 . 1 1 29 29 LEU H H 29 7.924 7.924 7.509 0.415 25155 4385 1 6 . 1 1 30 30 VAL N N 30 118.900 118.900 120.625 -1.725 25155 4386 1 6 . 1 1 30 30 VAL HA H 30 4.639 4.639 4.957 -0.318 25155 4387 1 6 . 1 1 30 30 VAL C C 30 174.368 174.368 175.292 -0.924 25155 4388 1 6 . 1 1 30 30 VAL CA C 30 61.110 61.110 60.806 0.304 25155 4389 1 6 . 1 1 30 30 VAL CB C 30 34.500 34.500 34.329 0.171 25155 4390 1 6 . 1 1 30 30 VAL H H 30 7.486 7.486 7.466 0.020 25155 4391 1 6 . 1 1 31 31 THR N N 31 124.000 124.000 122.011 1.989 25155 4392 1 6 . 1 1 31 31 THR HA H 31 4.331 4.331 4.804 -0.473 25155 4393 1 6 . 1 1 31 31 THR C C 31 172.670 172.670 173.578 -0.908 25155 4394 1 6 . 1 1 31 31 THR CA C 31 61.784 61.784 61.218 0.566 25155 4395 1 6 . 1 1 31 31 THR CB C 31 70.483 70.483 71.361 -0.878 25155 4396 1 6 . 1 1 31 31 THR H H 31 7.947 7.947 8.992 -1.045 25155 4397 1 6 . 1 1 32 32 LEU N N 32 127.408 127.408 126.032 1.376 25155 4398 1 6 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.636 0.001 25155 4399 1 6 . 1 1 32 32 LEU C C 32 176.425 176.425 177.104 -0.679 25155 4400 1 6 . 1 1 32 32 LEU CA C 32 54.760 54.760 55.281 -0.521 25155 4401 1 6 . 1 1 32 32 LEU CB C 32 43.809 43.809 42.894 0.915 25155 4402 1 6 . 1 1 32 32 LEU H H 32 8.614 8.614 8.756 -0.142 25155 4403 1 6 . 1 1 33 33 HIS N N 33 120.230 120.230 123.760 -3.530 25155 4404 1 6 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.956 -0.536 25155 4405 1 6 . 1 1 33 33 HIS C C 33 171.914 171.914 173.887 -1.973 25155 4406 1 6 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.771 0.529 25155 4407 1 6 . 1 1 33 33 HIS CB C 33 32.050 32.050 30.367 1.683 25155 4408 1 6 . 1 1 33 33 HIS H H 33 9.130 9.130 9.042 0.088 25155 4409 1 6 . 1 1 34 34 ASN N N 34 123.987 123.987 122.322 1.665 25155 4410 1 6 . 1 1 34 34 ASN HA H 34 3.600 3.600 4.065 -0.465 25155 4411 1 6 . 1 1 34 34 ASN C C 34 177.930 177.930 175.618 2.312 25155 4412 1 6 . 1 1 34 34 ASN CA C 34 51.730 51.730 52.382 -0.652 25155 4413 1 6 . 1 1 34 34 ASN CB C 34 38.747 38.747 38.539 0.208 25155 4414 1 6 . 1 1 34 34 ASN H H 34 8.759 8.759 8.444 0.315 25155 4415 1 6 . 1 1 35 35 LEU N N 35 128.751 128.751 126.367 2.384 25155 4416 1 6 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.185 0.105 25155 4417 1 6 . 1 1 35 35 LEU C C 35 177.363 177.363 178.062 -0.699 25155 4418 1 6 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.485 0.065 25155 4419 1 6 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.709 1.053 25155 4420 1 6 . 1 1 35 35 LEU H H 35 8.758 8.758 8.339 0.419 25155 4421 1 6 . 1 1 36 36 LYS N N 36 120.870 120.870 118.412 2.458 25155 4422 1 6 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.067 -0.134 25155 4423 1 6 . 1 1 36 36 LYS C C 36 176.540 176.540 177.014 -0.474 25155 4424 1 6 . 1 1 36 36 LYS CA C 36 59.260 59.260 58.048 1.212 25155 4425 1 6 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.487 0.313 25155 4426 1 6 . 1 1 37 37 ASP N N 37 115.288 115.288 116.257 -0.969 25155 4427 1 6 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.741 0.006 25155 4428 1 6 . 1 1 37 37 ASP C C 37 175.500 175.500 176.139 -0.639 25155 4429 1 6 . 1 1 37 37 ASP CA C 37 54.805 54.805 54.875 -0.070 25155 4430 1 6 . 1 1 37 37 ASP CB C 37 44.650 44.650 43.372 1.278 25155 4431 1 6 . 1 1 38 38 ASP N N 38 121.550 121.550 120.773 0.777 25155 4432 1 6 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.912 -0.047 25155 4433 1 6 . 1 1 38 38 ASP C C 38 174.895 174.895 175.699 -0.804 25155 4434 1 6 . 1 1 38 38 ASP CA C 38 52.840 52.840 53.597 -0.757 25155 4435 1 6 . 1 1 38 38 ASP CB C 38 42.240 42.240 42.701 -0.461 25155 4436 1 6 . 1 1 39 39 SER N N 39 115.170 115.170 118.157 -2.987 25155 4437 1 6 . 1 1 39 39 SER HA H 39 4.600 4.600 4.635 -0.035 25155 4438 1 6 . 1 1 39 39 SER C C 39 174.930 174.930 174.624 0.306 25155 4439 1 6 . 1 1 39 39 SER CA C 39 54.786 54.786 56.915 -2.129 25155 4440 1 6 . 1 1 39 39 SER CB C 39 64.840 64.840 63.155 1.685 25155 4441 1 6 . 1 1 39 39 SER H H 39 8.330 8.330 8.676 -0.346 25155 4442 1 6 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.413 -0.413 25155 4443 1 6 . 1 1 40 40 PRO C C 40 176.620 176.620 178.201 -1.581 25155 4444 1 6 . 1 1 40 40 PRO CA C 40 63.870 63.870 64.851 -0.981 25155 4445 1 6 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.903 -0.543 25155 4446 1 6 . 1 1 41 41 LYS N N 41 120.913 120.913 118.334 2.579 25155 4447 1 6 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.142 -0.246 25155 4448 1 6 . 1 1 41 41 LYS C C 41 179.580 179.580 178.644 0.936 25155 4449 1 6 . 1 1 41 41 LYS CA C 41 58.000 58.000 58.934 -0.934 25155 4450 1 6 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.077 1.023 25155 4451 1 6 . 1 1 42 42 LEU N N 42 118.206 118.206 120.311 -2.105 25155 4452 1 6 . 1 1 42 42 LEU HA H 42 4.025 4.025 4.061 -0.036 25155 4453 1 6 . 1 1 42 42 LEU C C 42 178.630 178.630 178.414 0.216 25155 4454 1 6 . 1 1 42 42 LEU CA C 42 57.030 57.030 57.215 -0.185 25155 4455 1 6 . 1 1 42 42 LEU CB C 42 41.820 41.820 41.098 0.722 25155 4456 1 6 . 1 1 42 42 LEU H H 42 7.598 7.598 7.607 -0.009 25155 4457 1 6 . 1 1 43 43 MET N N 43 118.913 118.913 117.478 1.435 25155 4458 1 6 . 1 1 43 43 MET HA H 43 3.760 3.760 4.000 -0.240 25155 4459 1 6 . 1 1 43 43 MET C C 43 177.710 177.710 178.475 -0.765 25155 4460 1 6 . 1 1 43 43 MET CA C 43 59.864 59.864 58.752 1.112 25155 4461 1 6 . 1 1 43 43 MET CB C 43 32.680 32.680 31.780 0.899 25155 4462 1 6 . 1 1 43 43 MET H H 43 8.180 8.180 8.184 -0.004 25155 4463 1 6 . 1 1 44 44 GLU N N 44 110.906 110.906 119.098 -8.192 25155 4464 1 6 . 1 1 44 44 GLU HA H 44 3.732 3.732 4.061 -0.329 25155 4465 1 6 . 1 1 44 44 GLU C C 44 178.120 178.120 179.146 -1.026 25155 4466 1 6 . 1 1 44 44 GLU CA C 44 59.450 59.450 59.171 0.279 25155 4467 1 6 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.267 0.533 25155 4468 1 6 . 1 1 45 45 GLN N N 45 115.770 115.770 117.533 -1.763 25155 4469 1 6 . 1 1 45 45 GLN HA H 45 4.190 4.190 4.005 0.185 25155 4470 1 6 . 1 1 45 45 GLN C C 45 175.480 175.480 176.681 -1.201 25155 4471 1 6 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.191 -1.091 25155 4472 1 6 . 1 1 45 45 GLN CB C 45 28.490 28.490 28.882 -0.392 25155 4473 1 6 . 1 1 45 45 GLN H H 45 7.517 7.517 7.581 -0.064 25155 4474 1 6 . 1 1 46 46 TYR N N 46 117.840 117.840 118.501 -0.661 25155 4475 1 6 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.482 0.178 25155 4476 1 6 . 1 1 46 46 TYR C C 46 175.480 175.480 176.185 -0.705 25155 4477 1 6 . 1 1 46 46 TYR CA C 46 58.827 58.827 58.688 0.139 25155 4478 1 6 . 1 1 46 46 TYR CB C 46 41.720 41.720 38.350 3.370 25155 4479 1 6 . 1 1 46 46 TYR H H 46 6.955 6.955 7.453 -0.498 25155 4480 1 6 . 1 1 47 47 ASP N N 47 121.540 121.540 122.810 -1.270 25155 4481 1 6 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.559 0.137 25155 4482 1 6 . 1 1 47 47 ASP C C 47 175.677 175.677 175.729 -0.052 25155 4483 1 6 . 1 1 47 47 ASP CA C 47 56.812 56.812 57.034 -0.222 25155 4484 1 6 . 1 1 47 47 ASP CB C 47 42.978 42.978 41.941 1.037 25155 4485 1 6 . 1 1 48 48 VAL N N 48 118.666 118.666 117.761 0.905 25155 4486 1 6 . 1 1 48 48 VAL HA H 48 5.057 5.057 4.932 0.125 25155 4487 1 6 . 1 1 48 48 VAL C C 48 174.180 174.180 174.604 -0.424 25155 4488 1 6 . 1 1 48 48 VAL CA C 48 60.000 60.000 60.636 -0.636 25155 4489 1 6 . 1 1 48 48 VAL CB C 48 36.200 36.200 33.287 2.913 25155 4490 1 6 . 1 1 48 48 VAL H H 48 7.631 7.631 8.066 -0.435 25155 4491 1 6 . 1 1 49 49 LEU N N 49 128.300 128.300 128.400 -0.100 25155 4492 1 6 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.056 0.544 25155 4493 1 6 . 1 1 49 49 LEU C C 49 174.810 174.810 175.204 -0.394 25155 4494 1 6 . 1 1 49 49 LEU CA C 49 52.230 52.230 54.182 -1.952 25155 4495 1 6 . 1 1 49 49 LEU CB C 49 45.400 45.400 45.044 0.356 25155 4496 1 6 . 1 1 49 49 LEU H H 49 9.469 9.469 8.976 0.493 25155 4497 1 6 . 1 1 50 50 ILE N N 50 124.400 124.400 127.301 -2.901 25155 4498 1 6 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.508 1.142 25155 4499 1 6 . 1 1 50 50 ILE C C 50 175.286 175.286 174.401 0.885 25155 4500 1 6 . 1 1 50 50 ILE CA C 50 59.900 59.900 61.401 -1.501 25155 4501 1 6 . 1 1 50 50 ILE CB C 50 40.200 40.200 39.245 0.955 25155 4502 1 6 . 1 1 50 50 ILE H H 50 9.213 9.213 9.238 -0.025 25155 4503 1 6 . 1 1 51 51 LEU N N 51 127.410 127.410 128.414 -1.004 25155 4504 1 6 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.474 1.596 25155 4505 1 6 . 1 1 51 51 LEU C C 51 174.540 174.540 175.909 -1.369 25155 4506 1 6 . 1 1 51 51 LEU CA C 51 52.950 52.950 53.238 -0.288 25155 4507 1 6 . 1 1 51 51 LEU CB C 51 43.190 43.190 43.710 -0.520 25155 4508 1 6 . 1 1 51 51 LEU H H 51 9.256 9.256 8.820 0.436 25155 4509 1 6 . 1 1 52 52 GLY N N 52 108.290 108.290 110.552 -2.262 25155 4510 1 6 . 1 1 52 52 GLY C C 52 174.330 174.330 171.336 2.994 25155 4511 1 6 . 1 1 52 52 GLY CA C 52 44.040 44.040 44.012 0.028 25155 4512 1 6 . 1 1 52 52 GLY H H 52 8.949 8.949 8.128 0.821 25155 4513 1 6 . 1 1 53 53 ILE N N 53 124.912 124.912 121.331 3.581 25155 4514 1 6 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.554 -0.379 25155 4515 1 6 . 1 1 53 53 ILE C C 53 174.470 174.470 173.119 1.351 25155 4516 1 6 . 1 1 53 53 ILE CA C 53 55.850 55.850 57.889 -2.039 25155 4517 1 6 . 1 1 53 53 ILE CB C 53 42.800 42.800 42.295 0.505 25155 4518 1 6 . 1 1 53 53 ILE H H 53 8.612 8.612 7.316 1.296 25155 4519 1 6 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.956 -0.144 25155 4520 1 6 . 1 1 54 54 PRO C C 54 174.565 174.565 176.254 -1.689 25155 4521 1 6 . 1 1 54 54 PRO CA C 54 61.850 61.850 61.979 -0.129 25155 4522 1 6 . 1 1 54 54 PRO CB C 54 32.400 32.400 32.461 -0.061 25155 4523 1 6 . 1 1 55 55 THR N N 55 116.040 116.040 117.282 -1.242 25155 4524 1 6 . 1 1 55 55 THR HA H 55 4.522 4.522 4.453 0.069 25155 4525 1 6 . 1 1 55 55 THR C C 55 173.990 173.990 173.051 0.939 25155 4526 1 6 . 1 1 55 55 THR CA C 55 62.845 62.845 62.245 0.600 25155 4527 1 6 . 1 1 55 55 THR CB C 55 70.795 70.795 70.817 -0.022 25155 4528 1 6 . 1 1 55 55 THR H H 55 7.663 7.663 8.521 -0.858 25155 4529 1 6 . 1 1 56 56 TRP N N 56 130.540 130.540 126.259 4.281 25155 4530 1 6 . 1 1 56 56 TRP CA C 56 54.800 54.800 55.619 -0.819 25155 4531 1 6 . 1 1 56 56 TRP H H 56 9.075 9.075 8.115 0.960 25155 4532 1 6 . 1 1 58 58 PHE HA H 58 4.540 4.540 3.947 0.593 25155 4533 1 6 . 1 1 58 58 PHE C C 58 177.070 177.070 174.870 2.200 25155 4534 1 6 . 1 1 58 58 PHE CA C 58 55.460 55.460 58.446 -2.986 25155 4535 1 6 . 1 1 58 58 PHE CB C 58 41.200 41.200 38.524 2.676 25155 4536 1 6 . 1 1 59 59 GLY N N 59 109.796 109.796 106.627 3.169 25155 4537 1 6 . 1 1 59 59 GLY CA C 59 45.763 45.763 44.622 1.141 25155 4538 1 6 . 1 1 59 59 GLY H H 59 8.392 8.392 7.327 1.065 25155 4539 1 6 . 1 1 60 60 GLU C C 60 175.660 175.660 176.168 -0.508 25155 4540 1 6 . 1 1 61 61 ILE N N 61 122.380 122.380 118.774 3.606 25155 4541 1 6 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.319 1.121 25155 4542 1 6 . 1 1 61 61 ILE CA C 61 62.100 62.100 62.403 -0.303 25155 4543 1 6 . 1 1 61 61 ILE CB C 61 38.750 38.750 37.146 1.604 25155 4544 1 6 . 1 1 61 61 ILE H H 61 8.436 8.436 8.383 0.053 25155 4545 1 6 . 1 1 62 62 GLN CB C 62 30.570 30.570 30.514 0.056 25155 4546 1 6 . 1 1 63 63 GLU HA H 63 4.030 4.030 4.017 0.013 25155 4547 1 6 . 1 1 63 63 GLU C C 63 177.134 177.134 177.711 -0.577 25155 4548 1 6 . 1 1 63 63 GLU CA C 63 60.520 60.520 60.297 0.223 25155 4549 1 6 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.800 -0.150 25155 4550 1 6 . 1 1 64 64 ASP N N 64 119.630 119.630 117.283 2.347 25155 4551 1 6 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.496 0.096 25155 4552 1 6 . 1 1 64 64 ASP C C 64 178.680 178.680 176.609 2.071 25155 4553 1 6 . 1 1 64 64 ASP CA C 64 57.823 57.823 56.538 1.285 25155 4554 1 6 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.232 0.868 25155 4555 1 6 . 1 1 65 65 TRP N N 65 120.535 120.535 120.990 -0.455 25155 4556 1 6 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.657 -0.332 25155 4557 1 6 . 1 1 65 65 TRP C C 65 178.684 178.684 177.080 1.604 25155 4558 1 6 . 1 1 65 65 TRP CA C 65 60.500 60.500 59.414 1.086 25155 4559 1 6 . 1 1 65 65 TRP CB C 65 30.100 30.100 32.120 -2.020 25155 4560 1 6 . 1 1 65 65 TRP H H 65 7.416 7.416 7.818 -0.402 25155 4561 1 6 . 1 1 66 66 GLU N N 66 120.760 120.760 121.125 -0.365 25155 4562 1 6 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.298 -0.478 25155 4563 1 6 . 1 1 66 66 GLU C C 66 178.860 178.860 178.927 -0.067 25155 4564 1 6 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.917 0.183 25155 4565 1 6 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.605 -0.595 25155 4566 1 6 . 1 1 67 67 ALA N N 67 118.972 118.972 122.000 -3.028 25155 4567 1 6 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.223 0.024 25155 4568 1 6 . 1 1 67 67 ALA C C 67 179.610 179.610 178.962 0.648 25155 4569 1 6 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.918 -0.318 25155 4570 1 6 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.869 -0.081 25155 4571 1 6 . 1 1 67 67 ALA H H 67 7.690 7.690 8.506 -0.816 25155 4572 1 6 . 1 1 68 68 VAL N N 68 107.530 107.530 111.397 -3.867 25155 4573 1 6 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.268 0.442 25155 4574 1 6 . 1 1 68 68 VAL C C 68 176.800 176.800 176.700 0.100 25155 4575 1 6 . 1 1 68 68 VAL CA C 68 60.060 60.060 63.066 -3.006 25155 4576 1 6 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.524 0.076 25155 4577 1 6 . 1 1 68 68 VAL H H 68 7.240 7.240 7.562 -0.322 25155 4578 1 6 . 1 1 69 69 TRP N N 69 126.960 126.960 124.556 2.404 25155 4579 1 6 . 1 1 69 69 TRP HA H 69 4.182 4.182 3.968 0.214 25155 4580 1 6 . 1 1 69 69 TRP C C 69 178.640 178.640 177.094 1.546 25155 4581 1 6 . 1 1 69 69 TRP CA C 69 61.300 61.300 62.574 -1.274 25155 4582 1 6 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.370 2.200 25155 4583 1 6 . 1 1 69 69 TRP H H 69 7.810 7.810 8.364 -0.554 25155 4584 1 6 . 1 1 70 70 ASP N N 70 114.644 114.644 116.716 -2.072 25155 4585 1 6 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.120 0.399 25155 4586 1 6 . 1 1 70 70 ASP C C 70 178.685 178.685 177.882 0.803 25155 4587 1 6 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.465 -0.465 25155 4588 1 6 . 1 1 70 70 ASP CB C 70 39.810 39.810 40.976 -1.166 25155 4589 1 6 . 1 1 71 71 GLN N N 71 120.100 120.100 117.152 2.948 25155 4590 1 6 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.196 -0.006 25155 4591 1 6 . 1 1 71 71 GLN C C 71 178.870 178.870 178.090 0.780 25155 4592 1 6 . 1 1 71 71 GLN CA C 71 57.617 57.617 57.448 0.169 25155 4593 1 6 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.531 -0.711 25155 4594 1 6 . 1 1 71 71 GLN H H 71 7.980 7.980 7.684 0.296 25155 4595 1 6 . 1 1 72 72 LEU N N 72 117.535 117.535 119.525 -1.990 25155 4596 1 6 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.975 -0.178 25155 4597 1 6 . 1 1 72 72 LEU C C 72 178.308 178.308 178.326 -0.018 25155 4598 1 6 . 1 1 72 72 LEU CA C 72 57.340 57.340 57.549 -0.209 25155 4599 1 6 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.571 0.129 25155 4600 1 6 . 1 1 72 72 LEU H H 72 7.435 7.435 8.007 -0.572 25155 4601 1 6 . 1 1 73 73 ASP N N 73 115.534 115.534 116.999 -1.465 25155 4602 1 6 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.388 -0.238 25155 4603 1 6 . 1 1 73 73 ASP C C 73 177.553 177.553 177.129 0.424 25155 4604 1 6 . 1 1 73 73 ASP CA C 73 57.350 57.350 56.268 1.082 25155 4605 1 6 . 1 1 73 73 ASP CB C 73 40.040 40.040 41.328 -1.288 25155 4606 1 6 . 1 1 74 74 ASP N N 74 117.300 117.300 120.056 -2.756 25155 4607 1 6 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.563 0.143 25155 4608 1 6 . 1 1 74 74 ASP C C 74 176.424 176.424 177.240 -0.816 25155 4609 1 6 . 1 1 74 74 ASP CA C 74 54.170 54.170 55.266 -1.096 25155 4610 1 6 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.562 0.258 25155 4611 1 6 . 1 1 75 75 LEU N N 75 118.500 118.500 120.732 -2.232 25155 4612 1 6 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.162 0.133 25155 4613 1 6 . 1 1 75 75 LEU C C 75 176.800 176.800 176.115 0.685 25155 4614 1 6 . 1 1 75 75 LEU CA C 75 54.400 54.400 55.373 -0.973 25155 4615 1 6 . 1 1 75 75 LEU CB C 75 43.280 43.280 41.971 1.309 25155 4616 1 6 . 1 1 75 75 LEU H H 75 6.966 6.966 7.971 -1.005 25155 4617 1 6 . 1 1 76 76 ASN N N 76 123.040 123.040 119.600 3.440 25155 4618 1 6 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.781 0.081 25155 4619 1 6 . 1 1 76 76 ASN C C 76 174.927 174.927 174.112 0.815 25155 4620 1 6 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.108 -1.227 25155 4621 1 6 . 1 1 76 76 ASN CB C 76 37.510 37.510 39.553 -2.043 25155 4622 1 6 . 1 1 76 76 ASN H H 76 9.882 9.882 9.073 0.809 25155 4623 1 6 . 1 1 77 77 LEU N N 77 123.614 123.614 123.732 -0.118 25155 4624 1 6 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.640 -0.270 25155 4625 1 6 . 1 1 77 77 LEU C C 77 175.110 175.110 176.180 -1.070 25155 4626 1 6 . 1 1 77 77 LEU CA C 77 52.200 52.200 53.234 -1.034 25155 4627 1 6 . 1 1 77 77 LEU CB C 77 42.786 42.786 42.925 -0.139 25155 4628 1 6 . 1 1 77 77 LEU H H 77 8.700 8.700 8.681 0.019 25155 4629 1 6 . 1 1 78 78 GLU N N 78 120.822 120.822 121.150 -0.328 25155 4630 1 6 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.077 -0.177 25155 4631 1 6 . 1 1 78 78 GLU C C 78 178.670 178.670 177.791 0.879 25155 4632 1 6 . 1 1 78 78 GLU CA C 78 58.700 58.700 58.072 0.628 25155 4633 1 6 . 1 1 78 78 GLU CB C 78 29.467 29.467 29.380 0.087 25155 4634 1 6 . 1 1 79 79 GLY N N 79 113.160 113.160 113.705 -0.545 25155 4635 1 6 . 1 1 79 79 GLY C C 79 174.523 174.523 173.934 0.589 25155 4636 1 6 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.645 -0.225 25155 4637 1 6 . 1 1 79 79 GLY H H 79 8.450 8.450 8.726 -0.276 25155 4638 1 6 . 1 1 80 80 LYS N N 80 120.283 120.283 119.571 0.712 25155 4639 1 6 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.376 -0.018 25155 4640 1 6 . 1 1 80 80 LYS C C 80 175.304 175.304 176.140 -0.836 25155 4641 1 6 . 1 1 80 80 LYS CA C 80 56.890 56.890 55.934 0.956 25155 4642 1 6 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.764 -0.644 25155 4643 1 6 . 1 1 81 81 ILE N N 81 122.288 122.288 122.089 0.199 25155 4644 1 6 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.400 0.406 25155 4645 1 6 . 1 1 81 81 ILE C C 81 174.750 174.750 175.340 -0.590 25155 4646 1 6 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.660 -1.840 25155 4647 1 6 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.156 0.694 25155 4648 1 6 . 1 1 81 81 ILE H H 81 7.405 7.405 7.931 -0.526 25155 4649 1 6 . 1 1 82 82 VAL N N 82 127.793 127.793 126.989 0.804 25155 4650 1 6 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.005 0.275 25155 4651 1 6 . 1 1 82 82 VAL C C 82 172.680 172.680 174.188 -1.508 25155 4652 1 6 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.511 -0.411 25155 4653 1 6 . 1 1 82 82 VAL CB C 82 35.280 35.280 36.124 -0.844 25155 4654 1 6 . 1 1 82 82 VAL H H 82 8.800 8.800 8.968 -0.168 25155 4655 1 6 . 1 1 83 83 ALA N N 83 130.911 130.911 128.640 2.271 25155 4656 1 6 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.526 -0.137 25155 4657 1 6 . 1 1 83 83 ALA C C 83 175.870 175.870 176.111 -0.241 25155 4658 1 6 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.440 0.560 25155 4659 1 6 . 1 1 83 83 ALA CB C 83 23.722 23.722 22.180 1.542 25155 4660 1 6 . 1 1 83 83 ALA H H 83 9.252 9.252 8.501 0.751 25155 4661 1 6 . 1 1 84 84 LEU N N 84 124.269 124.269 121.721 2.548 25155 4662 1 6 . 1 1 84 84 LEU HA H 84 5.508 5.508 5.078 0.430 25155 4663 1 6 . 1 1 84 84 LEU C C 84 175.490 175.490 175.468 0.022 25155 4664 1 6 . 1 1 84 84 LEU CA C 84 53.670 53.670 54.430 -0.760 25155 4665 1 6 . 1 1 84 84 LEU CB C 84 45.000 45.000 45.618 -0.619 25155 4666 1 6 . 1 1 84 84 LEU H H 84 10.378 10.378 9.164 1.214 25155 4667 1 6 . 1 1 85 85 TYR N N 85 115.826 115.826 119.459 -3.633 25155 4668 1 6 . 1 1 85 85 TYR HA H 85 4.950 4.950 5.221 -0.271 25155 4669 1 6 . 1 1 85 85 TYR C C 85 172.661 172.661 173.663 -1.002 25155 4670 1 6 . 1 1 85 85 TYR CA C 85 55.853 55.853 55.500 0.353 25155 4671 1 6 . 1 1 85 85 TYR CB C 85 43.200 43.200 41.328 1.872 25155 4672 1 6 . 1 1 85 85 TYR H H 85 9.200 9.200 8.172 1.028 25155 4673 1 6 . 1 1 86 86 GLY N N 86 106.802 106.802 105.264 1.538 25155 4674 1 6 . 1 1 86 86 GLY C C 86 170.348 170.348 171.394 -1.046 25155 4675 1 6 . 1 1 86 86 GLY CA C 86 44.687 44.687 44.801 -0.114 25155 4676 1 6 . 1 1 86 86 GLY H H 86 8.752 8.752 8.209 0.543 25155 4677 1 6 . 1 1 87 87 LEU N N 87 120.860 120.860 115.011 5.849 25155 4678 1 6 . 1 1 87 87 LEU HA H 87 5.476 5.476 5.211 0.265 25155 4679 1 6 . 1 1 87 87 LEU C C 87 177.720 177.720 175.802 1.918 25155 4680 1 6 . 1 1 87 87 LEU CA C 87 52.630 52.630 52.267 0.363 25155 4681 1 6 . 1 1 87 87 LEU CB C 87 45.900 45.900 44.625 1.275 25155 4682 1 6 . 1 1 87 87 LEU H H 87 6.320 6.320 7.646 -1.326 25155 4683 1 6 . 1 1 88 88 GLY N N 88 109.910 109.910 106.549 3.361 25155 4684 1 6 . 1 1 88 88 GLY C C 88 171.386 171.386 171.806 -0.420 25155 4685 1 6 . 1 1 88 88 GLY CA C 88 45.710 45.710 45.358 0.352 25155 4686 1 6 . 1 1 88 88 GLY H H 88 8.320 8.320 7.896 0.424 25155 4687 1 6 . 1 1 89 89 ASP N N 89 121.580 121.580 118.308 3.272 25155 4688 1 6 . 1 1 89 89 ASP HA H 89 5.190 5.190 5.120 0.070 25155 4689 1 6 . 1 1 89 89 ASP C C 89 176.608 176.608 175.480 1.128 25155 4690 1 6 . 1 1 89 89 ASP CA C 89 52.200 52.200 52.712 -0.512 25155 4691 1 6 . 1 1 89 89 ASP CB C 89 41.900 41.900 43.900 -2.000 25155 4692 1 6 . 1 1 90 90 GLN N N 90 123.900 123.900 122.314 1.586 25155 4693 1 6 . 1 1 90 90 GLN HA H 90 3.645 3.645 4.568 -0.923 25155 4694 1 6 . 1 1 90 90 GLN C C 90 173.523 173.523 175.730 -2.207 25155 4695 1 6 . 1 1 90 90 GLN CA C 90 58.706 58.706 55.194 3.511 25155 4696 1 6 . 1 1 90 90 GLN CB C 90 28.800 28.800 29.284 -0.484 25155 4697 1 6 . 1 1 90 90 GLN H H 90 8.726 8.726 8.400 0.326 25155 4698 1 6 . 1 1 91 91 LEU N N 91 117.080 117.080 121.236 -4.156 25155 4699 1 6 . 1 1 91 91 LEU HA H 91 4.470 4.470 3.946 0.524 25155 4700 1 6 . 1 1 91 91 LEU C C 91 179.840 179.840 178.720 1.120 25155 4701 1 6 . 1 1 91 91 LEU CA C 91 55.800 55.800 56.536 -0.736 25155 4702 1 6 . 1 1 91 91 LEU CB C 91 41.640 41.640 42.054 -0.414 25155 4703 1 6 . 1 1 91 91 LEU H H 91 7.092 7.092 8.693 -1.601 25155 4704 1 6 . 1 1 92 92 GLY N N 92 110.460 110.460 104.973 5.487 25155 4705 1 6 . 1 1 92 92 GLY C C 92 174.824 174.824 173.493 1.331 25155 4706 1 6 . 1 1 92 92 GLY CA C 92 46.390 46.390 44.100 2.290 25155 4707 1 6 . 1 1 92 92 GLY H H 92 9.243 9.243 8.818 0.425 25155 4708 1 6 . 1 1 93 93 TYR N N 93 118.140 118.140 116.603 1.537 25155 4709 1 6 . 1 1 93 93 TYR HA H 93 5.173 5.173 3.886 1.287 25155 4710 1 6 . 1 1 93 93 TYR C C 93 177.805 177.805 176.197 1.608 25155 4711 1 6 . 1 1 93 93 TYR CA C 93 57.430 57.430 58.907 -1.477 25155 4712 1 6 . 1 1 93 93 TYR CB C 93 39.300 39.300 35.445 3.855 25155 4713 1 6 . 1 1 93 93 TYR H H 93 7.252 7.252 7.511 -0.259 25155 4714 1 6 . 1 1 94 94 GLY N N 94 112.455 112.455 104.380 8.075 25155 4715 1 6 . 1 1 94 94 GLY C C 94 177.740 177.740 175.739 2.001 25155 4716 1 6 . 1 1 94 94 GLY CA C 94 49.880 49.880 45.339 4.541 25155 4717 1 6 . 1 1 94 94 GLY H H 94 8.154 8.154 8.045 0.109 25155 4718 1 6 . 1 1 95 95 GLU N N 95 123.040 123.040 121.202 1.838 25155 4719 1 6 . 1 1 95 95 GLU HA H 95 4.000 4.000 4.244 -0.244 25155 4720 1 6 . 1 1 95 95 GLU C C 95 175.145 175.145 177.199 -2.054 25155 4721 1 6 . 1 1 95 95 GLU CA C 95 57.950 57.950 58.513 -0.563 25155 4722 1 6 . 1 1 95 95 GLU CB C 95 27.400 27.400 29.916 -2.516 25155 4723 1 6 . 1 1 96 96 TRP N N 96 118.000 118.000 116.768 1.232 25155 4724 1 6 . 1 1 96 96 TRP HA H 96 5.213 5.213 4.688 0.525 25155 4725 1 6 . 1 1 96 96 TRP C C 96 176.616 176.616 176.380 0.236 25155 4726 1 6 . 1 1 96 96 TRP CA C 96 57.120 57.120 55.488 1.632 25155 4727 1 6 . 1 1 96 96 TRP CB C 96 29.970 29.970 28.844 1.126 25155 4728 1 6 . 1 1 96 96 TRP H H 96 7.785 7.785 7.491 0.294 25155 4729 1 6 . 1 1 97 97 PHE N N 97 123.268 123.268 121.803 1.465 25155 4730 1 6 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.538 0.122 25155 4731 1 6 . 1 1 97 97 PHE CA C 97 58.742 58.742 58.291 0.451 25155 4732 1 6 . 1 1 97 97 PHE CB C 97 40.835 40.835 39.922 0.913 25155 4733 1 6 . 1 1 97 97 PHE H H 97 7.054 7.054 7.370 -0.316 25155 4734 1 6 . 1 1 98 98 LEU HA H 98 3.440 3.440 3.533 -0.093 25155 4735 1 6 . 1 1 98 98 LEU C C 98 176.613 176.613 176.747 -0.134 25155 4736 1 6 . 1 1 98 98 LEU CA C 98 56.000 56.000 55.198 0.802 25155 4737 1 6 . 1 1 98 98 LEU CB C 98 38.600 38.600 38.888 -0.288 25155 4738 1 6 . 1 1 98 98 LEU H H 98 8.584 8.584 8.572 0.012 25155 4739 1 6 . 1 1 99 99 ASP N N 99 123.268 123.268 120.060 3.208 25155 4740 1 6 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.316 -0.351 25155 4741 1 6 . 1 1 99 99 ASP C C 99 178.876 178.876 177.047 1.829 25155 4742 1 6 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.511 1.749 25155 4743 1 6 . 1 1 99 99 ASP CB C 99 40.350 40.350 41.082 -0.732 25155 4744 1 6 . 1 1 100 100 ALA N N 100 119.124 119.124 121.379 -2.255 25155 4745 1 6 . 1 1 100 100 ALA HA H 100 3.822 3.822 4.046 -0.224 25155 4746 1 6 . 1 1 100 100 ALA C C 100 178.490 178.490 179.337 -0.847 25155 4747 1 6 . 1 1 100 100 ALA CA C 100 55.100 55.100 54.725 0.375 25155 4748 1 6 . 1 1 100 100 ALA CB C 100 19.700 19.700 18.165 1.535 25155 4749 1 6 . 1 1 100 100 ALA H H 100 8.400 8.400 7.794 0.606 25155 4750 1 6 . 1 1 101 101 LEU N N 101 118.687 118.687 120.249 -1.562 25155 4751 1 6 . 1 1 101 101 LEU HA H 101 3.674 3.674 3.989 -0.315 25155 4752 1 6 . 1 1 101 101 LEU C C 101 179.050 179.050 178.689 0.361 25155 4753 1 6 . 1 1 101 101 LEU CA C 101 57.800 57.800 57.079 0.721 25155 4754 1 6 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.615 1.034 25155 4755 1 6 . 1 1 101 101 LEU H H 101 6.518 6.518 7.471 -0.953 25155 4756 1 6 . 1 1 102 102 GLY N N 102 104.410 104.410 106.878 -2.468 25155 4757 1 6 . 1 1 102 102 GLY C C 102 176.056 176.056 175.963 0.093 25155 4758 1 6 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.357 0.393 25155 4759 1 6 . 1 1 102 102 GLY H H 102 7.712 7.712 8.242 -0.530 25155 4760 1 6 . 1 1 103 103 MET N N 103 120.550 120.550 121.229 -0.679 25155 4761 1 6 . 1 1 103 103 MET HA H 103 4.256 4.256 4.348 -0.092 25155 4762 1 6 . 1 1 103 103 MET C C 103 179.650 179.650 178.273 1.377 25155 4763 1 6 . 1 1 103 103 MET CA C 103 59.450 59.450 59.159 0.291 25155 4764 1 6 . 1 1 103 103 MET CB C 103 32.300 32.300 32.655 -0.355 25155 4765 1 6 . 1 1 103 103 MET H H 103 8.485 8.485 8.499 -0.014 25155 4766 1 6 . 1 1 104 104 LEU N N 104 123.480 123.480 118.961 4.519 25155 4767 1 6 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.332 -0.271 25155 4768 1 6 . 1 1 104 104 LEU C C 104 177.750 177.750 178.449 -0.699 25155 4769 1 6 . 1 1 104 104 LEU CA C 104 58.100 58.100 57.104 0.996 25155 4770 1 6 . 1 1 104 104 LEU CB C 104 41.450 41.450 41.239 0.211 25155 4771 1 6 . 1 1 104 104 LEU H H 104 8.392 8.392 7.767 0.625 25155 4772 1 6 . 1 1 105 105 HIS N N 105 119.570 119.570 120.681 -1.111 25155 4773 1 6 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.156 -0.304 25155 4774 1 6 . 1 1 105 105 HIS C C 105 177.550 177.550 177.392 0.158 25155 4775 1 6 . 1 1 105 105 HIS CA C 105 61.000 61.000 60.926 0.074 25155 4776 1 6 . 1 1 105 105 HIS CB C 105 28.820 28.820 30.215 -1.395 25155 4777 1 6 . 1 1 105 105 HIS H H 105 8.247 8.247 8.767 -0.520 25155 4778 1 6 . 1 1 106 106 ASP N N 106 119.780 119.780 120.312 -0.532 25155 4779 1 6 . 1 1 106 106 ASP HA H 106 4.333 4.333 4.277 0.056 25155 4780 1 6 . 1 1 106 106 ASP C C 106 179.410 179.410 178.208 1.202 25155 4781 1 6 . 1 1 106 106 ASP CA C 106 57.800 57.800 57.506 0.294 25155 4782 1 6 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.001 -0.401 25155 4783 1 6 . 1 1 107 107 LYS N N 107 121.660 121.660 118.878 2.782 25155 4784 1 6 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.065 0.035 25155 4785 1 6 . 1 1 107 107 LYS C C 107 178.316 178.316 178.154 0.162 25155 4786 1 6 . 1 1 107 107 LYS CA C 107 58.750 58.750 58.382 0.368 25155 4787 1 6 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.369 -0.519 25155 4788 1 6 . 1 1 108 108 LEU N N 108 116.050 116.050 116.381 -0.331 25155 4789 1 6 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.455 -0.445 25155 4790 1 6 . 1 1 108 108 LEU C C 108 179.050 179.050 179.124 -0.074 25155 4791 1 6 . 1 1 108 108 LEU CA C 108 56.240 56.240 55.903 0.337 25155 4792 1 6 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.344 -0.544 25155 4793 1 6 . 1 1 108 108 LEU H H 108 8.072 8.072 7.771 0.301 25155 4794 1 6 . 1 1 109 109 SER N N 109 116.280 116.280 116.840 -0.560 25155 4795 1 6 . 1 1 109 109 SER HA H 109 4.300 4.300 4.374 -0.074 25155 4796 1 6 . 1 1 109 109 SER C C 109 175.848 175.848 176.433 -0.585 25155 4797 1 6 . 1 1 109 109 SER CA C 109 62.410 62.410 62.299 0.111 25155 4798 1 6 . 1 1 109 109 SER CB C 109 62.850 62.850 63.028 -0.178 25155 4799 1 6 . 1 1 109 109 SER H H 109 8.366 8.366 8.615 -0.249 25155 4800 1 6 . 1 1 110 110 THR N N 110 110.416 110.416 111.984 -1.568 25155 4801 1 6 . 1 1 110 110 THR HA H 110 4.614 4.614 4.321 0.293 25155 4802 1 6 . 1 1 110 110 THR C C 110 175.675 175.675 175.708 -0.033 25155 4803 1 6 . 1 1 110 110 THR CA C 110 62.030 62.030 64.277 -2.247 25155 4804 1 6 . 1 1 110 110 THR CB C 110 68.810 68.810 68.881 -0.071 25155 4805 1 6 . 1 1 110 110 THR H H 110 7.185 7.185 7.770 -0.585 25155 4806 1 6 . 1 1 111 111 LYS N N 111 120.090 120.090 120.400 -0.310 25155 4807 1 6 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.472 0.041 25155 4808 1 6 . 1 1 111 111 LYS C C 111 176.814 176.814 176.580 0.234 25155 4809 1 6 . 1 1 111 111 LYS CA C 111 55.730 55.730 55.524 0.206 25155 4810 1 6 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.629 -1.699 25155 4811 1 6 . 1 1 112 112 GLY N N 112 107.540 107.540 108.195 -0.655 25155 4812 1 6 . 1 1 112 112 GLY C C 112 176.223 176.223 174.430 1.793 25155 4813 1 6 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.393 1.533 25155 4814 1 6 . 1 1 112 112 GLY H H 112 8.315 8.315 7.596 0.719 25155 4815 1 6 . 1 1 113 113 VAL N N 113 113.536 113.536 116.444 -2.908 25155 4816 1 6 . 1 1 113 113 VAL HA H 113 4.494 4.494 4.241 0.253 25155 4817 1 6 . 1 1 113 113 VAL C C 113 174.560 174.560 174.844 -0.284 25155 4818 1 6 . 1 1 113 113 VAL CA C 113 59.550 59.550 61.082 -1.532 25155 4819 1 6 . 1 1 113 113 VAL CB C 113 32.800 32.800 31.890 0.910 25155 4820 1 6 . 1 1 113 113 VAL H H 113 6.835 6.835 7.060 -0.225 25155 4821 1 6 . 1 1 114 114 LYS N N 114 122.920 122.920 122.202 0.718 25155 4822 1 6 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.394 0.100 25155 4823 1 6 . 1 1 114 114 LYS C C 114 174.925 174.925 174.753 0.172 25155 4824 1 6 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.119 0.161 25155 4825 1 6 . 1 1 114 114 LYS CB C 114 33.630 33.630 34.196 -0.565 25155 4826 1 6 . 1 1 115 115 PHE N N 115 123.140 123.140 123.831 -0.691 25155 4827 1 6 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.415 0.285 25155 4828 1 6 . 1 1 115 115 PHE C C 115 177.580 177.580 176.306 1.274 25155 4829 1 6 . 1 1 115 115 PHE CA C 115 58.677 58.677 56.742 1.935 25155 4830 1 6 . 1 1 115 115 PHE CB C 115 41.120 41.120 40.100 1.020 25155 4831 1 6 . 1 1 115 115 PHE H H 115 8.506 8.506 8.456 0.050 25155 4832 1 6 . 1 1 116 116 VAL N N 116 115.737 115.737 117.793 -2.056 25155 4833 1 6 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.780 -0.302 25155 4834 1 6 . 1 1 116 116 VAL C C 116 175.300 175.300 175.100 0.200 25155 4835 1 6 . 1 1 116 116 VAL CA C 116 58.877 58.877 59.581 -0.704 25155 4836 1 6 . 1 1 116 116 VAL CB C 116 34.120 34.120 34.459 -0.339 25155 4837 1 6 . 1 1 116 116 VAL H H 116 8.860 8.860 8.787 0.073 25155 4838 1 6 . 1 1 117 117 GLY N N 117 108.137 108.137 110.863 -2.726 25155 4839 1 6 . 1 1 117 117 GLY C C 117 176.110 176.110 174.184 1.926 25155 4840 1 6 . 1 1 117 117 GLY CA C 117 47.500 47.500 45.049 2.451 25155 4841 1 6 . 1 1 117 117 GLY H H 117 9.838 9.838 9.250 0.588 25155 4842 1 6 . 1 1 118 118 TYR N N 118 120.380 120.380 120.181 0.199 25155 4843 1 6 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.490 0.480 25155 4844 1 6 . 1 1 118 118 TYR C C 118 177.630 177.630 174.836 2.794 25155 4845 1 6 . 1 1 118 118 TYR CA C 118 55.800 55.800 59.331 -3.531 25155 4846 1 6 . 1 1 118 118 TYR CB C 118 35.970 35.970 37.727 -1.757 25155 4847 1 6 . 1 1 118 118 TYR H H 118 8.652 8.652 8.355 0.297 25155 4848 1 6 . 1 1 119 119 TRP N N 119 126.040 126.040 118.845 7.195 25155 4849 1 6 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.079 0.942 25155 4850 1 6 . 1 1 119 119 TRP C C 119 173.000 173.000 173.854 -0.854 25155 4851 1 6 . 1 1 119 119 TRP CA C 119 53.820 53.820 56.031 -2.211 25155 4852 1 6 . 1 1 119 119 TRP CB C 119 36.050 36.050 33.340 2.710 25155 4853 1 6 . 1 1 119 119 TRP H H 119 8.070 8.070 8.284 -0.214 25155 4854 1 6 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.530 0.254 25155 4855 1 6 . 1 1 120 120 PRO C C 120 176.870 176.870 176.249 0.621 25155 4856 1 6 . 1 1 120 120 PRO CA C 120 63.780 63.780 63.047 0.733 25155 4857 1 6 . 1 1 120 120 PRO CB C 120 31.990 31.990 31.887 0.103 25155 4858 1 6 . 1 1 121 121 THR N N 121 109.310 109.310 114.095 -4.785 25155 4859 1 6 . 1 1 121 121 THR HA H 121 4.073 4.073 3.972 0.101 25155 4860 1 6 . 1 1 121 121 THR C C 121 176.324 176.324 174.995 1.329 25155 4861 1 6 . 1 1 121 121 THR CA C 121 61.250 61.250 63.305 -2.055 25155 4862 1 6 . 1 1 121 121 THR CB C 121 69.730 69.730 68.650 1.080 25155 4863 1 6 . 1 1 121 121 THR H H 121 7.370 7.370 8.497 -1.127 25155 4864 1 6 . 1 1 122 122 GLU N N 122 123.937 123.937 121.492 2.445 25155 4865 1 6 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.062 0.162 25155 4866 1 6 . 1 1 122 122 GLU C C 122 177.737 177.737 177.859 -0.122 25155 4867 1 6 . 1 1 122 122 GLU CA C 122 58.200 58.200 57.483 0.717 25155 4868 1 6 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.292 0.508 25155 4869 1 6 . 1 1 123 123 GLY N N 123 114.563 114.563 112.373 2.190 25155 4870 1 6 . 1 1 123 123 GLY C C 123 173.783 173.783 173.778 0.005 25155 4871 1 6 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.501 -0.121 25155 4872 1 6 . 1 1 123 123 GLY H H 123 9.144 9.144 8.901 0.243 25155 4873 1 6 . 1 1 124 124 TYR N N 124 118.800 118.800 121.106 -2.306 25155 4874 1 6 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.605 0.613 25155 4875 1 6 . 1 1 124 124 TYR C C 124 175.673 175.673 175.712 -0.039 25155 4876 1 6 . 1 1 124 124 TYR CA C 124 56.950 56.950 58.856 -1.906 25155 4877 1 6 . 1 1 124 124 TYR CB C 124 41.100 41.100 40.437 0.663 25155 4878 1 6 . 1 1 124 124 TYR H H 124 7.895 7.895 8.067 -0.172 25155 4879 1 6 . 1 1 125 125 GLU N N 125 124.790 124.790 124.602 0.188 25155 4880 1 6 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.487 0.198 25155 4881 1 6 . 1 1 125 125 GLU C C 125 172.877 172.877 175.210 -2.333 25155 4882 1 6 . 1 1 125 125 GLU CA C 125 55.700 55.700 55.870 -0.170 25155 4883 1 6 . 1 1 125 125 GLU CB C 125 31.340 31.340 29.465 1.875 25155 4884 1 6 . 1 1 126 126 PHE N N 126 118.670 118.670 120.586 -1.916 25155 4885 1 6 . 1 1 126 126 PHE HA H 126 4.841 4.841 5.039 -0.198 25155 4886 1 6 . 1 1 126 126 PHE C C 126 173.800 173.800 173.979 -0.179 25155 4887 1 6 . 1 1 126 126 PHE CA C 126 56.950 56.950 57.024 -0.074 25155 4888 1 6 . 1 1 126 126 PHE CB C 126 40.300 40.300 41.426 -1.126 25155 4889 1 6 . 1 1 126 126 PHE H H 126 7.645 7.645 7.965 -0.320 25155 4890 1 6 . 1 1 127 127 THR N N 127 107.038 107.038 114.603 -7.565 25155 4891 1 6 . 1 1 127 127 THR HA H 127 4.370 4.370 4.256 0.114 25155 4892 1 6 . 1 1 127 127 THR C C 127 175.100 175.100 174.062 1.038 25155 4893 1 6 . 1 1 127 127 THR CA C 127 61.080 61.080 61.260 -0.180 25155 4894 1 6 . 1 1 127 127 THR CB C 127 70.500 70.500 69.312 1.188 25155 4895 1 6 . 1 1 127 127 THR H H 127 7.306 7.306 8.540 -1.234 25155 4896 1 6 . 1 1 128 128 SER N N 128 118.150 118.150 119.026 -0.876 25155 4897 1 6 . 1 1 128 128 SER HA H 128 4.650 4.650 4.808 -0.158 25155 4898 1 6 . 1 1 128 128 SER C C 128 175.760 175.760 174.217 1.543 25155 4899 1 6 . 1 1 128 128 SER CA C 128 55.813 55.813 56.992 -1.179 25155 4900 1 6 . 1 1 128 128 SER CB C 128 65.300 65.300 63.825 1.475 25155 4901 1 6 . 1 1 128 128 SER H H 128 7.354 7.354 7.889 -0.535 25155 4902 1 6 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.514 0.250 25155 4903 1 6 . 1 1 129 129 PRO C C 129 178.860 178.860 178.380 0.480 25155 4904 1 6 . 1 1 129 129 PRO CA C 129 62.728 62.728 64.608 -1.880 25155 4905 1 6 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.396 0.004 25155 4906 1 6 . 1 1 130 130 LYS N N 130 122.158 122.158 119.335 2.823 25155 4907 1 6 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.174 0.036 25155 4908 1 6 . 1 1 130 130 LYS C C 130 176.890 176.890 175.724 1.166 25155 4909 1 6 . 1 1 130 130 LYS CA C 130 61.375 61.375 60.570 0.805 25155 4910 1 6 . 1 1 130 130 LYS CB C 130 30.350 30.350 31.203 -0.853 25155 4911 1 6 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.464 0.069 25155 4912 1 6 . 1 1 131 131 PRO C C 131 173.810 173.810 175.574 -1.764 25155 4913 1 6 . 1 1 131 131 PRO CA C 131 64.510 64.510 63.132 1.378 25155 4914 1 6 . 1 1 131 131 PRO CB C 131 31.745 31.745 31.101 0.644 25155 4915 1 6 . 1 1 132 132 VAL N N 132 114.480 114.480 112.876 1.604 25155 4916 1 6 . 1 1 132 132 VAL HA H 132 5.158 5.158 5.049 0.109 25155 4917 1 6 . 1 1 132 132 VAL C C 132 175.137 175.137 174.123 1.014 25155 4918 1 6 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.307 0.493 25155 4919 1 6 . 1 1 132 132 VAL CB C 132 34.780 34.780 35.760 -0.980 25155 4920 1 6 . 1 1 132 132 VAL H H 132 6.716 6.716 7.565 -0.849 25155 4921 1 6 . 1 1 133 133 ILE N N 133 120.670 120.670 113.090 7.580 25155 4922 1 6 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.542 -0.150 25155 4923 1 6 . 1 1 133 133 ILE C C 133 175.485 175.485 174.884 0.601 25155 4924 1 6 . 1 1 133 133 ILE CA C 133 60.000 60.000 59.193 0.807 25155 4925 1 6 . 1 1 133 133 ILE CB C 133 42.020 42.020 41.183 0.837 25155 4926 1 6 . 1 1 133 133 ILE H H 133 8.740 8.740 8.442 0.298 25155 4927 1 6 . 1 1 134 134 ALA N N 134 122.454 122.454 123.497 -1.043 25155 4928 1 6 . 1 1 134 134 ALA HA H 134 3.953 3.953 3.930 0.023 25155 4929 1 6 . 1 1 134 134 ALA C C 134 178.387 178.387 177.282 1.105 25155 4930 1 6 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.394 -0.344 25155 4931 1 6 . 1 1 134 134 ALA CB C 134 16.982 16.982 17.062 -0.080 25155 4932 1 6 . 1 1 134 134 ALA H H 134 8.490 8.490 8.583 -0.093 25155 4933 1 6 . 1 1 135 135 ASP N N 135 117.310 117.310 116.749 0.561 25155 4934 1 6 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.316 -0.072 25155 4935 1 6 . 1 1 135 135 ASP C C 135 176.390 176.390 176.952 -0.562 25155 4936 1 6 . 1 1 135 135 ASP CA C 135 55.120 55.120 54.590 0.530 25155 4937 1 6 . 1 1 135 135 ASP CB C 135 39.865 39.865 40.116 -0.251 25155 4938 1 6 . 1 1 136 136 GLY N N 136 104.336 104.336 103.846 0.490 25155 4939 1 6 . 1 1 136 136 GLY C C 136 174.940 174.940 175.315 -0.375 25155 4940 1 6 . 1 1 136 136 GLY CA C 136 45.150 45.150 45.241 -0.091 25155 4941 1 6 . 1 1 136 136 GLY H H 136 7.592 7.592 7.940 -0.348 25155 4942 1 6 . 1 1 137 137 GLN N N 137 118.675 118.675 119.013 -0.338 25155 4943 1 6 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.385 -0.323 25155 4944 1 6 . 1 1 137 137 GLN C C 137 176.420 176.420 175.251 1.169 25155 4945 1 6 . 1 1 137 137 GLN CA C 137 57.760 57.760 56.540 1.220 25155 4946 1 6 . 1 1 137 137 GLN CB C 137 30.400 30.400 30.006 0.394 25155 4947 1 6 . 1 1 137 137 GLN H H 137 7.843 7.843 7.814 0.029 25155 4948 1 6 . 1 1 138 138 LEU N N 138 118.160 118.160 118.998 -0.838 25155 4949 1 6 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.458 0.503 25155 4950 1 6 . 1 1 138 138 LEU C C 138 175.700 175.700 174.193 1.507 25155 4951 1 6 . 1 1 138 138 LEU CA C 138 53.705 53.705 54.446 -0.741 25155 4952 1 6 . 1 1 138 138 LEU CB C 138 46.480 46.480 46.245 0.235 25155 4953 1 6 . 1 1 138 138 LEU H H 138 7.356 7.356 7.240 0.116 25155 4954 1 6 . 1 1 139 139 PHE N N 139 119.060 119.060 121.402 -2.342 25155 4955 1 6 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.807 0.537 25155 4956 1 6 . 1 1 139 139 PHE C C 139 178.850 178.850 177.466 1.384 25155 4957 1 6 . 1 1 139 139 PHE CA C 139 56.670 56.670 57.665 -0.995 25155 4958 1 6 . 1 1 139 139 PHE CB C 139 43.652 43.652 39.867 3.785 25155 4959 1 6 . 1 1 139 139 PHE H H 139 10.026 10.026 9.079 0.947 25155 4960 1 6 . 1 1 140 140 VAL N N 140 109.905 109.905 116.709 -6.804 25155 4961 1 6 . 1 1 140 140 VAL HA H 140 3.500 3.500 3.165 0.335 25155 4962 1 6 . 1 1 140 140 VAL C C 140 172.860 172.860 174.939 -2.079 25155 4963 1 6 . 1 1 140 140 VAL CA C 140 61.812 61.812 62.374 -0.562 25155 4964 1 6 . 1 1 140 140 VAL CB C 140 30.250 30.250 30.592 -0.342 25155 4965 1 6 . 1 1 140 140 VAL H H 140 7.550 7.550 8.458 -0.908 25155 4966 1 6 . 1 1 141 141 GLY N N 141 106.600 106.600 107.621 -1.021 25155 4967 1 6 . 1 1 141 141 GLY C C 141 171.350 171.350 172.660 -1.310 25155 4968 1 6 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.887 0.573 25155 4969 1 6 . 1 1 141 141 GLY H H 141 7.052 7.052 7.312 -0.260 25155 4970 1 6 . 1 1 142 142 LEU N N 142 117.820 117.820 120.093 -2.273 25155 4971 1 6 . 1 1 142 142 LEU HA H 142 4.962 4.962 3.934 1.028 25155 4972 1 6 . 1 1 142 142 LEU CA C 142 55.600 55.600 54.011 1.589 25155 4973 1 6 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.453 -4.523 25155 4974 1 6 . 1 1 142 142 LEU H H 142 7.643 7.643 8.167 -0.524 25155 4975 1 6 . 1 1 143 143 ALA HA H 143 4.220 4.220 3.727 0.493 25155 4976 1 6 . 1 1 143 143 ALA C C 143 175.505 175.505 175.747 -0.242 25155 4977 1 6 . 1 1 143 143 ALA CA C 143 49.600 49.600 50.568 -0.968 25155 4978 1 6 . 1 1 143 143 ALA CB C 143 23.330 23.330 18.169 5.161 25155 4979 1 6 . 1 1 144 144 LEU N N 144 124.960 124.960 122.859 2.101 25155 4980 1 6 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.487 0.293 25155 4981 1 6 . 1 1 144 144 LEU C C 144 174.700 174.700 175.210 -0.510 25155 4982 1 6 . 1 1 144 144 LEU CA C 144 52.790 52.790 53.345 -0.555 25155 4983 1 6 . 1 1 144 144 LEU CB C 144 45.300 45.300 44.813 0.486 25155 4984 1 6 . 1 1 144 144 LEU H H 144 8.583 8.583 7.783 0.800 25155 4985 1 6 . 1 1 145 145 ASP N N 145 119.100 119.100 119.560 -0.460 25155 4986 1 6 . 1 1 145 145 ASP HA H 145 5.422 5.422 5.349 0.073 25155 4987 1 6 . 1 1 145 145 ASP C C 145 176.180 176.180 175.179 1.001 25155 4988 1 6 . 1 1 145 145 ASP CA C 145 53.600 53.600 52.767 0.833 25155 4989 1 6 . 1 1 145 145 ASP CB C 145 43.180 43.180 44.094 -0.914 25155 4990 1 6 . 1 1 147 147 THR HA H 147 4.093 4.093 4.657 -0.564 25155 4991 1 6 . 1 1 147 147 THR C C 147 175.858 175.858 174.807 1.051 25155 4992 1 6 . 1 1 147 147 THR CA C 147 66.400 66.400 63.387 3.013 25155 4993 1 6 . 1 1 147 147 THR CB C 147 69.400 69.400 71.018 -1.618 25155 4994 1 6 . 1 1 147 147 THR H H 147 8.745 8.745 8.791 -0.046 25155 4995 1 6 . 1 1 148 148 ASN N N 148 115.408 115.408 118.954 -3.546 25155 4996 1 6 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.697 0.313 25155 4997 1 6 . 1 1 148 148 ASN C C 148 175.750 175.750 174.451 1.299 25155 4998 1 6 . 1 1 148 148 ASN CA C 148 53.400 53.400 54.846 -1.446 25155 4999 1 6 . 1 1 148 148 ASN CB C 148 41.900 41.900 39.547 2.353 25155 5000 1 6 . 1 1 148 148 ASN H H 148 8.975 8.975 8.804 0.171 25155 5001 1 6 . 1 1 149 149 GLN N N 149 117.900 117.900 117.457 0.443 25155 5002 1 6 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.560 0.376 25155 5003 1 6 . 1 1 149 149 GLN C C 149 178.280 178.280 174.628 3.652 25155 5004 1 6 . 1 1 149 149 GLN CA C 149 53.730 53.730 55.100 -1.370 25155 5005 1 6 . 1 1 149 149 GLN CB C 149 29.790 29.790 30.684 -0.894 25155 5006 1 6 . 1 1 149 149 GLN H H 149 7.430 7.430 7.706 -0.276 25155 5007 1 6 . 1 1 150 150 TYR N N 150 121.060 121.060 123.653 -2.593 25155 5008 1 6 . 1 1 150 150 TYR HA H 150 4.671 4.671 4.735 -0.064 25155 5009 1 6 . 1 1 150 150 TYR C C 150 178.680 178.680 177.703 0.977 25155 5010 1 6 . 1 1 150 150 TYR CA C 150 57.930 57.930 59.136 -1.206 25155 5011 1 6 . 1 1 150 150 TYR CB C 150 38.860 38.860 39.243 -0.383 25155 5012 1 6 . 1 1 150 150 TYR H H 150 8.115 8.115 8.835 -0.720 25155 5013 1 6 . 1 1 151 151 ASP N N 151 121.175 121.175 121.575 -0.400 25155 5014 1 6 . 1 1 151 151 ASP CA C 151 57.000 57.000 56.725 0.275 25155 5015 1 6 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.579 1.421 25155 5016 1 6 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.600 -0.010 25155 5017 1 6 . 1 1 152 152 LEU C C 152 178.300 178.300 177.506 0.794 25155 5018 1 6 . 1 1 152 152 LEU CA C 152 54.788 54.788 55.650 -0.862 25155 5019 1 6 . 1 1 152 152 LEU CB C 152 42.200 42.200 41.744 0.456 25155 5020 1 6 . 1 1 153 153 SER N N 153 116.170 116.170 118.403 -2.233 25155 5021 1 6 . 1 1 153 153 SER HA H 153 3.911 3.911 3.991 -0.080 25155 5022 1 6 . 1 1 153 153 SER CA C 153 63.400 63.400 62.225 1.175 25155 5023 1 6 . 1 1 153 153 SER CB C 153 63.200 63.200 62.989 0.212 25155 5024 1 6 . 1 1 153 153 SER H H 153 7.378 7.378 7.738 -0.360 25155 5025 1 6 . 1 1 154 154 ASP N N 154 121.640 121.640 120.794 0.846 25155 5026 1 6 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.334 -0.094 25155 5027 1 6 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.624 1.676 25155 5028 1 6 . 1 1 154 154 ASP CB C 154 40.000 40.000 40.943 -0.943 25155 5029 1 6 . 1 1 155 155 GLU HA H 155 4.170 4.170 4.043 0.127 25155 5030 1 6 . 1 1 155 155 GLU C C 155 179.420 179.420 178.948 0.472 25155 5031 1 6 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.346 -0.145 25155 5032 1 6 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.567 -0.087 25155 5033 1 6 . 1 1 156 156 ARG N N 156 121.230 121.230 118.970 2.260 25155 5034 1 6 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.231 0.045 25155 5035 1 6 . 1 1 156 156 ARG C C 156 177.350 177.350 179.440 -2.090 25155 5036 1 6 . 1 1 156 156 ARG CA C 156 59.950 59.950 59.477 0.473 25155 5037 1 6 . 1 1 156 156 ARG CB C 156 31.100 31.100 30.264 0.836 25155 5038 1 6 . 1 1 157 157 ILE N N 157 118.190 118.190 119.718 -1.528 25155 5039 1 6 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.685 -0.255 25155 5040 1 6 . 1 1 157 157 ILE C C 157 178.480 178.480 177.757 0.723 25155 5041 1 6 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.327 1.233 25155 5042 1 6 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.946 0.534 25155 5043 1 6 . 1 1 157 157 ILE H H 157 8.705 8.705 8.324 0.381 25155 5044 1 6 . 1 1 158 158 GLN N N 158 119.975 119.975 120.608 -0.633 25155 5045 1 6 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.905 0.051 25155 5046 1 6 . 1 1 158 158 GLN C C 158 178.730 178.730 178.286 0.444 25155 5047 1 6 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.319 1.381 25155 5048 1 6 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.306 0.176 25155 5049 1 6 . 1 1 158 158 GLN H H 158 8.262 8.262 8.505 -0.243 25155 5050 1 6 . 1 1 159 159 SER N N 159 115.466 115.466 115.290 0.176 25155 5051 1 6 . 1 1 159 159 SER HA H 159 4.446 4.446 4.285 0.161 25155 5052 1 6 . 1 1 159 159 SER C C 159 177.320 177.320 176.811 0.509 25155 5053 1 6 . 1 1 159 159 SER CA C 159 63.500 63.500 61.167 2.333 25155 5054 1 6 . 1 1 159 159 SER CB C 159 63.818 63.818 63.180 0.638 25155 5055 1 6 . 1 1 159 159 SER H H 159 8.440 8.440 8.122 0.318 25155 5056 1 6 . 1 1 160 160 TRP N N 160 126.784 126.784 124.823 1.961 25155 5057 1 6 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.447 0.007 25155 5058 1 6 . 1 1 160 160 TRP C C 160 177.934 177.934 177.751 0.183 25155 5059 1 6 . 1 1 160 160 TRP CA C 160 62.745 62.745 62.155 0.590 25155 5060 1 6 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.402 -0.052 25155 5061 1 6 . 1 1 160 160 TRP H H 160 9.243 9.243 7.694 1.549 25155 5062 1 6 . 1 1 161 161 CYS N N 161 116.395 116.395 119.030 -2.635 25155 5063 1 6 . 1 1 161 161 CYS HA H 161 3.886 3.886 3.809 0.077 25155 5064 1 6 . 1 1 161 161 CYS C C 161 176.245 176.245 177.012 -0.767 25155 5065 1 6 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.865 0.435 25155 5066 1 6 . 1 1 161 161 CYS CB C 161 27.723 27.723 27.005 0.718 25155 5067 1 6 . 1 1 161 161 CYS H H 161 8.845 8.845 9.106 -0.261 25155 5068 1 6 . 1 1 162 162 GLU N N 162 118.030 118.030 119.348 -1.318 25155 5069 1 6 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.873 0.047 25155 5070 1 6 . 1 1 162 162 GLU C C 162 178.700 178.700 178.776 -0.076 25155 5071 1 6 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.537 0.263 25155 5072 1 6 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.235 0.265 25155 5073 1 6 . 1 1 163 163 GLN N N 163 120.650 120.650 119.689 0.961 25155 5074 1 6 . 1 1 163 163 GLN HA H 163 4.173 4.173 4.026 0.147 25155 5075 1 6 . 1 1 163 163 GLN C C 163 179.700 179.700 178.432 1.268 25155 5076 1 6 . 1 1 163 163 GLN CA C 163 59.688 59.688 58.976 0.712 25155 5077 1 6 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.734 0.166 25155 5078 1 6 . 1 1 163 163 GLN H H 163 8.148 8.148 7.778 0.370 25155 5079 1 6 . 1 1 164 164 ILE N N 164 114.836 114.836 117.221 -2.385 25155 5080 1 6 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.582 0.478 25155 5081 1 6 . 1 1 164 164 ILE C C 164 178.676 178.676 177.708 0.968 25155 5082 1 6 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.418 1.742 25155 5083 1 6 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.341 0.289 25155 5084 1 6 . 1 1 164 164 ILE H H 164 8.958 8.958 8.178 0.780 25155 5085 1 6 . 1 1 165 165 LEU N N 165 123.700 123.700 119.682 4.018 25155 5086 1 6 . 1 1 165 165 LEU HA H 165 4.100 4.100 4.063 0.037 25155 5087 1 6 . 1 1 165 165 LEU C C 165 180.548 180.548 178.457 2.091 25155 5088 1 6 . 1 1 165 165 LEU CA C 165 58.150 58.150 58.169 -0.018 25155 5089 1 6 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.496 -0.366 25155 5090 1 6 . 1 1 165 165 LEU H H 165 7.830 7.830 8.018 -0.188 25155 5091 1 6 . 1 1 166 166 ASN N N 166 120.160 120.160 118.550 1.610 25155 5092 1 6 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.361 0.209 25155 5093 1 6 . 1 1 166 166 ASN C C 166 175.690 175.690 177.402 -1.712 25155 5094 1 6 . 1 1 166 166 ASN CA C 166 55.946 55.946 56.855 -0.909 25155 5095 1 6 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.324 0.156 25155 5096 1 6 . 1 1 166 166 ASN H H 166 7.706 7.706 7.924 -0.218 25155 5097 1 6 . 1 1 167 167 GLU N N 167 121.286 121.286 121.276 0.010 25155 5098 1 6 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.015 0.089 25155 5099 1 6 . 1 1 167 167 GLU C C 167 180.520 180.520 179.226 1.294 25155 5100 1 6 . 1 1 167 167 GLU CA C 167 59.920 59.920 59.244 0.676 25155 5101 1 6 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.710 1.215 25155 5102 1 6 . 1 1 168 168 MET N N 168 118.622 118.622 115.148 3.474 25155 5103 1 6 . 1 1 168 168 MET HA H 168 3.996 3.996 4.191 -0.195 25155 5104 1 6 . 1 1 168 168 MET C C 168 176.856 176.856 177.459 -0.603 25155 5105 1 6 . 1 1 168 168 MET CA C 168 59.500 59.500 58.349 1.151 25155 5106 1 6 . 1 1 168 168 MET CB C 168 33.700 33.700 32.604 1.096 25155 5107 1 6 . 1 1 168 168 MET H H 168 8.723 8.723 8.316 0.407 25155 5108 1 6 . 1 1 169 169 ALA N N 169 121.760 121.760 122.654 -0.894 25155 5109 1 6 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.277 -0.121 25155 5110 1 6 . 1 1 169 169 ALA C C 169 179.790 179.790 180.215 -0.425 25155 5111 1 6 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.102 0.698 25155 5112 1 6 . 1 1 169 169 ALA CB C 169 18.220 18.220 18.994 -0.774 25155 5113 1 6 . 1 1 169 169 ALA H H 169 7.494 7.494 7.607 -0.113 25155 5114 1 6 . 1 1 170 170 GLU N N 170 116.970 116.970 119.035 -2.065 25155 5115 1 6 . 1 1 170 170 GLU HA H 170 4.091 4.091 4.007 0.084 25155 5116 1 6 . 1 1 170 170 GLU C C 170 177.745 177.745 179.121 -1.376 25155 5117 1 6 . 1 1 170 170 GLU CA C 170 58.000 58.000 59.046 -1.046 25155 5118 1 6 . 1 1 170 170 GLU CB C 170 29.730 29.730 29.386 0.344 25155 5119 1 6 . 1 1 171 171 HIS N N 171 118.150 118.150 118.937 -0.787 25155 5120 1 6 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.267 0.203 25155 5121 1 6 . 1 1 171 171 HIS C C 171 175.848 175.848 176.174 -0.326 25155 5122 1 6 . 1 1 171 171 HIS CA C 171 57.600 57.600 58.447 -0.847 25155 5123 1 6 . 1 1 171 171 HIS CB C 171 30.800 30.800 29.598 1.202 25155 5124 1 6 . 1 1 171 171 HIS H H 171 7.717 7.717 7.771 -0.054 25155 5125 1 6 . 1 1 172 172 TYR N N 172 119.483 119.483 117.355 2.128 25155 5126 1 6 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.579 0.012 25155 5127 1 6 . 1 1 172 172 TYR C C 172 174.590 174.590 175.536 -0.946 25155 5128 1 6 . 1 1 172 172 TYR CA C 172 57.813 57.813 56.844 0.969 25155 5129 1 6 . 1 1 172 172 TYR CB C 172 38.900 38.900 38.057 0.843 25155 5130 1 6 . 1 1 172 172 TYR H H 172 7.778 7.778 7.771 0.007 25155 5131 1 7 . 1 1 2 2 ASN N N 2 122.966 122.966 119.795 3.171 25155 5132 1 7 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.210 -0.035 25155 5133 1 7 . 1 1 2 2 ASN C C 2 175.200 175.200 174.118 1.082 25155 5134 1 7 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.557 0.363 25155 5135 1 7 . 1 1 2 2 ASN CB C 2 40.000 40.000 40.931 -0.931 25155 5136 1 7 . 1 1 2 2 ASN H H 2 9.392 9.392 8.379 1.013 25155 5137 1 7 . 1 1 3 3 MET N N 3 120.660 120.660 120.715 -0.055 25155 5138 1 7 . 1 1 3 3 MET HA H 3 5.565 5.565 5.078 0.487 25155 5139 1 7 . 1 1 3 3 MET C C 3 174.200 174.200 175.398 -1.198 25155 5140 1 7 . 1 1 3 3 MET CA C 3 54.550 54.550 54.183 0.367 25155 5141 1 7 . 1 1 3 3 MET CB C 3 34.100 34.100 35.277 -1.177 25155 5142 1 7 . 1 1 3 3 MET H H 3 8.745 8.745 8.787 -0.042 25155 5143 1 7 . 1 1 4 4 GLY N N 4 115.792 115.792 109.836 5.956 25155 5144 1 7 . 1 1 4 4 GLY C C 4 170.444 170.444 171.953 -1.509 25155 5145 1 7 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.402 -0.515 25155 5146 1 7 . 1 1 4 4 GLY H H 4 8.989 8.989 8.713 0.276 25155 5147 1 7 . 1 1 5 5 LEU N N 5 131.175 131.175 125.319 5.856 25155 5148 1 7 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.296 1.026 25155 5149 1 7 . 1 1 5 5 LEU C C 5 175.700 175.700 174.629 1.071 25155 5150 1 7 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.533 -0.213 25155 5151 1 7 . 1 1 5 5 LEU CB C 5 44.700 44.700 43.754 0.946 25155 5152 1 7 . 1 1 5 5 LEU H H 5 8.917 8.917 8.180 0.737 25155 5153 1 7 . 1 1 6 6 PHE N N 6 125.990 125.990 124.936 1.054 25155 5154 1 7 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.714 0.024 25155 5155 1 7 . 1 1 6 6 PHE C C 6 174.358 174.358 173.456 0.902 25155 5156 1 7 . 1 1 6 6 PHE CA C 6 55.480 55.480 54.895 0.585 25155 5157 1 7 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.865 -0.815 25155 5158 1 7 . 1 1 6 6 PHE H H 6 9.225 9.225 9.133 0.092 25155 5159 1 7 . 1 1 7 7 TYR N N 7 118.040 118.040 116.750 1.290 25155 5160 1 7 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.642 0.287 25155 5161 1 7 . 1 1 7 7 TYR C C 7 171.690 171.690 175.296 -3.606 25155 5162 1 7 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.621 -1.161 25155 5163 1 7 . 1 1 7 7 TYR CB C 7 40.800 40.800 39.990 0.810 25155 5164 1 7 . 1 1 7 7 TYR H H 7 8.235 8.235 7.931 0.304 25155 5165 1 7 . 1 1 8 8 GLY N N 8 106.640 106.640 108.391 -1.751 25155 5166 1 7 . 1 1 8 8 GLY C C 8 171.682 171.682 173.852 -2.170 25155 5167 1 7 . 1 1 8 8 GLY CA C 8 44.050 44.050 45.581 -1.532 25155 5168 1 7 . 1 1 8 8 GLY H H 8 6.996 6.996 9.153 -2.157 25155 5169 1 7 . 1 1 9 9 SER N N 9 118.164 118.164 116.672 1.492 25155 5170 1 7 . 1 1 9 9 SER C C 9 174.560 174.560 176.026 -1.466 25155 5171 1 7 . 1 1 9 9 SER CA C 9 57.140 57.140 57.500 -0.360 25155 5172 1 7 . 1 1 9 9 SER H H 9 9.680 9.680 7.671 2.009 25155 5173 1 7 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.922 -0.292 25155 5174 1 7 . 1 1 17 17 ALA C C 17 177.740 177.740 179.225 -1.485 25155 5175 1 7 . 1 1 17 17 ALA CA C 17 54.900 54.900 55.114 -0.213 25155 5176 1 7 . 1 1 17 17 ALA CB C 17 17.790 17.790 17.822 -0.032 25155 5177 1 7 . 1 1 17 17 ALA H H 17 8.055 8.055 7.479 0.576 25155 5178 1 7 . 1 1 18 18 ALA N N 18 120.026 120.026 121.130 -1.104 25155 5179 1 7 . 1 1 18 18 ALA HA H 18 3.713 3.713 3.709 0.004 25155 5180 1 7 . 1 1 18 18 ALA C C 18 179.040 179.040 179.400 -0.360 25155 5181 1 7 . 1 1 18 18 ALA CA C 18 54.860 54.860 55.168 -0.308 25155 5182 1 7 . 1 1 18 18 ALA CB C 18 18.200 18.200 18.158 0.042 25155 5183 1 7 . 1 1 18 18 ALA H H 18 7.015 7.015 8.287 -1.272 25155 5184 1 7 . 1 1 19 19 GLU N N 19 116.656 116.656 118.410 -1.754 25155 5185 1 7 . 1 1 19 19 GLU HA H 19 3.580 3.580 3.931 -0.351 25155 5186 1 7 . 1 1 19 19 GLU C C 19 178.487 178.487 179.522 -1.035 25155 5187 1 7 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.758 -0.089 25155 5188 1 7 . 1 1 19 19 GLU CB C 19 29.400 29.400 29.488 -0.088 25155 5189 1 7 . 1 1 20 20 LYS N N 20 120.100 120.100 120.294 -0.194 25155 5190 1 7 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.062 0.284 25155 5191 1 7 . 1 1 20 20 LYS C C 20 175.330 175.330 179.057 -3.727 25155 5192 1 7 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.496 -2.396 25155 5193 1 7 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.538 0.462 25155 5194 1 7 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.784 -0.319 25155 5195 1 7 . 1 1 21 21 ILE C C 21 177.680 177.680 178.208 -0.528 25155 5196 1 7 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.383 0.257 25155 5197 1 7 . 1 1 21 21 ILE CB C 21 38.030 38.030 37.897 0.133 25155 5198 1 7 . 1 1 21 21 ILE H H 21 8.220 8.220 8.563 -0.343 25155 5199 1 7 . 1 1 22 22 ARG N N 22 119.433 119.433 118.485 0.948 25155 5200 1 7 . 1 1 22 22 ARG HA H 22 3.550 3.550 4.041 -0.491 25155 5201 1 7 . 1 1 22 22 ARG C C 22 177.268 177.268 178.279 -1.011 25155 5202 1 7 . 1 1 22 22 ARG CA C 22 59.760 59.760 58.680 1.080 25155 5203 1 7 . 1 1 22 22 ARG CB C 22 28.900 28.900 29.022 -0.122 25155 5204 1 7 . 1 1 23 23 ASP N N 23 118.945 118.945 120.018 -1.073 25155 5205 1 7 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.443 -0.101 25155 5206 1 7 . 1 1 23 23 ASP C C 23 178.470 178.470 178.613 -0.143 25155 5207 1 7 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.181 0.269 25155 5208 1 7 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.927 -0.557 25155 5209 1 7 . 1 1 24 24 ILE N N 24 121.200 121.200 119.241 1.959 25155 5210 1 7 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.859 -0.125 25155 5211 1 7 . 1 1 24 24 ILE C C 24 178.297 178.297 177.923 0.374 25155 5212 1 7 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.584 -0.084 25155 5213 1 7 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.607 0.133 25155 5214 1 7 . 1 1 24 24 ILE H H 24 8.160 8.160 8.041 0.119 25155 5215 1 7 . 1 1 25 25 ILE N N 25 121.166 121.166 117.495 3.671 25155 5216 1 7 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.898 -0.255 25155 5217 1 7 . 1 1 25 25 ILE C C 25 176.825 176.825 176.766 0.059 25155 5218 1 7 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.350 2.539 25155 5219 1 7 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.798 -1.048 25155 5220 1 7 . 1 1 25 25 ILE H H 25 8.480 8.480 8.143 0.337 25155 5221 1 7 . 1 1 26 26 GLY N N 26 109.050 109.050 104.805 4.245 25155 5222 1 7 . 1 1 26 26 GLY C C 26 173.800 173.800 172.617 1.183 25155 5223 1 7 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.502 -0.102 25155 5224 1 7 . 1 1 26 26 GLY H H 26 7.945 7.945 7.722 0.223 25155 5225 1 7 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.433 -0.070 25155 5226 1 7 . 1 1 27 27 PRO C C 27 177.157 177.157 177.058 0.099 25155 5227 1 7 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.829 0.701 25155 5228 1 7 . 1 1 27 27 PRO CB C 27 32.000 32.000 32.201 -0.201 25155 5229 1 7 . 1 1 28 28 GLU N N 28 116.510 116.510 116.707 -0.197 25155 5230 1 7 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.213 0.047 25155 5231 1 7 . 1 1 28 28 GLU C C 28 177.000 177.000 177.023 -0.023 25155 5232 1 7 . 1 1 28 28 GLU CA C 28 57.680 57.680 57.863 -0.183 25155 5233 1 7 . 1 1 28 28 GLU CB C 28 28.620 28.620 29.148 -0.528 25155 5234 1 7 . 1 1 29 29 LEU N N 29 120.334 120.334 113.086 7.248 25155 5235 1 7 . 1 1 29 29 LEU HA H 29 4.650 4.650 4.990 -0.340 25155 5236 1 7 . 1 1 29 29 LEU C C 29 175.676 175.676 175.008 0.668 25155 5237 1 7 . 1 1 29 29 LEU CA C 29 55.924 55.924 54.842 1.082 25155 5238 1 7 . 1 1 29 29 LEU CB C 29 44.880 44.880 44.601 0.279 25155 5239 1 7 . 1 1 29 29 LEU H H 29 7.924 7.924 7.567 0.357 25155 5240 1 7 . 1 1 30 30 VAL N N 30 118.900 118.900 120.355 -1.455 25155 5241 1 7 . 1 1 30 30 VAL HA H 30 4.639 4.639 4.868 -0.229 25155 5242 1 7 . 1 1 30 30 VAL C C 30 174.368 174.368 175.172 -0.804 25155 5243 1 7 . 1 1 30 30 VAL CA C 30 61.110 61.110 60.480 0.631 25155 5244 1 7 . 1 1 30 30 VAL CB C 30 34.500 34.500 35.096 -0.596 25155 5245 1 7 . 1 1 30 30 VAL H H 30 7.486 7.486 7.341 0.145 25155 5246 1 7 . 1 1 31 31 THR N N 31 124.000 124.000 120.942 3.058 25155 5247 1 7 . 1 1 31 31 THR HA H 31 4.331 4.331 4.708 -0.377 25155 5248 1 7 . 1 1 31 31 THR C C 31 172.670 172.670 173.410 -0.740 25155 5249 1 7 . 1 1 31 31 THR CA C 31 61.784 61.784 60.987 0.797 25155 5250 1 7 . 1 1 31 31 THR CB C 31 70.483 70.483 71.109 -0.626 25155 5251 1 7 . 1 1 31 31 THR H H 31 7.947 7.947 8.772 -0.825 25155 5252 1 7 . 1 1 32 32 LEU N N 32 127.408 127.408 126.112 1.296 25155 5253 1 7 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.500 0.137 25155 5254 1 7 . 1 1 32 32 LEU C C 32 176.425 176.425 177.101 -0.676 25155 5255 1 7 . 1 1 32 32 LEU CA C 32 54.760 54.760 55.211 -0.451 25155 5256 1 7 . 1 1 32 32 LEU CB C 32 43.809 43.809 42.648 1.161 25155 5257 1 7 . 1 1 32 32 LEU H H 32 8.614 8.614 8.710 -0.096 25155 5258 1 7 . 1 1 33 33 HIS N N 33 120.230 120.230 124.898 -4.668 25155 5259 1 7 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.952 -0.532 25155 5260 1 7 . 1 1 33 33 HIS C C 33 171.914 171.914 174.036 -2.122 25155 5261 1 7 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.584 0.716 25155 5262 1 7 . 1 1 33 33 HIS CB C 33 32.050 32.050 30.212 1.838 25155 5263 1 7 . 1 1 33 33 HIS H H 33 9.130 9.130 9.130 0.000 25155 5264 1 7 . 1 1 34 34 ASN N N 34 123.987 123.987 121.374 2.613 25155 5265 1 7 . 1 1 34 34 ASN HA H 34 3.600 3.600 3.921 -0.321 25155 5266 1 7 . 1 1 34 34 ASN C C 34 177.930 177.930 175.554 2.376 25155 5267 1 7 . 1 1 34 34 ASN CA C 34 51.730 51.730 52.267 -0.537 25155 5268 1 7 . 1 1 34 34 ASN CB C 34 38.747 38.747 38.244 0.503 25155 5269 1 7 . 1 1 34 34 ASN H H 34 8.759 8.759 8.043 0.716 25155 5270 1 7 . 1 1 35 35 LEU N N 35 128.751 128.751 126.544 2.207 25155 5271 1 7 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.213 0.077 25155 5272 1 7 . 1 1 35 35 LEU C C 35 177.363 177.363 178.071 -0.708 25155 5273 1 7 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.138 0.412 25155 5274 1 7 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.484 1.278 25155 5275 1 7 . 1 1 35 35 LEU H H 35 8.758 8.758 8.609 0.149 25155 5276 1 7 . 1 1 36 36 LYS N N 36 120.870 120.870 117.985 2.885 25155 5277 1 7 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.215 -0.282 25155 5278 1 7 . 1 1 36 36 LYS C C 36 176.540 176.540 176.937 -0.397 25155 5279 1 7 . 1 1 36 36 LYS CA C 36 59.260 59.260 58.097 1.163 25155 5280 1 7 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.375 0.425 25155 5281 1 7 . 1 1 37 37 ASP N N 37 115.288 115.288 116.341 -1.053 25155 5282 1 7 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.707 0.040 25155 5283 1 7 . 1 1 37 37 ASP C C 37 175.500 175.500 176.055 -0.555 25155 5284 1 7 . 1 1 37 37 ASP CA C 37 54.805 54.805 54.604 0.201 25155 5285 1 7 . 1 1 37 37 ASP CB C 37 44.650 44.650 43.629 1.021 25155 5286 1 7 . 1 1 38 38 ASP N N 38 121.550 121.550 121.087 0.463 25155 5287 1 7 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.899 -0.034 25155 5288 1 7 . 1 1 38 38 ASP C C 38 174.895 174.895 175.923 -1.028 25155 5289 1 7 . 1 1 38 38 ASP CA C 38 52.840 52.840 54.111 -1.271 25155 5290 1 7 . 1 1 38 38 ASP CB C 38 42.240 42.240 42.509 -0.269 25155 5291 1 7 . 1 1 39 39 SER N N 39 115.170 115.170 117.513 -2.343 25155 5292 1 7 . 1 1 39 39 SER HA H 39 4.600 4.600 4.692 -0.092 25155 5293 1 7 . 1 1 39 39 SER C C 39 174.930 174.930 174.380 0.550 25155 5294 1 7 . 1 1 39 39 SER CA C 39 54.786 54.786 56.651 -1.865 25155 5295 1 7 . 1 1 39 39 SER CB C 39 64.840 64.840 63.471 1.369 25155 5296 1 7 . 1 1 39 39 SER H H 39 8.330 8.330 8.647 -0.317 25155 5297 1 7 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.470 -0.470 25155 5298 1 7 . 1 1 40 40 PRO C C 40 176.620 176.620 178.269 -1.649 25155 5299 1 7 . 1 1 40 40 PRO CA C 40 63.870 63.870 64.911 -1.041 25155 5300 1 7 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.901 -0.541 25155 5301 1 7 . 1 1 41 41 LYS N N 41 120.913 120.913 118.347 2.566 25155 5302 1 7 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.110 -0.214 25155 5303 1 7 . 1 1 41 41 LYS C C 41 179.580 179.580 178.562 1.018 25155 5304 1 7 . 1 1 41 41 LYS CA C 41 58.000 58.000 58.925 -0.925 25155 5305 1 7 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.027 1.073 25155 5306 1 7 . 1 1 42 42 LEU N N 42 118.206 118.206 120.779 -2.573 25155 5307 1 7 . 1 1 42 42 LEU HA H 42 4.025 4.025 3.912 0.113 25155 5308 1 7 . 1 1 42 42 LEU C C 42 178.630 178.630 178.729 -0.099 25155 5309 1 7 . 1 1 42 42 LEU CA C 42 57.030 57.030 57.481 -0.451 25155 5310 1 7 . 1 1 42 42 LEU CB C 42 41.820 41.820 41.122 0.698 25155 5311 1 7 . 1 1 42 42 LEU H H 42 7.598 7.598 7.551 0.047 25155 5312 1 7 . 1 1 43 43 MET N N 43 118.913 118.913 116.169 2.744 25155 5313 1 7 . 1 1 43 43 MET HA H 43 3.760 3.760 4.067 -0.307 25155 5314 1 7 . 1 1 43 43 MET C C 43 177.710 177.710 177.118 0.592 25155 5315 1 7 . 1 1 43 43 MET CA C 43 59.864 59.864 58.136 1.728 25155 5316 1 7 . 1 1 43 43 MET CB C 43 32.680 32.680 32.080 0.600 25155 5317 1 7 . 1 1 43 43 MET H H 43 8.180 8.180 8.041 0.139 25155 5318 1 7 . 1 1 44 44 GLU N N 44 110.906 110.906 116.614 -5.708 25155 5319 1 7 . 1 1 44 44 GLU HA H 44 3.732 3.732 4.021 -0.289 25155 5320 1 7 . 1 1 44 44 GLU C C 44 178.120 178.120 179.407 -1.287 25155 5321 1 7 . 1 1 44 44 GLU CA C 44 59.450 59.450 58.566 0.884 25155 5322 1 7 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.606 0.194 25155 5323 1 7 . 1 1 45 45 GLN N N 45 115.770 115.770 118.133 -2.363 25155 5324 1 7 . 1 1 45 45 GLN HA H 45 4.190 4.190 3.922 0.268 25155 5325 1 7 . 1 1 45 45 GLN C C 45 175.480 175.480 176.267 -0.787 25155 5326 1 7 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.405 -1.305 25155 5327 1 7 . 1 1 45 45 GLN CB C 45 28.490 28.490 28.604 -0.114 25155 5328 1 7 . 1 1 45 45 GLN H H 45 7.517 7.517 7.410 0.107 25155 5329 1 7 . 1 1 46 46 TYR N N 46 117.840 117.840 117.803 0.037 25155 5330 1 7 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.473 0.187 25155 5331 1 7 . 1 1 46 46 TYR C C 46 175.480 175.480 176.707 -1.227 25155 5332 1 7 . 1 1 46 46 TYR CA C 46 58.827 58.827 57.936 0.891 25155 5333 1 7 . 1 1 46 46 TYR CB C 46 41.720 41.720 38.590 3.130 25155 5334 1 7 . 1 1 46 46 TYR H H 46 6.955 6.955 7.234 -0.279 25155 5335 1 7 . 1 1 47 47 ASP N N 47 121.540 121.540 123.086 -1.546 25155 5336 1 7 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.619 0.077 25155 5337 1 7 . 1 1 47 47 ASP C C 47 175.677 175.677 175.824 -0.147 25155 5338 1 7 . 1 1 47 47 ASP CA C 47 56.812 56.812 56.879 -0.067 25155 5339 1 7 . 1 1 47 47 ASP CB C 47 42.978 42.978 41.779 1.199 25155 5340 1 7 . 1 1 48 48 VAL N N 48 118.666 118.666 117.173 1.493 25155 5341 1 7 . 1 1 48 48 VAL HA H 48 5.057 5.057 4.921 0.136 25155 5342 1 7 . 1 1 48 48 VAL C C 48 174.180 174.180 174.169 0.011 25155 5343 1 7 . 1 1 48 48 VAL CA C 48 60.000 60.000 61.362 -1.362 25155 5344 1 7 . 1 1 48 48 VAL CB C 48 36.200 36.200 33.995 2.205 25155 5345 1 7 . 1 1 48 48 VAL H H 48 7.631 7.631 7.425 0.206 25155 5346 1 7 . 1 1 49 49 LEU N N 49 128.300 128.300 128.126 0.174 25155 5347 1 7 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.156 0.444 25155 5348 1 7 . 1 1 49 49 LEU C C 49 174.810 174.810 174.747 0.063 25155 5349 1 7 . 1 1 49 49 LEU CA C 49 52.230 52.230 54.093 -1.863 25155 5350 1 7 . 1 1 49 49 LEU CB C 49 45.400 45.400 46.335 -0.935 25155 5351 1 7 . 1 1 49 49 LEU H H 49 9.469 9.469 8.997 0.472 25155 5352 1 7 . 1 1 50 50 ILE N N 50 124.400 124.400 126.833 -2.433 25155 5353 1 7 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.644 1.006 25155 5354 1 7 . 1 1 50 50 ILE C C 50 175.286 175.286 174.408 0.878 25155 5355 1 7 . 1 1 50 50 ILE CA C 50 59.900 59.900 61.193 -1.293 25155 5356 1 7 . 1 1 50 50 ILE CB C 50 40.200 40.200 39.797 0.403 25155 5357 1 7 . 1 1 50 50 ILE H H 50 9.213 9.213 9.239 -0.026 25155 5358 1 7 . 1 1 51 51 LEU N N 51 127.410 127.410 128.199 -0.789 25155 5359 1 7 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.140 1.930 25155 5360 1 7 . 1 1 51 51 LEU C C 51 174.540 174.540 175.802 -1.262 25155 5361 1 7 . 1 1 51 51 LEU CA C 51 52.950 52.950 53.329 -0.379 25155 5362 1 7 . 1 1 51 51 LEU CB C 51 43.190 43.190 43.678 -0.488 25155 5363 1 7 . 1 1 51 51 LEU H H 51 9.256 9.256 8.942 0.314 25155 5364 1 7 . 1 1 52 52 GLY N N 52 108.290 108.290 110.712 -2.422 25155 5365 1 7 . 1 1 52 52 GLY C C 52 174.330 174.330 171.915 2.415 25155 5366 1 7 . 1 1 52 52 GLY CA C 52 44.040 44.040 43.951 0.089 25155 5367 1 7 . 1 1 52 52 GLY H H 52 8.949 8.949 8.548 0.401 25155 5368 1 7 . 1 1 53 53 ILE N N 53 124.912 124.912 121.086 3.826 25155 5369 1 7 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.640 -0.465 25155 5370 1 7 . 1 1 53 53 ILE C C 53 174.470 174.470 173.164 1.306 25155 5371 1 7 . 1 1 53 53 ILE CA C 53 55.850 55.850 57.985 -2.135 25155 5372 1 7 . 1 1 53 53 ILE CB C 53 42.800 42.800 42.164 0.636 25155 5373 1 7 . 1 1 53 53 ILE H H 53 8.612 8.612 7.983 0.629 25155 5374 1 7 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.545 0.267 25155 5375 1 7 . 1 1 54 54 PRO C C 54 174.565 174.565 177.956 -3.391 25155 5376 1 7 . 1 1 54 54 PRO CA C 54 61.850 61.850 64.141 -2.291 25155 5377 1 7 . 1 1 54 54 PRO CB C 54 32.400 32.400 32.166 0.234 25155 5378 1 7 . 1 1 55 55 THR N N 55 116.040 116.040 110.520 5.520 25155 5379 1 7 . 1 1 55 55 THR HA H 55 4.522 4.522 3.681 0.841 25155 5380 1 7 . 1 1 55 55 THR C C 55 173.990 173.990 173.646 0.344 25155 5381 1 7 . 1 1 55 55 THR CA C 55 62.845 62.845 65.230 -2.385 25155 5382 1 7 . 1 1 55 55 THR CB C 55 70.795 70.795 68.028 2.767 25155 5383 1 7 . 1 1 55 55 THR H H 55 7.663 7.663 7.975 -0.312 25155 5384 1 7 . 1 1 56 56 TRP N N 56 130.540 130.540 119.953 10.587 25155 5385 1 7 . 1 1 56 56 TRP CA C 56 54.800 54.800 58.509 -3.709 25155 5386 1 7 . 1 1 56 56 TRP H H 56 9.075 9.075 8.094 0.981 25155 5387 1 7 . 1 1 58 58 PHE HA H 58 4.540 4.540 3.985 0.555 25155 5388 1 7 . 1 1 58 58 PHE C C 58 177.070 177.070 174.728 2.342 25155 5389 1 7 . 1 1 58 58 PHE CA C 58 55.460 55.460 58.288 -2.828 25155 5390 1 7 . 1 1 58 58 PHE CB C 58 41.200 41.200 38.239 2.961 25155 5391 1 7 . 1 1 59 59 GLY N N 59 109.796 109.796 106.384 3.412 25155 5392 1 7 . 1 1 59 59 GLY CA C 59 45.763 45.763 45.402 0.361 25155 5393 1 7 . 1 1 59 59 GLY H H 59 8.392 8.392 7.449 0.943 25155 5394 1 7 . 1 1 60 60 GLU C C 60 175.660 175.660 175.346 0.314 25155 5395 1 7 . 1 1 61 61 ILE N N 61 122.380 122.380 122.449 -0.069 25155 5396 1 7 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.595 0.845 25155 5397 1 7 . 1 1 61 61 ILE CA C 61 62.100 62.100 61.755 0.345 25155 5398 1 7 . 1 1 61 61 ILE CB C 61 38.750 38.750 37.765 0.985 25155 5399 1 7 . 1 1 61 61 ILE H H 61 8.436 8.436 8.101 0.335 25155 5400 1 7 . 1 1 62 62 GLN CB C 62 30.570 30.570 29.735 0.835 25155 5401 1 7 . 1 1 63 63 GLU HA H 63 4.030 4.030 4.009 0.021 25155 5402 1 7 . 1 1 63 63 GLU C C 63 177.134 177.134 178.149 -1.015 25155 5403 1 7 . 1 1 63 63 GLU CA C 63 60.520 60.520 60.074 0.446 25155 5404 1 7 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.561 0.089 25155 5405 1 7 . 1 1 64 64 ASP N N 64 119.630 119.630 118.037 1.593 25155 5406 1 7 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.462 0.130 25155 5407 1 7 . 1 1 64 64 ASP C C 64 178.680 178.680 177.348 1.332 25155 5408 1 7 . 1 1 64 64 ASP CA C 64 57.823 57.823 56.879 0.945 25155 5409 1 7 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.628 0.472 25155 5410 1 7 . 1 1 65 65 TRP N N 65 120.535 120.535 121.536 -1.001 25155 5411 1 7 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.589 -0.264 25155 5412 1 7 . 1 1 65 65 TRP C C 65 178.684 178.684 177.482 1.202 25155 5413 1 7 . 1 1 65 65 TRP CA C 65 60.500 60.500 60.760 -0.260 25155 5414 1 7 . 1 1 65 65 TRP CB C 65 30.100 30.100 31.047 -0.947 25155 5415 1 7 . 1 1 65 65 TRP H H 65 7.416 7.416 7.969 -0.553 25155 5416 1 7 . 1 1 66 66 GLU N N 66 120.760 120.760 121.014 -0.254 25155 5417 1 7 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.182 -0.362 25155 5418 1 7 . 1 1 66 66 GLU C C 66 178.860 178.860 178.837 0.023 25155 5419 1 7 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.846 0.254 25155 5420 1 7 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.520 -0.510 25155 5421 1 7 . 1 1 67 67 ALA N N 67 118.972 118.972 121.525 -2.553 25155 5422 1 7 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.211 0.036 25155 5423 1 7 . 1 1 67 67 ALA C C 67 179.610 179.610 178.958 0.652 25155 5424 1 7 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.779 -0.179 25155 5425 1 7 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.818 -0.030 25155 5426 1 7 . 1 1 67 67 ALA H H 67 7.690 7.690 8.466 -0.776 25155 5427 1 7 . 1 1 68 68 VAL N N 68 107.530 107.530 110.794 -3.264 25155 5428 1 7 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.184 0.526 25155 5429 1 7 . 1 1 68 68 VAL C C 68 176.800 176.800 176.679 0.121 25155 5430 1 7 . 1 1 68 68 VAL CA C 68 60.060 60.060 62.648 -2.588 25155 5431 1 7 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.669 -0.069 25155 5432 1 7 . 1 1 68 68 VAL H H 68 7.240 7.240 7.443 -0.203 25155 5433 1 7 . 1 1 69 69 TRP N N 69 126.960 126.960 124.603 2.357 25155 5434 1 7 . 1 1 69 69 TRP HA H 69 4.182 4.182 4.040 0.142 25155 5435 1 7 . 1 1 69 69 TRP C C 69 178.640 178.640 177.104 1.536 25155 5436 1 7 . 1 1 69 69 TRP CA C 69 61.300 61.300 62.868 -1.569 25155 5437 1 7 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.473 2.097 25155 5438 1 7 . 1 1 69 69 TRP H H 69 7.810 7.810 8.483 -0.673 25155 5439 1 7 . 1 1 70 70 ASP N N 70 114.644 114.644 117.053 -2.409 25155 5440 1 7 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.241 0.278 25155 5441 1 7 . 1 1 70 70 ASP C C 70 178.685 178.685 177.898 0.787 25155 5442 1 7 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.676 -0.676 25155 5443 1 7 . 1 1 70 70 ASP CB C 70 39.810 39.810 41.008 -1.198 25155 5444 1 7 . 1 1 71 71 GLN N N 71 120.100 120.100 116.888 3.212 25155 5445 1 7 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.221 -0.031 25155 5446 1 7 . 1 1 71 71 GLN C C 71 178.870 178.870 178.047 0.823 25155 5447 1 7 . 1 1 71 71 GLN CA C 71 57.617 57.617 57.530 0.087 25155 5448 1 7 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.682 -0.862 25155 5449 1 7 . 1 1 71 71 GLN H H 71 7.980 7.980 7.850 0.130 25155 5450 1 7 . 1 1 72 72 LEU N N 72 117.535 117.535 119.280 -1.745 25155 5451 1 7 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.956 -0.159 25155 5452 1 7 . 1 1 72 72 LEU C C 72 178.308 178.308 178.168 0.140 25155 5453 1 7 . 1 1 72 72 LEU CA C 72 57.340 57.340 57.270 0.070 25155 5454 1 7 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.553 0.147 25155 5455 1 7 . 1 1 72 72 LEU H H 72 7.435 7.435 8.108 -0.673 25155 5456 1 7 . 1 1 73 73 ASP N N 73 115.534 115.534 117.005 -1.471 25155 5457 1 7 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.370 -0.220 25155 5458 1 7 . 1 1 73 73 ASP C C 73 177.553 177.553 176.818 0.735 25155 5459 1 7 . 1 1 73 73 ASP CA C 73 57.350 57.350 56.309 1.041 25155 5460 1 7 . 1 1 73 73 ASP CB C 73 40.040 40.040 41.582 -1.542 25155 5461 1 7 . 1 1 74 74 ASP N N 74 117.300 117.300 120.017 -2.717 25155 5462 1 7 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.546 0.160 25155 5463 1 7 . 1 1 74 74 ASP C C 74 176.424 176.424 177.271 -0.847 25155 5464 1 7 . 1 1 74 74 ASP CA C 74 54.170 54.170 55.344 -1.174 25155 5465 1 7 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.504 0.316 25155 5466 1 7 . 1 1 75 75 LEU N N 75 118.500 118.500 120.703 -2.203 25155 5467 1 7 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.093 0.202 25155 5468 1 7 . 1 1 75 75 LEU C C 75 176.800 176.800 176.395 0.405 25155 5469 1 7 . 1 1 75 75 LEU CA C 75 54.400 54.400 55.514 -1.114 25155 5470 1 7 . 1 1 75 75 LEU CB C 75 43.280 43.280 41.844 1.436 25155 5471 1 7 . 1 1 75 75 LEU H H 75 6.966 6.966 7.997 -1.031 25155 5472 1 7 . 1 1 76 76 ASN N N 76 123.040 123.040 119.942 3.098 25155 5473 1 7 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.735 0.127 25155 5474 1 7 . 1 1 76 76 ASN C C 76 174.927 174.927 174.153 0.774 25155 5475 1 7 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.442 -1.561 25155 5476 1 7 . 1 1 76 76 ASN CB C 76 37.510 37.510 39.492 -1.982 25155 5477 1 7 . 1 1 76 76 ASN H H 76 9.882 9.882 9.034 0.848 25155 5478 1 7 . 1 1 77 77 LEU N N 77 123.614 123.614 123.790 -0.176 25155 5479 1 7 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.618 -0.248 25155 5480 1 7 . 1 1 77 77 LEU C C 77 175.110 175.110 176.205 -1.095 25155 5481 1 7 . 1 1 77 77 LEU CA C 77 52.200 52.200 53.236 -1.036 25155 5482 1 7 . 1 1 77 77 LEU CB C 77 42.786 42.786 42.932 -0.146 25155 5483 1 7 . 1 1 77 77 LEU H H 77 8.700 8.700 8.701 -0.002 25155 5484 1 7 . 1 1 78 78 GLU N N 78 120.822 120.822 121.272 -0.450 25155 5485 1 7 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.064 -0.165 25155 5486 1 7 . 1 1 78 78 GLU C C 78 178.670 178.670 177.729 0.941 25155 5487 1 7 . 1 1 78 78 GLU CA C 78 58.700 58.700 58.086 0.614 25155 5488 1 7 . 1 1 78 78 GLU CB C 78 29.467 29.467 29.383 0.084 25155 5489 1 7 . 1 1 79 79 GLY N N 79 113.160 113.160 113.578 -0.418 25155 5490 1 7 . 1 1 79 79 GLY C C 79 174.523 174.523 173.879 0.644 25155 5491 1 7 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.629 -0.209 25155 5492 1 7 . 1 1 79 79 GLY H H 79 8.450 8.450 8.760 -0.310 25155 5493 1 7 . 1 1 80 80 LYS N N 80 120.283 120.283 120.132 0.151 25155 5494 1 7 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.329 0.029 25155 5495 1 7 . 1 1 80 80 LYS C C 80 175.304 175.304 176.119 -0.815 25155 5496 1 7 . 1 1 80 80 LYS CA C 80 56.890 56.890 56.261 0.629 25155 5497 1 7 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.518 -0.398 25155 5498 1 7 . 1 1 81 81 ILE N N 81 122.288 122.288 122.471 -0.183 25155 5499 1 7 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.329 0.477 25155 5500 1 7 . 1 1 81 81 ILE C C 81 174.750 174.750 175.241 -0.491 25155 5501 1 7 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.658 -1.838 25155 5502 1 7 . 1 1 81 81 ILE CB C 81 38.850 38.850 37.946 0.904 25155 5503 1 7 . 1 1 81 81 ILE H H 81 7.405 7.405 8.573 -1.168 25155 5504 1 7 . 1 1 82 82 VAL N N 82 127.793 127.793 126.957 0.836 25155 5505 1 7 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.349 -0.069 25155 5506 1 7 . 1 1 82 82 VAL C C 82 172.680 172.680 174.181 -1.501 25155 5507 1 7 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.292 -0.192 25155 5508 1 7 . 1 1 82 82 VAL CB C 82 35.280 35.280 36.080 -0.800 25155 5509 1 7 . 1 1 82 82 VAL H H 82 8.800 8.800 9.002 -0.202 25155 5510 1 7 . 1 1 83 83 ALA N N 83 130.911 130.911 127.403 3.508 25155 5511 1 7 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.181 0.208 25155 5512 1 7 . 1 1 83 83 ALA C C 83 175.870 175.870 175.624 0.246 25155 5513 1 7 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.825 0.175 25155 5514 1 7 . 1 1 83 83 ALA CB C 83 23.722 23.722 22.829 0.893 25155 5515 1 7 . 1 1 83 83 ALA H H 83 9.252 9.252 8.782 0.470 25155 5516 1 7 . 1 1 84 84 LEU N N 84 124.269 124.269 121.358 2.911 25155 5517 1 7 . 1 1 84 84 LEU HA H 84 5.508 5.508 5.254 0.254 25155 5518 1 7 . 1 1 84 84 LEU C C 84 175.490 175.490 175.374 0.116 25155 5519 1 7 . 1 1 84 84 LEU CA C 84 53.670 53.670 54.604 -0.934 25155 5520 1 7 . 1 1 84 84 LEU CB C 84 45.000 45.000 45.807 -0.807 25155 5521 1 7 . 1 1 84 84 LEU H H 84 10.378 10.378 9.032 1.346 25155 5522 1 7 . 1 1 85 85 TYR N N 85 115.826 115.826 121.417 -5.591 25155 5523 1 7 . 1 1 85 85 TYR HA H 85 4.950 4.950 4.608 0.342 25155 5524 1 7 . 1 1 85 85 TYR C C 85 172.661 172.661 174.649 -1.988 25155 5525 1 7 . 1 1 85 85 TYR CA C 85 55.853 55.853 56.739 -0.886 25155 5526 1 7 . 1 1 85 85 TYR CB C 85 43.200 43.200 42.858 0.342 25155 5527 1 7 . 1 1 85 85 TYR H H 85 9.200 9.200 9.153 0.047 25155 5528 1 7 . 1 1 86 86 GLY N N 86 106.802 106.802 108.137 -1.335 25155 5529 1 7 . 1 1 86 86 GLY C C 86 170.348 170.348 171.672 -1.324 25155 5530 1 7 . 1 1 86 86 GLY CA C 86 44.687 44.687 44.697 -0.009 25155 5531 1 7 . 1 1 86 86 GLY H H 86 8.752 8.752 7.748 1.004 25155 5532 1 7 . 1 1 87 87 LEU N N 87 120.860 120.860 115.085 5.775 25155 5533 1 7 . 1 1 87 87 LEU HA H 87 5.476 5.476 5.135 0.341 25155 5534 1 7 . 1 1 87 87 LEU C C 87 177.720 177.720 175.753 1.967 25155 5535 1 7 . 1 1 87 87 LEU CA C 87 52.630 52.630 52.306 0.324 25155 5536 1 7 . 1 1 87 87 LEU CB C 87 45.900 45.900 44.369 1.531 25155 5537 1 7 . 1 1 87 87 LEU H H 87 6.320 6.320 7.882 -1.562 25155 5538 1 7 . 1 1 88 88 GLY N N 88 109.910 109.910 106.226 3.684 25155 5539 1 7 . 1 1 88 88 GLY C C 88 171.386 171.386 171.595 -0.209 25155 5540 1 7 . 1 1 88 88 GLY CA C 88 45.710 45.710 45.361 0.349 25155 5541 1 7 . 1 1 88 88 GLY H H 88 8.320 8.320 8.328 -0.008 25155 5542 1 7 . 1 1 89 89 ASP N N 89 121.580 121.580 124.315 -2.735 25155 5543 1 7 . 1 1 89 89 ASP HA H 89 5.190 5.190 4.589 0.601 25155 5544 1 7 . 1 1 89 89 ASP C C 89 176.608 176.608 176.407 0.201 25155 5545 1 7 . 1 1 89 89 ASP CA C 89 52.200 52.200 52.637 -0.437 25155 5546 1 7 . 1 1 89 89 ASP CB C 89 41.900 41.900 42.050 -0.150 25155 5547 1 7 . 1 1 90 90 GLN N N 90 123.900 123.900 125.692 -1.792 25155 5548 1 7 . 1 1 90 90 GLN HA H 90 3.645 3.645 3.932 -0.287 25155 5549 1 7 . 1 1 90 90 GLN C C 90 173.523 173.523 177.014 -3.491 25155 5550 1 7 . 1 1 90 90 GLN CA C 90 58.706 58.706 57.888 0.818 25155 5551 1 7 . 1 1 90 90 GLN CB C 90 28.800 28.800 28.866 -0.066 25155 5552 1 7 . 1 1 90 90 GLN H H 90 8.726 8.726 8.409 0.317 25155 5553 1 7 . 1 1 91 91 LEU N N 91 117.080 117.080 119.186 -2.106 25155 5554 1 7 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.107 0.363 25155 5555 1 7 . 1 1 91 91 LEU C C 91 179.840 179.840 178.505 1.335 25155 5556 1 7 . 1 1 91 91 LEU CA C 91 55.800 55.800 55.921 -0.121 25155 5557 1 7 . 1 1 91 91 LEU CB C 91 41.640 41.640 42.143 -0.503 25155 5558 1 7 . 1 1 91 91 LEU H H 91 7.092 7.092 8.361 -1.269 25155 5559 1 7 . 1 1 92 92 GLY N N 92 110.460 110.460 105.155 5.305 25155 5560 1 7 . 1 1 92 92 GLY C C 92 174.824 174.824 175.054 -0.230 25155 5561 1 7 . 1 1 92 92 GLY CA C 92 46.390 46.390 46.847 -0.457 25155 5562 1 7 . 1 1 92 92 GLY H H 92 9.243 9.243 8.559 0.684 25155 5563 1 7 . 1 1 93 93 TYR N N 93 118.140 118.140 117.065 1.075 25155 5564 1 7 . 1 1 93 93 TYR HA H 93 5.173 5.173 4.449 0.724 25155 5565 1 7 . 1 1 93 93 TYR C C 93 177.805 177.805 177.457 0.348 25155 5566 1 7 . 1 1 93 93 TYR CA C 93 57.430 57.430 57.319 0.111 25155 5567 1 7 . 1 1 93 93 TYR CB C 93 39.300 39.300 39.021 0.279 25155 5568 1 7 . 1 1 93 93 TYR H H 93 7.252 7.252 7.166 0.086 25155 5569 1 7 . 1 1 94 94 GLY N N 94 112.455 112.455 109.156 3.299 25155 5570 1 7 . 1 1 94 94 GLY C C 94 177.740 177.740 176.131 1.609 25155 5571 1 7 . 1 1 94 94 GLY CA C 94 49.880 49.880 46.670 3.210 25155 5572 1 7 . 1 1 94 94 GLY H H 94 8.154 8.154 7.811 0.343 25155 5573 1 7 . 1 1 95 95 GLU N N 95 123.040 123.040 121.627 1.413 25155 5574 1 7 . 1 1 95 95 GLU HA H 95 4.000 4.000 4.024 -0.024 25155 5575 1 7 . 1 1 95 95 GLU C C 95 175.145 175.145 177.296 -2.151 25155 5576 1 7 . 1 1 95 95 GLU CA C 95 57.950 57.950 58.808 -0.858 25155 5577 1 7 . 1 1 95 95 GLU CB C 95 27.400 27.400 29.568 -2.168 25155 5578 1 7 . 1 1 96 96 TRP N N 96 118.000 118.000 115.849 2.151 25155 5579 1 7 . 1 1 96 96 TRP HA H 96 5.213 5.213 4.989 0.224 25155 5580 1 7 . 1 1 96 96 TRP C C 96 176.616 176.616 176.235 0.381 25155 5581 1 7 . 1 1 96 96 TRP CA C 96 57.120 57.120 55.225 1.895 25155 5582 1 7 . 1 1 96 96 TRP CB C 96 29.970 29.970 27.710 2.260 25155 5583 1 7 . 1 1 96 96 TRP H H 96 7.785 7.785 7.747 0.038 25155 5584 1 7 . 1 1 97 97 PHE N N 97 123.268 123.268 122.854 0.414 25155 5585 1 7 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.178 0.482 25155 5586 1 7 . 1 1 97 97 PHE CA C 97 58.742 58.742 60.653 -1.911 25155 5587 1 7 . 1 1 97 97 PHE CB C 97 40.835 40.835 39.276 1.559 25155 5588 1 7 . 1 1 97 97 PHE H H 97 7.054 7.054 7.842 -0.788 25155 5589 1 7 . 1 1 98 98 LEU HA H 98 3.440 3.440 3.546 -0.106 25155 5590 1 7 . 1 1 98 98 LEU C C 98 176.613 176.613 177.142 -0.529 25155 5591 1 7 . 1 1 98 98 LEU CA C 98 56.000 56.000 55.141 0.859 25155 5592 1 7 . 1 1 98 98 LEU CB C 98 38.600 38.600 39.144 -0.544 25155 5593 1 7 . 1 1 98 98 LEU H H 98 8.584 8.584 8.274 0.310 25155 5594 1 7 . 1 1 99 99 ASP N N 99 123.268 123.268 120.647 2.621 25155 5595 1 7 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.360 -0.395 25155 5596 1 7 . 1 1 99 99 ASP C C 99 178.876 178.876 177.251 1.625 25155 5597 1 7 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.593 1.667 25155 5598 1 7 . 1 1 99 99 ASP CB C 99 40.350 40.350 41.171 -0.821 25155 5599 1 7 . 1 1 100 100 ALA N N 100 119.124 119.124 120.149 -1.025 25155 5600 1 7 . 1 1 100 100 ALA HA H 100 3.822 3.822 4.259 -0.437 25155 5601 1 7 . 1 1 100 100 ALA C C 100 178.490 178.490 179.190 -0.700 25155 5602 1 7 . 1 1 100 100 ALA CA C 100 55.100 55.100 53.717 1.383 25155 5603 1 7 . 1 1 100 100 ALA CB C 100 19.700 19.700 18.355 1.345 25155 5604 1 7 . 1 1 100 100 ALA H H 100 8.400 8.400 7.628 0.772 25155 5605 1 7 . 1 1 101 101 LEU N N 101 118.687 118.687 120.942 -2.255 25155 5606 1 7 . 1 1 101 101 LEU HA H 101 3.674 3.674 4.066 -0.392 25155 5607 1 7 . 1 1 101 101 LEU C C 101 179.050 179.050 178.581 0.469 25155 5608 1 7 . 1 1 101 101 LEU CA C 101 57.800 57.800 57.352 0.448 25155 5609 1 7 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.775 0.875 25155 5610 1 7 . 1 1 101 101 LEU H H 101 6.518 6.518 7.761 -1.243 25155 5611 1 7 . 1 1 102 102 GLY N N 102 104.410 104.410 105.871 -1.461 25155 5612 1 7 . 1 1 102 102 GLY C C 102 176.056 176.056 175.832 0.224 25155 5613 1 7 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.231 0.519 25155 5614 1 7 . 1 1 102 102 GLY H H 102 7.712 7.712 7.821 -0.109 25155 5615 1 7 . 1 1 103 103 MET N N 103 120.550 120.550 120.075 0.475 25155 5616 1 7 . 1 1 103 103 MET HA H 103 4.256 4.256 4.533 -0.277 25155 5617 1 7 . 1 1 103 103 MET C C 103 179.650 179.650 178.308 1.342 25155 5618 1 7 . 1 1 103 103 MET CA C 103 59.450 59.450 58.928 0.522 25155 5619 1 7 . 1 1 103 103 MET CB C 103 32.300 32.300 32.772 -0.472 25155 5620 1 7 . 1 1 103 103 MET H H 103 8.485 8.485 7.568 0.917 25155 5621 1 7 . 1 1 104 104 LEU N N 104 123.480 123.480 121.082 2.398 25155 5622 1 7 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.499 -0.438 25155 5623 1 7 . 1 1 104 104 LEU C C 104 177.750 177.750 178.797 -1.047 25155 5624 1 7 . 1 1 104 104 LEU CA C 104 58.100 58.100 57.639 0.461 25155 5625 1 7 . 1 1 104 104 LEU CB C 104 41.450 41.450 41.349 0.101 25155 5626 1 7 . 1 1 104 104 LEU H H 104 8.392 8.392 7.881 0.511 25155 5627 1 7 . 1 1 105 105 HIS N N 105 119.570 119.570 119.884 -0.314 25155 5628 1 7 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.265 -0.413 25155 5629 1 7 . 1 1 105 105 HIS C C 105 177.550 177.550 177.018 0.532 25155 5630 1 7 . 1 1 105 105 HIS CA C 105 61.000 61.000 60.605 0.395 25155 5631 1 7 . 1 1 105 105 HIS CB C 105 28.820 28.820 29.973 -1.153 25155 5632 1 7 . 1 1 105 105 HIS H H 105 8.247 8.247 8.217 0.030 25155 5633 1 7 . 1 1 106 106 ASP N N 106 119.780 119.780 118.480 1.300 25155 5634 1 7 . 1 1 106 106 ASP HA H 106 4.333 4.333 4.386 -0.053 25155 5635 1 7 . 1 1 106 106 ASP C C 106 179.410 179.410 178.429 0.981 25155 5636 1 7 . 1 1 106 106 ASP CA C 106 57.800 57.800 57.461 0.339 25155 5637 1 7 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.138 -0.538 25155 5638 1 7 . 1 1 107 107 LYS N N 107 121.660 121.660 117.519 4.141 25155 5639 1 7 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.093 0.007 25155 5640 1 7 . 1 1 107 107 LYS C C 107 178.316 178.316 177.988 0.328 25155 5641 1 7 . 1 1 107 107 LYS CA C 107 58.750 58.750 58.685 0.065 25155 5642 1 7 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.285 -0.435 25155 5643 1 7 . 1 1 108 108 LEU N N 108 116.050 116.050 117.385 -1.335 25155 5644 1 7 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.438 -0.428 25155 5645 1 7 . 1 1 108 108 LEU C C 108 179.050 179.050 178.765 0.285 25155 5646 1 7 . 1 1 108 108 LEU CA C 108 56.240 56.240 55.884 0.356 25155 5647 1 7 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.511 -0.711 25155 5648 1 7 . 1 1 108 108 LEU H H 108 8.072 8.072 7.683 0.389 25155 5649 1 7 . 1 1 109 109 SER N N 109 116.280 116.280 115.912 0.368 25155 5650 1 7 . 1 1 109 109 SER HA H 109 4.300 4.300 4.312 -0.012 25155 5651 1 7 . 1 1 109 109 SER C C 109 175.848 175.848 175.722 0.126 25155 5652 1 7 . 1 1 109 109 SER CA C 109 62.410 62.410 61.586 0.824 25155 5653 1 7 . 1 1 109 109 SER CB C 109 62.850 62.850 63.245 -0.395 25155 5654 1 7 . 1 1 109 109 SER H H 109 8.366 8.366 7.870 0.496 25155 5655 1 7 . 1 1 110 110 THR N N 110 110.416 110.416 109.570 0.846 25155 5656 1 7 . 1 1 110 110 THR HA H 110 4.614 4.614 4.349 0.265 25155 5657 1 7 . 1 1 110 110 THR C C 110 175.675 175.675 175.520 0.155 25155 5658 1 7 . 1 1 110 110 THR CA C 110 62.030 62.030 63.234 -1.204 25155 5659 1 7 . 1 1 110 110 THR CB C 110 68.810 68.810 68.919 -0.109 25155 5660 1 7 . 1 1 110 110 THR H H 110 7.185 7.185 7.921 -0.736 25155 5661 1 7 . 1 1 111 111 LYS N N 111 120.090 120.090 120.881 -0.791 25155 5662 1 7 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.418 0.095 25155 5663 1 7 . 1 1 111 111 LYS C C 111 176.814 176.814 176.584 0.230 25155 5664 1 7 . 1 1 111 111 LYS CA C 111 55.730 55.730 55.772 -0.042 25155 5665 1 7 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.478 -1.548 25155 5666 1 7 . 1 1 112 112 GLY N N 112 107.540 107.540 107.806 -0.266 25155 5667 1 7 . 1 1 112 112 GLY C C 112 176.223 176.223 174.416 1.807 25155 5668 1 7 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.364 1.562 25155 5669 1 7 . 1 1 112 112 GLY H H 112 8.315 8.315 7.610 0.705 25155 5670 1 7 . 1 1 113 113 VAL N N 113 113.536 113.536 116.144 -2.608 25155 5671 1 7 . 1 1 113 113 VAL HA H 113 4.494 4.494 4.156 0.338 25155 5672 1 7 . 1 1 113 113 VAL C C 113 174.560 174.560 174.890 -0.330 25155 5673 1 7 . 1 1 113 113 VAL CA C 113 59.550 59.550 61.489 -1.938 25155 5674 1 7 . 1 1 113 113 VAL CB C 113 32.800 32.800 32.233 0.567 25155 5675 1 7 . 1 1 113 113 VAL H H 113 6.835 6.835 7.061 -0.226 25155 5676 1 7 . 1 1 114 114 LYS N N 114 122.920 122.920 121.022 1.898 25155 5677 1 7 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.390 0.104 25155 5678 1 7 . 1 1 114 114 LYS C C 114 174.925 174.925 174.785 0.140 25155 5679 1 7 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.218 0.062 25155 5680 1 7 . 1 1 114 114 LYS CB C 114 33.630 33.630 34.651 -1.021 25155 5681 1 7 . 1 1 115 115 PHE N N 115 123.140 123.140 123.025 0.115 25155 5682 1 7 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.553 0.147 25155 5683 1 7 . 1 1 115 115 PHE C C 115 177.580 177.580 175.912 1.668 25155 5684 1 7 . 1 1 115 115 PHE CA C 115 58.677 58.677 56.431 2.245 25155 5685 1 7 . 1 1 115 115 PHE CB C 115 41.120 41.120 40.811 0.309 25155 5686 1 7 . 1 1 115 115 PHE H H 115 8.506 8.506 8.451 0.055 25155 5687 1 7 . 1 1 116 116 VAL N N 116 115.737 115.737 115.378 0.359 25155 5688 1 7 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.668 -0.190 25155 5689 1 7 . 1 1 116 116 VAL C C 116 175.300 175.300 175.850 -0.550 25155 5690 1 7 . 1 1 116 116 VAL CA C 116 58.877 58.877 59.421 -0.544 25155 5691 1 7 . 1 1 116 116 VAL CB C 116 34.120 34.120 34.798 -0.678 25155 5692 1 7 . 1 1 116 116 VAL H H 116 8.860 8.860 8.343 0.517 25155 5693 1 7 . 1 1 117 117 GLY N N 117 108.137 108.137 110.471 -2.334 25155 5694 1 7 . 1 1 117 117 GLY C C 117 176.110 176.110 174.235 1.875 25155 5695 1 7 . 1 1 117 117 GLY CA C 117 47.500 47.500 45.081 2.419 25155 5696 1 7 . 1 1 117 117 GLY H H 117 9.838 9.838 8.820 1.018 25155 5697 1 7 . 1 1 118 118 TYR N N 118 120.380 120.380 120.001 0.379 25155 5698 1 7 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.470 0.500 25155 5699 1 7 . 1 1 118 118 TYR C C 118 177.630 177.630 175.138 2.492 25155 5700 1 7 . 1 1 118 118 TYR CA C 118 55.800 55.800 59.322 -3.522 25155 5701 1 7 . 1 1 118 118 TYR CB C 118 35.970 35.970 37.478 -1.508 25155 5702 1 7 . 1 1 118 118 TYR H H 118 8.652 8.652 8.334 0.318 25155 5703 1 7 . 1 1 119 119 TRP N N 119 126.040 126.040 119.530 6.510 25155 5704 1 7 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.126 0.895 25155 5705 1 7 . 1 1 119 119 TRP C C 119 173.000 173.000 173.914 -0.914 25155 5706 1 7 . 1 1 119 119 TRP CA C 119 53.820 53.820 55.671 -1.851 25155 5707 1 7 . 1 1 119 119 TRP CB C 119 36.050 36.050 33.208 2.842 25155 5708 1 7 . 1 1 119 119 TRP H H 119 8.070 8.070 8.661 -0.591 25155 5709 1 7 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.443 0.341 25155 5710 1 7 . 1 1 120 120 PRO C C 120 176.870 176.870 176.944 -0.074 25155 5711 1 7 . 1 1 120 120 PRO CA C 120 63.780 63.780 63.740 0.040 25155 5712 1 7 . 1 1 120 120 PRO CB C 120 31.990 31.990 31.935 0.055 25155 5713 1 7 . 1 1 121 121 THR N N 121 109.310 109.310 115.887 -6.577 25155 5714 1 7 . 1 1 121 121 THR HA H 121 4.073 4.073 3.644 0.429 25155 5715 1 7 . 1 1 121 121 THR C C 121 176.324 176.324 175.125 1.199 25155 5716 1 7 . 1 1 121 121 THR CA C 121 61.250 61.250 63.819 -2.569 25155 5717 1 7 . 1 1 121 121 THR CB C 121 69.730 69.730 68.818 0.912 25155 5718 1 7 . 1 1 121 121 THR H H 121 7.370 7.370 8.257 -0.887 25155 5719 1 7 . 1 1 122 122 GLU N N 122 123.937 123.937 121.219 2.718 25155 5720 1 7 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.008 0.216 25155 5721 1 7 . 1 1 122 122 GLU C C 122 177.737 177.737 177.819 -0.082 25155 5722 1 7 . 1 1 122 122 GLU CA C 122 58.200 58.200 57.755 0.445 25155 5723 1 7 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.499 0.301 25155 5724 1 7 . 1 1 123 123 GLY N N 123 114.563 114.563 111.428 3.135 25155 5725 1 7 . 1 1 123 123 GLY C C 123 173.783 173.783 173.520 0.263 25155 5726 1 7 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.219 0.161 25155 5727 1 7 . 1 1 123 123 GLY H H 123 9.144 9.144 8.871 0.273 25155 5728 1 7 . 1 1 124 124 TYR N N 124 118.800 118.800 121.034 -2.234 25155 5729 1 7 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.526 0.692 25155 5730 1 7 . 1 1 124 124 TYR C C 124 175.673 175.673 175.184 0.489 25155 5731 1 7 . 1 1 124 124 TYR CA C 124 56.950 56.950 57.615 -0.665 25155 5732 1 7 . 1 1 124 124 TYR CB C 124 41.100 41.100 40.323 0.777 25155 5733 1 7 . 1 1 124 124 TYR H H 124 7.895 7.895 7.907 -0.012 25155 5734 1 7 . 1 1 125 125 GLU N N 125 124.790 124.790 122.320 2.470 25155 5735 1 7 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.687 -0.002 25155 5736 1 7 . 1 1 125 125 GLU C C 125 172.877 172.877 174.863 -1.986 25155 5737 1 7 . 1 1 125 125 GLU CA C 125 55.700 55.700 55.431 0.269 25155 5738 1 7 . 1 1 125 125 GLU CB C 125 31.340 31.340 31.085 0.255 25155 5739 1 7 . 1 1 126 126 PHE N N 126 118.670 118.670 117.860 0.810 25155 5740 1 7 . 1 1 126 126 PHE HA H 126 4.841 4.841 5.389 -0.548 25155 5741 1 7 . 1 1 126 126 PHE C C 126 173.800 173.800 174.287 -0.487 25155 5742 1 7 . 1 1 126 126 PHE CA C 126 56.950 56.950 57.032 -0.082 25155 5743 1 7 . 1 1 126 126 PHE CB C 126 40.300 40.300 40.486 -0.186 25155 5744 1 7 . 1 1 126 126 PHE H H 126 7.645 7.645 7.879 -0.234 25155 5745 1 7 . 1 1 127 127 THR N N 127 107.038 107.038 114.944 -7.906 25155 5746 1 7 . 1 1 127 127 THR HA H 127 4.370 4.370 4.307 0.063 25155 5747 1 7 . 1 1 127 127 THR C C 127 175.100 175.100 174.891 0.209 25155 5748 1 7 . 1 1 127 127 THR CA C 127 61.080 61.080 62.642 -1.562 25155 5749 1 7 . 1 1 127 127 THR CB C 127 70.500 70.500 69.995 0.505 25155 5750 1 7 . 1 1 127 127 THR H H 127 7.306 7.306 8.450 -1.144 25155 5751 1 7 . 1 1 128 128 SER N N 128 118.150 118.150 120.453 -2.303 25155 5752 1 7 . 1 1 128 128 SER HA H 128 4.650 4.650 4.668 -0.018 25155 5753 1 7 . 1 1 128 128 SER C C 128 175.760 175.760 174.996 0.764 25155 5754 1 7 . 1 1 128 128 SER CA C 128 55.813 55.813 56.812 -1.000 25155 5755 1 7 . 1 1 128 128 SER CB C 128 65.300 65.300 64.248 1.052 25155 5756 1 7 . 1 1 128 128 SER H H 128 7.354 7.354 8.281 -0.927 25155 5757 1 7 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.688 0.076 25155 5758 1 7 . 1 1 129 129 PRO C C 129 178.860 178.860 177.750 1.110 25155 5759 1 7 . 1 1 129 129 PRO CA C 129 62.728 62.728 64.358 -1.630 25155 5760 1 7 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.430 -0.030 25155 5761 1 7 . 1 1 130 130 LYS N N 130 122.158 122.158 120.218 1.940 25155 5762 1 7 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.176 0.034 25155 5763 1 7 . 1 1 130 130 LYS C C 130 176.890 176.890 176.270 0.620 25155 5764 1 7 . 1 1 130 130 LYS CA C 130 61.375 61.375 60.920 0.455 25155 5765 1 7 . 1 1 130 130 LYS CB C 130 30.350 30.350 30.739 -0.389 25155 5766 1 7 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.492 0.041 25155 5767 1 7 . 1 1 131 131 PRO C C 131 173.810 173.810 175.301 -1.491 25155 5768 1 7 . 1 1 131 131 PRO CA C 131 64.510 64.510 63.035 1.475 25155 5769 1 7 . 1 1 131 131 PRO CB C 131 31.745 31.745 31.070 0.675 25155 5770 1 7 . 1 1 132 132 VAL N N 132 114.480 114.480 112.731 1.749 25155 5771 1 7 . 1 1 132 132 VAL HA H 132 5.158 5.158 5.176 -0.018 25155 5772 1 7 . 1 1 132 132 VAL C C 132 175.137 175.137 174.204 0.933 25155 5773 1 7 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.387 0.413 25155 5774 1 7 . 1 1 132 132 VAL CB C 132 34.780 34.780 35.861 -1.081 25155 5775 1 7 . 1 1 132 132 VAL H H 132 6.716 6.716 7.531 -0.815 25155 5776 1 7 . 1 1 133 133 ILE N N 133 120.670 120.670 113.520 7.150 25155 5777 1 7 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.564 -0.172 25155 5778 1 7 . 1 1 133 133 ILE C C 133 175.485 175.485 174.923 0.562 25155 5779 1 7 . 1 1 133 133 ILE CA C 133 60.000 60.000 59.223 0.777 25155 5780 1 7 . 1 1 133 133 ILE CB C 133 42.020 42.020 41.241 0.779 25155 5781 1 7 . 1 1 133 133 ILE H H 133 8.740 8.740 8.188 0.552 25155 5782 1 7 . 1 1 134 134 ALA N N 134 122.454 122.454 124.167 -1.713 25155 5783 1 7 . 1 1 134 134 ALA HA H 134 3.953 3.953 3.946 0.007 25155 5784 1 7 . 1 1 134 134 ALA C C 134 178.387 178.387 176.716 1.671 25155 5785 1 7 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.442 -0.392 25155 5786 1 7 . 1 1 134 134 ALA CB C 134 16.982 16.982 16.893 0.089 25155 5787 1 7 . 1 1 134 134 ALA H H 134 8.490 8.490 8.553 -0.063 25155 5788 1 7 . 1 1 135 135 ASP N N 135 117.310 117.310 116.498 0.812 25155 5789 1 7 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.266 -0.022 25155 5790 1 7 . 1 1 135 135 ASP C C 135 176.390 176.390 176.817 -0.427 25155 5791 1 7 . 1 1 135 135 ASP CA C 135 55.120 55.120 54.463 0.657 25155 5792 1 7 . 1 1 135 135 ASP CB C 135 39.865 39.865 40.153 -0.288 25155 5793 1 7 . 1 1 136 136 GLY N N 136 104.336 104.336 104.100 0.236 25155 5794 1 7 . 1 1 136 136 GLY C C 136 174.940 174.940 175.115 -0.175 25155 5795 1 7 . 1 1 136 136 GLY CA C 136 45.150 45.150 45.186 -0.036 25155 5796 1 7 . 1 1 136 136 GLY H H 136 7.592 7.592 7.843 -0.251 25155 5797 1 7 . 1 1 137 137 GLN N N 137 118.675 118.675 118.845 -0.170 25155 5798 1 7 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.581 -0.519 25155 5799 1 7 . 1 1 137 137 GLN C C 137 176.420 176.420 175.090 1.330 25155 5800 1 7 . 1 1 137 137 GLN CA C 137 57.760 57.760 56.934 0.826 25155 5801 1 7 . 1 1 137 137 GLN CB C 137 30.400 30.400 30.646 -0.246 25155 5802 1 7 . 1 1 137 137 GLN H H 137 7.843 7.843 8.107 -0.264 25155 5803 1 7 . 1 1 138 138 LEU N N 138 118.160 118.160 118.991 -0.831 25155 5804 1 7 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.917 0.044 25155 5805 1 7 . 1 1 138 138 LEU C C 138 175.700 175.700 174.907 0.793 25155 5806 1 7 . 1 1 138 138 LEU CA C 138 53.705 53.705 53.092 0.613 25155 5807 1 7 . 1 1 138 138 LEU CB C 138 46.480 46.480 45.448 1.032 25155 5808 1 7 . 1 1 138 138 LEU H H 138 7.356 7.356 7.290 0.066 25155 5809 1 7 . 1 1 139 139 PHE N N 139 119.060 119.060 121.190 -2.130 25155 5810 1 7 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.748 0.596 25155 5811 1 7 . 1 1 139 139 PHE C C 139 178.850 178.850 177.767 1.083 25155 5812 1 7 . 1 1 139 139 PHE CA C 139 56.670 56.670 57.697 -1.027 25155 5813 1 7 . 1 1 139 139 PHE CB C 139 43.652 43.652 39.198 4.454 25155 5814 1 7 . 1 1 139 139 PHE H H 139 10.026 10.026 9.070 0.956 25155 5815 1 7 . 1 1 140 140 VAL N N 140 109.905 109.905 116.789 -6.884 25155 5816 1 7 . 1 1 140 140 VAL HA H 140 3.500 3.500 3.326 0.174 25155 5817 1 7 . 1 1 140 140 VAL C C 140 172.860 172.860 175.334 -2.474 25155 5818 1 7 . 1 1 140 140 VAL CA C 140 61.812 61.812 62.755 -0.943 25155 5819 1 7 . 1 1 140 140 VAL CB C 140 30.250 30.250 30.808 -0.558 25155 5820 1 7 . 1 1 140 140 VAL H H 140 7.550 7.550 8.414 -0.864 25155 5821 1 7 . 1 1 141 141 GLY N N 141 106.600 106.600 108.104 -1.504 25155 5822 1 7 . 1 1 141 141 GLY C C 141 171.350 171.350 172.853 -1.503 25155 5823 1 7 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.462 0.998 25155 5824 1 7 . 1 1 141 141 GLY H H 141 7.052 7.052 7.267 -0.215 25155 5825 1 7 . 1 1 142 142 LEU N N 142 117.820 117.820 120.066 -2.246 25155 5826 1 7 . 1 1 142 142 LEU HA H 142 4.962 4.962 3.692 1.270 25155 5827 1 7 . 1 1 142 142 LEU CA C 142 55.600 55.600 53.103 2.497 25155 5828 1 7 . 1 1 142 142 LEU CB C 142 37.930 37.930 43.537 -5.607 25155 5829 1 7 . 1 1 142 142 LEU H H 142 7.643 7.643 7.930 -0.287 25155 5830 1 7 . 1 1 143 143 ALA HA H 143 4.220 4.220 3.778 0.442 25155 5831 1 7 . 1 1 143 143 ALA C C 143 175.505 175.505 175.663 -0.158 25155 5832 1 7 . 1 1 143 143 ALA CA C 143 49.600 49.600 50.843 -1.243 25155 5833 1 7 . 1 1 143 143 ALA CB C 143 23.330 23.330 18.695 4.635 25155 5834 1 7 . 1 1 144 144 LEU N N 144 124.960 124.960 122.563 2.397 25155 5835 1 7 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.408 0.372 25155 5836 1 7 . 1 1 144 144 LEU C C 144 174.700 174.700 174.986 -0.286 25155 5837 1 7 . 1 1 144 144 LEU CA C 144 52.790 52.790 53.836 -1.046 25155 5838 1 7 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.603 -0.303 25155 5839 1 7 . 1 1 144 144 LEU H H 144 8.583 8.583 7.834 0.749 25155 5840 1 7 . 1 1 145 145 ASP N N 145 119.100 119.100 121.990 -2.890 25155 5841 1 7 . 1 1 145 145 ASP HA H 145 5.422 5.422 5.077 0.345 25155 5842 1 7 . 1 1 145 145 ASP C C 145 176.180 176.180 176.881 -0.701 25155 5843 1 7 . 1 1 145 145 ASP CA C 145 53.600 53.600 54.046 -0.446 25155 5844 1 7 . 1 1 145 145 ASP CB C 145 43.180 43.180 43.445 -0.265 25155 5845 1 7 . 1 1 147 147 THR HA H 147 4.093 4.093 4.238 -0.145 25155 5846 1 7 . 1 1 147 147 THR C C 147 175.858 175.858 174.201 1.657 25155 5847 1 7 . 1 1 147 147 THR CA C 147 66.400 66.400 63.814 2.586 25155 5848 1 7 . 1 1 147 147 THR CB C 147 69.400 69.400 70.630 -1.230 25155 5849 1 7 . 1 1 147 147 THR H H 147 8.745 8.745 8.281 0.464 25155 5850 1 7 . 1 1 148 148 ASN N N 148 115.408 115.408 118.609 -3.201 25155 5851 1 7 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.923 0.087 25155 5852 1 7 . 1 1 148 148 ASN C C 148 175.750 175.750 175.350 0.400 25155 5853 1 7 . 1 1 148 148 ASN CA C 148 53.400 53.400 54.152 -0.752 25155 5854 1 7 . 1 1 148 148 ASN CB C 148 41.900 41.900 40.444 1.456 25155 5855 1 7 . 1 1 148 148 ASN H H 148 8.975 8.975 8.730 0.245 25155 5856 1 7 . 1 1 149 149 GLN N N 149 117.900 117.900 119.109 -1.209 25155 5857 1 7 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.642 0.294 25155 5858 1 7 . 1 1 149 149 GLN C C 149 178.280 178.280 175.704 2.576 25155 5859 1 7 . 1 1 149 149 GLN CA C 149 53.730 53.730 54.595 -0.865 25155 5860 1 7 . 1 1 149 149 GLN CB C 149 29.790 29.790 29.465 0.325 25155 5861 1 7 . 1 1 149 149 GLN H H 149 7.430 7.430 8.578 -1.148 25155 5862 1 7 . 1 1 150 150 TYR N N 150 121.060 121.060 119.748 1.312 25155 5863 1 7 . 1 1 150 150 TYR HA H 150 4.671 4.671 3.983 0.688 25155 5864 1 7 . 1 1 150 150 TYR C C 150 178.680 178.680 177.656 1.024 25155 5865 1 7 . 1 1 150 150 TYR CA C 150 57.930 57.930 62.715 -4.785 25155 5866 1 7 . 1 1 150 150 TYR CB C 150 38.860 38.860 37.867 0.994 25155 5867 1 7 . 1 1 150 150 TYR H H 150 8.115 8.115 8.253 -0.138 25155 5868 1 7 . 1 1 151 151 ASP N N 151 121.175 121.175 118.535 2.640 25155 5869 1 7 . 1 1 151 151 ASP CA C 151 57.000 57.000 57.123 -0.123 25155 5870 1 7 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.639 1.361 25155 5871 1 7 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.282 0.308 25155 5872 1 7 . 1 1 152 152 LEU C C 152 178.300 178.300 178.855 -0.555 25155 5873 1 7 . 1 1 152 152 LEU CA C 152 54.788 54.788 56.142 -1.353 25155 5874 1 7 . 1 1 152 152 LEU CB C 152 42.200 42.200 40.758 1.442 25155 5875 1 7 . 1 1 153 153 SER N N 153 116.170 116.170 117.558 -1.388 25155 5876 1 7 . 1 1 153 153 SER HA H 153 3.911 3.911 4.148 -0.237 25155 5877 1 7 . 1 1 153 153 SER CA C 153 63.400 63.400 62.724 0.676 25155 5878 1 7 . 1 1 153 153 SER CB C 153 63.200 63.200 62.682 0.518 25155 5879 1 7 . 1 1 153 153 SER H H 153 7.378 7.378 8.554 -1.176 25155 5880 1 7 . 1 1 154 154 ASP N N 154 121.640 121.640 121.789 -0.149 25155 5881 1 7 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.381 -0.141 25155 5882 1 7 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.674 1.626 25155 5883 1 7 . 1 1 154 154 ASP CB C 154 40.000 40.000 41.108 -1.108 25155 5884 1 7 . 1 1 155 155 GLU HA H 155 4.170 4.170 3.970 0.200 25155 5885 1 7 . 1 1 155 155 GLU C C 155 179.420 179.420 178.984 0.436 25155 5886 1 7 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.622 -0.422 25155 5887 1 7 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.813 -0.333 25155 5888 1 7 . 1 1 156 156 ARG N N 156 121.230 121.230 119.268 1.962 25155 5889 1 7 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.260 0.016 25155 5890 1 7 . 1 1 156 156 ARG C C 156 177.350 177.350 179.316 -1.966 25155 5891 1 7 . 1 1 156 156 ARG CA C 156 59.950 59.950 59.515 0.435 25155 5892 1 7 . 1 1 156 156 ARG CB C 156 31.100 31.100 30.083 1.017 25155 5893 1 7 . 1 1 157 157 ILE N N 157 118.190 118.190 120.067 -1.877 25155 5894 1 7 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.857 -0.427 25155 5895 1 7 . 1 1 157 157 ILE C C 157 178.480 178.480 178.058 0.422 25155 5896 1 7 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.714 0.846 25155 5897 1 7 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.861 0.619 25155 5898 1 7 . 1 1 157 157 ILE H H 157 8.705 8.705 8.438 0.267 25155 5899 1 7 . 1 1 158 158 GLN N N 158 119.975 119.975 120.569 -0.594 25155 5900 1 7 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.975 -0.019 25155 5901 1 7 . 1 1 158 158 GLN C C 158 178.730 178.730 178.384 0.346 25155 5902 1 7 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.277 1.423 25155 5903 1 7 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.397 0.085 25155 5904 1 7 . 1 1 158 158 GLN H H 158 8.262 8.262 8.627 -0.365 25155 5905 1 7 . 1 1 159 159 SER N N 159 115.466 115.466 115.726 -0.260 25155 5906 1 7 . 1 1 159 159 SER HA H 159 4.446 4.446 4.346 0.100 25155 5907 1 7 . 1 1 159 159 SER C C 159 177.320 177.320 177.018 0.302 25155 5908 1 7 . 1 1 159 159 SER CA C 159 63.500 63.500 61.263 2.237 25155 5909 1 7 . 1 1 159 159 SER CB C 159 63.818 63.818 63.386 0.432 25155 5910 1 7 . 1 1 159 159 SER H H 159 8.440 8.440 8.550 -0.110 25155 5911 1 7 . 1 1 160 160 TRP N N 160 126.784 126.784 124.812 1.972 25155 5912 1 7 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.472 -0.018 25155 5913 1 7 . 1 1 160 160 TRP C C 160 177.934 177.934 177.902 0.032 25155 5914 1 7 . 1 1 160 160 TRP CA C 160 62.745 62.745 62.343 0.402 25155 5915 1 7 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.534 -0.184 25155 5916 1 7 . 1 1 160 160 TRP H H 160 9.243 9.243 8.189 1.054 25155 5917 1 7 . 1 1 161 161 CYS N N 161 116.395 116.395 120.048 -3.653 25155 5918 1 7 . 1 1 161 161 CYS HA H 161 3.886 3.886 4.125 -0.239 25155 5919 1 7 . 1 1 161 161 CYS C C 161 176.245 176.245 177.382 -1.137 25155 5920 1 7 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.295 1.005 25155 5921 1 7 . 1 1 161 161 CYS CB C 161 27.723 27.723 27.460 0.263 25155 5922 1 7 . 1 1 161 161 CYS H H 161 8.845 8.845 9.111 -0.266 25155 5923 1 7 . 1 1 162 162 GLU N N 162 118.030 118.030 119.144 -1.114 25155 5924 1 7 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.901 0.019 25155 5925 1 7 . 1 1 162 162 GLU C C 162 178.700 178.700 178.824 -0.124 25155 5926 1 7 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.526 0.274 25155 5927 1 7 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.325 0.176 25155 5928 1 7 . 1 1 163 163 GLN N N 163 120.650 120.650 119.605 1.045 25155 5929 1 7 . 1 1 163 163 GLN HA H 163 4.173 4.173 4.045 0.128 25155 5930 1 7 . 1 1 163 163 GLN C C 163 179.700 179.700 178.516 1.184 25155 5931 1 7 . 1 1 163 163 GLN CA C 163 59.688 59.688 58.958 0.730 25155 5932 1 7 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.743 0.157 25155 5933 1 7 . 1 1 163 163 GLN H H 163 8.148 8.148 7.849 0.299 25155 5934 1 7 . 1 1 164 164 ILE N N 164 114.836 114.836 116.898 -2.062 25155 5935 1 7 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.653 0.407 25155 5936 1 7 . 1 1 164 164 ILE C C 164 178.676 178.676 177.755 0.921 25155 5937 1 7 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.409 1.751 25155 5938 1 7 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.503 0.127 25155 5939 1 7 . 1 1 164 164 ILE H H 164 8.958 8.958 8.354 0.604 25155 5940 1 7 . 1 1 165 165 LEU N N 165 123.700 123.700 120.149 3.551 25155 5941 1 7 . 1 1 165 165 LEU HA H 165 4.100 4.100 4.164 -0.064 25155 5942 1 7 . 1 1 165 165 LEU C C 165 180.548 180.548 178.309 2.239 25155 5943 1 7 . 1 1 165 165 LEU CA C 165 58.150 58.150 57.923 0.227 25155 5944 1 7 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.464 -0.334 25155 5945 1 7 . 1 1 165 165 LEU H H 165 7.830 7.830 7.818 0.012 25155 5946 1 7 . 1 1 166 166 ASN N N 166 120.160 120.160 118.364 1.796 25155 5947 1 7 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.336 0.234 25155 5948 1 7 . 1 1 166 166 ASN C C 166 175.690 175.690 177.242 -1.552 25155 5949 1 7 . 1 1 166 166 ASN CA C 166 55.946 55.946 56.486 -0.540 25155 5950 1 7 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.455 0.025 25155 5951 1 7 . 1 1 166 166 ASN H H 166 7.706 7.706 7.878 -0.172 25155 5952 1 7 . 1 1 167 167 GLU N N 167 121.286 121.286 121.431 -0.145 25155 5953 1 7 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.217 -0.113 25155 5954 1 7 . 1 1 167 167 GLU C C 167 180.520 180.520 179.026 1.494 25155 5955 1 7 . 1 1 167 167 GLU CA C 167 59.920 59.920 59.037 0.883 25155 5956 1 7 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.756 1.169 25155 5957 1 7 . 1 1 168 168 MET N N 168 118.622 118.622 115.982 2.640 25155 5958 1 7 . 1 1 168 168 MET HA H 168 3.996 3.996 4.362 -0.366 25155 5959 1 7 . 1 1 168 168 MET C C 168 176.856 176.856 177.684 -0.828 25155 5960 1 7 . 1 1 168 168 MET CA C 168 59.500 59.500 58.694 0.806 25155 5961 1 7 . 1 1 168 168 MET CB C 168 33.700 33.700 32.686 1.014 25155 5962 1 7 . 1 1 168 168 MET H H 168 8.723 8.723 8.364 0.359 25155 5963 1 7 . 1 1 169 169 ALA N N 169 121.760 121.760 122.985 -1.225 25155 5964 1 7 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.215 -0.059 25155 5965 1 7 . 1 1 169 169 ALA C C 169 179.790 179.790 179.667 0.123 25155 5966 1 7 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.578 0.222 25155 5967 1 7 . 1 1 169 169 ALA CB C 169 18.220 18.220 18.666 -0.446 25155 5968 1 7 . 1 1 169 169 ALA H H 169 7.494 7.494 7.367 0.127 25155 5969 1 7 . 1 1 170 170 GLU N N 170 116.970 116.970 118.479 -1.509 25155 5970 1 7 . 1 1 170 170 GLU HA H 170 4.091 4.091 4.031 0.060 25155 5971 1 7 . 1 1 170 170 GLU C C 170 177.745 177.745 178.529 -0.784 25155 5972 1 7 . 1 1 170 170 GLU CA C 170 58.000 58.000 58.844 -0.844 25155 5973 1 7 . 1 1 170 170 GLU CB C 170 29.730 29.730 29.601 0.129 25155 5974 1 7 . 1 1 171 171 HIS N N 171 118.150 118.150 116.738 1.412 25155 5975 1 7 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.342 0.128 25155 5976 1 7 . 1 1 171 171 HIS C C 171 175.848 175.848 176.092 -0.244 25155 5977 1 7 . 1 1 171 171 HIS CA C 171 57.600 57.600 58.127 -0.527 25155 5978 1 7 . 1 1 171 171 HIS CB C 171 30.800 30.800 29.993 0.807 25155 5979 1 7 . 1 1 171 171 HIS H H 171 7.717 7.717 7.876 -0.159 25155 5980 1 7 . 1 1 172 172 TYR N N 172 119.483 119.483 118.384 1.099 25155 5981 1 7 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.344 0.247 25155 5982 1 7 . 1 1 172 172 TYR C C 172 174.590 174.590 175.518 -0.928 25155 5983 1 7 . 1 1 172 172 TYR CA C 172 57.813 57.813 59.453 -1.639 25155 5984 1 7 . 1 1 172 172 TYR CB C 172 38.900 38.900 39.654 -0.754 25155 5985 1 7 . 1 1 172 172 TYR H H 172 7.778 7.778 7.774 0.004 25155 5986 1 8 . 1 1 2 2 ASN N N 2 122.966 122.966 118.768 4.198 25155 5987 1 8 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.211 -0.036 25155 5988 1 8 . 1 1 2 2 ASN C C 2 175.200 175.200 173.481 1.719 25155 5989 1 8 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.403 0.517 25155 5990 1 8 . 1 1 2 2 ASN CB C 2 40.000 40.000 41.252 -1.252 25155 5991 1 8 . 1 1 2 2 ASN H H 2 9.392 9.392 8.291 1.101 25155 5992 1 8 . 1 1 3 3 MET N N 3 120.660 120.660 116.799 3.861 25155 5993 1 8 . 1 1 3 3 MET HA H 3 5.565 5.565 5.168 0.397 25155 5994 1 8 . 1 1 3 3 MET C C 3 174.200 174.200 175.508 -1.308 25155 5995 1 8 . 1 1 3 3 MET CA C 3 54.550 54.550 54.617 -0.067 25155 5996 1 8 . 1 1 3 3 MET CB C 3 34.100 34.100 36.715 -2.615 25155 5997 1 8 . 1 1 3 3 MET H H 3 8.745 8.745 9.040 -0.295 25155 5998 1 8 . 1 1 4 4 GLY N N 4 115.792 115.792 109.471 6.321 25155 5999 1 8 . 1 1 4 4 GLY C C 4 170.444 170.444 171.611 -1.167 25155 6000 1 8 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.003 -0.116 25155 6001 1 8 . 1 1 4 4 GLY H H 4 8.989 8.989 8.960 0.029 25155 6002 1 8 . 1 1 5 5 LEU N N 5 131.175 131.175 126.598 4.577 25155 6003 1 8 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.301 1.021 25155 6004 1 8 . 1 1 5 5 LEU C C 5 175.700 175.700 174.512 1.188 25155 6005 1 8 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.388 -0.068 25155 6006 1 8 . 1 1 5 5 LEU CB C 5 44.700 44.700 43.841 0.859 25155 6007 1 8 . 1 1 5 5 LEU H H 5 8.917 8.917 8.547 0.370 25155 6008 1 8 . 1 1 6 6 PHE N N 6 125.990 125.990 126.014 -0.024 25155 6009 1 8 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.755 -0.017 25155 6010 1 8 . 1 1 6 6 PHE C C 6 174.358 174.358 173.494 0.864 25155 6011 1 8 . 1 1 6 6 PHE CA C 6 55.480 55.480 54.989 0.491 25155 6012 1 8 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.607 -0.557 25155 6013 1 8 . 1 1 6 6 PHE H H 6 9.225 9.225 9.121 0.104 25155 6014 1 8 . 1 1 7 7 TYR N N 7 118.040 118.040 116.321 1.719 25155 6015 1 8 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.434 0.495 25155 6016 1 8 . 1 1 7 7 TYR C C 7 171.690 171.690 174.087 -2.397 25155 6017 1 8 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.390 -0.930 25155 6018 1 8 . 1 1 7 7 TYR CB C 7 40.800 40.800 41.017 -0.217 25155 6019 1 8 . 1 1 7 7 TYR H H 7 8.235 8.235 8.110 0.125 25155 6020 1 8 . 1 1 8 8 GLY N N 8 106.640 106.640 107.220 -0.580 25155 6021 1 8 . 1 1 8 8 GLY C C 8 171.682 171.682 172.254 -0.572 25155 6022 1 8 . 1 1 8 8 GLY CA C 8 44.050 44.050 46.153 -2.103 25155 6023 1 8 . 1 1 8 8 GLY H H 8 6.996 6.996 8.678 -1.682 25155 6024 1 8 . 1 1 9 9 SER N N 9 118.164 118.164 115.333 2.831 25155 6025 1 8 . 1 1 9 9 SER C C 9 174.560 174.560 174.454 0.106 25155 6026 1 8 . 1 1 9 9 SER CA C 9 57.140 57.140 57.893 -0.753 25155 6027 1 8 . 1 1 9 9 SER H H 9 9.680 9.680 7.945 1.735 25155 6028 1 8 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.923 -0.293 25155 6029 1 8 . 1 1 17 17 ALA C C 17 177.740 177.740 179.233 -1.493 25155 6030 1 8 . 1 1 17 17 ALA CA C 17 54.900 54.900 54.949 -0.049 25155 6031 1 8 . 1 1 17 17 ALA CB C 17 17.790 17.790 17.750 0.040 25155 6032 1 8 . 1 1 17 17 ALA H H 17 8.055 8.055 7.592 0.463 25155 6033 1 8 . 1 1 18 18 ALA N N 18 120.026 120.026 121.341 -1.315 25155 6034 1 8 . 1 1 18 18 ALA HA H 18 3.713 3.713 3.937 -0.224 25155 6035 1 8 . 1 1 18 18 ALA C C 18 179.040 179.040 179.671 -0.631 25155 6036 1 8 . 1 1 18 18 ALA CA C 18 54.860 54.860 55.007 -0.147 25155 6037 1 8 . 1 1 18 18 ALA CB C 18 18.200 18.200 18.070 0.131 25155 6038 1 8 . 1 1 18 18 ALA H H 18 7.015 7.015 8.188 -1.173 25155 6039 1 8 . 1 1 19 19 GLU N N 19 116.656 116.656 118.452 -1.796 25155 6040 1 8 . 1 1 19 19 GLU HA H 19 3.580 3.580 3.968 -0.388 25155 6041 1 8 . 1 1 19 19 GLU C C 19 178.487 178.487 179.260 -0.773 25155 6042 1 8 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.885 -0.214 25155 6043 1 8 . 1 1 19 19 GLU CB C 19 29.400 29.400 29.642 -0.242 25155 6044 1 8 . 1 1 20 20 LYS N N 20 120.100 120.100 119.787 0.313 25155 6045 1 8 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.086 0.260 25155 6046 1 8 . 1 1 20 20 LYS C C 20 175.330 175.330 179.161 -3.831 25155 6047 1 8 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.352 -2.252 25155 6048 1 8 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.498 0.502 25155 6049 1 8 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.657 -0.192 25155 6050 1 8 . 1 1 21 21 ILE C C 21 177.680 177.680 177.908 -0.228 25155 6051 1 8 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.768 -0.128 25155 6052 1 8 . 1 1 21 21 ILE CB C 21 38.030 38.030 37.852 0.178 25155 6053 1 8 . 1 1 21 21 ILE H H 21 8.220 8.220 8.640 -0.420 25155 6054 1 8 . 1 1 22 22 ARG N N 22 119.433 119.433 119.845 -0.412 25155 6055 1 8 . 1 1 22 22 ARG HA H 22 3.550 3.550 3.915 -0.365 25155 6056 1 8 . 1 1 22 22 ARG C C 22 177.268 177.268 178.250 -0.982 25155 6057 1 8 . 1 1 22 22 ARG CA C 22 59.760 59.760 59.761 -0.001 25155 6058 1 8 . 1 1 22 22 ARG CB C 22 28.900 28.900 29.931 -1.031 25155 6059 1 8 . 1 1 23 23 ASP N N 23 118.945 118.945 119.552 -0.607 25155 6060 1 8 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.455 -0.113 25155 6061 1 8 . 1 1 23 23 ASP C C 23 178.470 178.470 178.877 -0.407 25155 6062 1 8 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.251 0.199 25155 6063 1 8 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.877 -0.506 25155 6064 1 8 . 1 1 24 24 ILE N N 24 121.200 121.200 119.487 1.713 25155 6065 1 8 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.784 -0.050 25155 6066 1 8 . 1 1 24 24 ILE C C 24 178.297 178.297 177.906 0.391 25155 6067 1 8 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.871 -0.371 25155 6068 1 8 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.435 0.305 25155 6069 1 8 . 1 1 24 24 ILE H H 24 8.160 8.160 8.053 0.107 25155 6070 1 8 . 1 1 25 25 ILE N N 25 121.166 121.166 117.307 3.859 25155 6071 1 8 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.872 -0.229 25155 6072 1 8 . 1 1 25 25 ILE C C 25 176.825 176.825 176.698 0.127 25155 6073 1 8 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.074 2.816 25155 6074 1 8 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.840 -1.090 25155 6075 1 8 . 1 1 25 25 ILE H H 25 8.480 8.480 8.009 0.471 25155 6076 1 8 . 1 1 26 26 GLY N N 26 109.050 109.050 105.111 3.939 25155 6077 1 8 . 1 1 26 26 GLY C C 26 173.800 173.800 172.573 1.227 25155 6078 1 8 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.483 -0.083 25155 6079 1 8 . 1 1 26 26 GLY H H 26 7.945 7.945 7.797 0.148 25155 6080 1 8 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.480 -0.117 25155 6081 1 8 . 1 1 27 27 PRO C C 27 177.157 177.157 176.985 0.172 25155 6082 1 8 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.722 0.808 25155 6083 1 8 . 1 1 27 27 PRO CB C 27 32.000 32.000 32.128 -0.128 25155 6084 1 8 . 1 1 28 28 GLU N N 28 116.510 116.510 116.861 -0.351 25155 6085 1 8 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.241 0.019 25155 6086 1 8 . 1 1 28 28 GLU C C 28 177.000 177.000 176.948 0.052 25155 6087 1 8 . 1 1 28 28 GLU CA C 28 57.680 57.680 57.681 -0.001 25155 6088 1 8 . 1 1 28 28 GLU CB C 28 28.620 28.620 29.196 -0.576 25155 6089 1 8 . 1 1 29 29 LEU N N 29 120.334 120.334 112.219 8.115 25155 6090 1 8 . 1 1 29 29 LEU HA H 29 4.650 4.650 4.744 -0.094 25155 6091 1 8 . 1 1 29 29 LEU C C 29 175.676 175.676 175.153 0.523 25155 6092 1 8 . 1 1 29 29 LEU CA C 29 55.924 55.924 55.010 0.914 25155 6093 1 8 . 1 1 29 29 LEU CB C 29 44.880 44.880 44.252 0.628 25155 6094 1 8 . 1 1 29 29 LEU H H 29 7.924 7.924 7.571 0.353 25155 6095 1 8 . 1 1 30 30 VAL N N 30 118.900 118.900 120.725 -1.825 25155 6096 1 8 . 1 1 30 30 VAL HA H 30 4.639 4.639 4.910 -0.271 25155 6097 1 8 . 1 1 30 30 VAL C C 30 174.368 174.368 175.986 -1.618 25155 6098 1 8 . 1 1 30 30 VAL CA C 30 61.110 61.110 60.736 0.374 25155 6099 1 8 . 1 1 30 30 VAL CB C 30 34.500 34.500 33.780 0.720 25155 6100 1 8 . 1 1 30 30 VAL H H 30 7.486 7.486 7.617 -0.131 25155 6101 1 8 . 1 1 31 31 THR N N 31 124.000 124.000 120.040 3.960 25155 6102 1 8 . 1 1 31 31 THR HA H 31 4.331 4.331 4.735 -0.404 25155 6103 1 8 . 1 1 31 31 THR C C 31 172.670 172.670 173.083 -0.413 25155 6104 1 8 . 1 1 31 31 THR CA C 31 61.784 61.784 61.169 0.615 25155 6105 1 8 . 1 1 31 31 THR CB C 31 70.483 70.483 71.108 -0.625 25155 6106 1 8 . 1 1 31 31 THR H H 31 7.947 7.947 8.351 -0.404 25155 6107 1 8 . 1 1 32 32 LEU N N 32 127.408 127.408 125.558 1.850 25155 6108 1 8 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.612 0.025 25155 6109 1 8 . 1 1 32 32 LEU C C 32 176.425 176.425 177.061 -0.636 25155 6110 1 8 . 1 1 32 32 LEU CA C 32 54.760 54.760 54.990 -0.230 25155 6111 1 8 . 1 1 32 32 LEU CB C 32 43.809 43.809 43.108 0.701 25155 6112 1 8 . 1 1 32 32 LEU H H 32 8.614 8.614 8.644 -0.030 25155 6113 1 8 . 1 1 33 33 HIS N N 33 120.230 120.230 123.427 -3.197 25155 6114 1 8 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.933 -0.513 25155 6115 1 8 . 1 1 33 33 HIS C C 33 171.914 171.914 173.818 -1.904 25155 6116 1 8 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.919 0.381 25155 6117 1 8 . 1 1 33 33 HIS CB C 33 32.050 32.050 30.573 1.477 25155 6118 1 8 . 1 1 33 33 HIS H H 33 9.130 9.130 9.004 0.126 25155 6119 1 8 . 1 1 34 34 ASN N N 34 123.987 123.987 121.987 2.000 25155 6120 1 8 . 1 1 34 34 ASN HA H 34 3.600 3.600 4.064 -0.464 25155 6121 1 8 . 1 1 34 34 ASN C C 34 177.930 177.930 175.767 2.163 25155 6122 1 8 . 1 1 34 34 ASN CA C 34 51.730 51.730 52.240 -0.510 25155 6123 1 8 . 1 1 34 34 ASN CB C 34 38.747 38.747 38.522 0.225 25155 6124 1 8 . 1 1 34 34 ASN H H 34 8.759 8.759 8.429 0.330 25155 6125 1 8 . 1 1 35 35 LEU N N 35 128.751 128.751 126.245 2.506 25155 6126 1 8 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.176 0.114 25155 6127 1 8 . 1 1 35 35 LEU C C 35 177.363 177.363 178.084 -0.721 25155 6128 1 8 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.511 0.039 25155 6129 1 8 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.595 1.167 25155 6130 1 8 . 1 1 35 35 LEU H H 35 8.758 8.758 8.665 0.093 25155 6131 1 8 . 1 1 36 36 LYS N N 36 120.870 120.870 118.664 2.206 25155 6132 1 8 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.200 -0.267 25155 6133 1 8 . 1 1 36 36 LYS C C 36 176.540 176.540 177.022 -0.482 25155 6134 1 8 . 1 1 36 36 LYS CA C 36 59.260 59.260 58.150 1.111 25155 6135 1 8 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.468 0.332 25155 6136 1 8 . 1 1 37 37 ASP N N 37 115.288 115.288 115.842 -0.554 25155 6137 1 8 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.728 0.019 25155 6138 1 8 . 1 1 37 37 ASP C C 37 175.500 175.500 176.174 -0.674 25155 6139 1 8 . 1 1 37 37 ASP CA C 37 54.805 54.805 54.780 0.025 25155 6140 1 8 . 1 1 37 37 ASP CB C 37 44.650 44.650 43.382 1.268 25155 6141 1 8 . 1 1 38 38 ASP N N 38 121.550 121.550 120.853 0.697 25155 6142 1 8 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.877 -0.012 25155 6143 1 8 . 1 1 38 38 ASP C C 38 174.895 174.895 175.793 -0.898 25155 6144 1 8 . 1 1 38 38 ASP CA C 38 52.840 52.840 53.794 -0.954 25155 6145 1 8 . 1 1 38 38 ASP CB C 38 42.240 42.240 42.527 -0.287 25155 6146 1 8 . 1 1 39 39 SER N N 39 115.170 115.170 117.715 -2.545 25155 6147 1 8 . 1 1 39 39 SER HA H 39 4.600 4.600 4.613 -0.013 25155 6148 1 8 . 1 1 39 39 SER C C 39 174.930 174.930 174.592 0.338 25155 6149 1 8 . 1 1 39 39 SER CA C 39 54.786 54.786 56.899 -2.113 25155 6150 1 8 . 1 1 39 39 SER CB C 39 64.840 64.840 63.192 1.648 25155 6151 1 8 . 1 1 39 39 SER H H 39 8.330 8.330 8.651 -0.321 25155 6152 1 8 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.443 -0.443 25155 6153 1 8 . 1 1 40 40 PRO C C 40 176.620 176.620 177.865 -1.245 25155 6154 1 8 . 1 1 40 40 PRO CA C 40 63.870 63.870 64.820 -0.950 25155 6155 1 8 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.731 -0.371 25155 6156 1 8 . 1 1 41 41 LYS N N 41 120.913 120.913 118.153 2.760 25155 6157 1 8 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.189 -0.293 25155 6158 1 8 . 1 1 41 41 LYS C C 41 179.580 179.580 178.508 1.072 25155 6159 1 8 . 1 1 41 41 LYS CA C 41 58.000 58.000 58.017 -0.017 25155 6160 1 8 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.259 0.841 25155 6161 1 8 . 1 1 42 42 LEU N N 42 118.206 118.206 120.502 -2.296 25155 6162 1 8 . 1 1 42 42 LEU HA H 42 4.025 4.025 4.101 -0.076 25155 6163 1 8 . 1 1 42 42 LEU C C 42 178.630 178.630 178.643 -0.013 25155 6164 1 8 . 1 1 42 42 LEU CA C 42 57.030 57.030 56.928 0.102 25155 6165 1 8 . 1 1 42 42 LEU CB C 42 41.820 41.820 40.835 0.985 25155 6166 1 8 . 1 1 42 42 LEU H H 42 7.598 7.598 7.594 0.004 25155 6167 1 8 . 1 1 43 43 MET N N 43 118.913 118.913 117.219 1.694 25155 6168 1 8 . 1 1 43 43 MET HA H 43 3.760 3.760 4.031 -0.271 25155 6169 1 8 . 1 1 43 43 MET C C 43 177.710 177.710 178.431 -0.721 25155 6170 1 8 . 1 1 43 43 MET CA C 43 59.864 59.864 58.658 1.206 25155 6171 1 8 . 1 1 43 43 MET CB C 43 32.680 32.680 31.752 0.928 25155 6172 1 8 . 1 1 43 43 MET H H 43 8.180 8.180 8.186 -0.006 25155 6173 1 8 . 1 1 44 44 GLU N N 44 110.906 110.906 119.344 -8.438 25155 6174 1 8 . 1 1 44 44 GLU HA H 44 3.732 3.732 4.059 -0.327 25155 6175 1 8 . 1 1 44 44 GLU C C 44 178.120 178.120 179.070 -0.950 25155 6176 1 8 . 1 1 44 44 GLU CA C 44 59.450 59.450 59.098 0.352 25155 6177 1 8 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.269 0.531 25155 6178 1 8 . 1 1 45 45 GLN N N 45 115.770 115.770 117.385 -1.615 25155 6179 1 8 . 1 1 45 45 GLN HA H 45 4.190 4.190 3.980 0.210 25155 6180 1 8 . 1 1 45 45 GLN C C 45 175.480 175.480 176.681 -1.201 25155 6181 1 8 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.215 -1.115 25155 6182 1 8 . 1 1 45 45 GLN CB C 45 28.490 28.490 28.840 -0.350 25155 6183 1 8 . 1 1 45 45 GLN H H 45 7.517 7.517 7.453 0.064 25155 6184 1 8 . 1 1 46 46 TYR N N 46 117.840 117.840 118.216 -0.376 25155 6185 1 8 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.489 0.171 25155 6186 1 8 . 1 1 46 46 TYR C C 46 175.480 175.480 176.187 -0.707 25155 6187 1 8 . 1 1 46 46 TYR CA C 46 58.827 58.827 58.419 0.408 25155 6188 1 8 . 1 1 46 46 TYR CB C 46 41.720 41.720 38.558 3.162 25155 6189 1 8 . 1 1 46 46 TYR H H 46 6.955 6.955 7.374 -0.419 25155 6190 1 8 . 1 1 47 47 ASP N N 47 121.540 121.540 122.514 -0.974 25155 6191 1 8 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.583 0.113 25155 6192 1 8 . 1 1 47 47 ASP C C 47 175.677 175.677 175.926 -0.249 25155 6193 1 8 . 1 1 47 47 ASP CA C 47 56.812 56.812 57.016 -0.203 25155 6194 1 8 . 1 1 47 47 ASP CB C 47 42.978 42.978 41.873 1.105 25155 6195 1 8 . 1 1 48 48 VAL N N 48 118.666 118.666 117.201 1.465 25155 6196 1 8 . 1 1 48 48 VAL HA H 48 5.057 5.057 4.940 0.117 25155 6197 1 8 . 1 1 48 48 VAL C C 48 174.180 174.180 174.410 -0.230 25155 6198 1 8 . 1 1 48 48 VAL CA C 48 60.000 60.000 61.376 -1.376 25155 6199 1 8 . 1 1 48 48 VAL CB C 48 36.200 36.200 33.729 2.471 25155 6200 1 8 . 1 1 48 48 VAL H H 48 7.631 7.631 7.885 -0.254 25155 6201 1 8 . 1 1 49 49 LEU N N 49 128.300 128.300 127.369 0.931 25155 6202 1 8 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.247 0.353 25155 6203 1 8 . 1 1 49 49 LEU C C 49 174.810 174.810 174.900 -0.090 25155 6204 1 8 . 1 1 49 49 LEU CA C 49 52.230 52.230 53.911 -1.681 25155 6205 1 8 . 1 1 49 49 LEU CB C 49 45.400 45.400 46.123 -0.723 25155 6206 1 8 . 1 1 49 49 LEU H H 49 9.469 9.469 8.848 0.621 25155 6207 1 8 . 1 1 50 50 ILE N N 50 124.400 124.400 127.164 -2.764 25155 6208 1 8 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.591 1.059 25155 6209 1 8 . 1 1 50 50 ILE C C 50 175.286 175.286 174.155 1.131 25155 6210 1 8 . 1 1 50 50 ILE CA C 50 59.900 59.900 60.888 -0.988 25155 6211 1 8 . 1 1 50 50 ILE CB C 50 40.200 40.200 39.970 0.230 25155 6212 1 8 . 1 1 50 50 ILE H H 50 9.213 9.213 9.245 -0.032 25155 6213 1 8 . 1 1 51 51 LEU N N 51 127.410 127.410 128.345 -0.935 25155 6214 1 8 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.259 1.811 25155 6215 1 8 . 1 1 51 51 LEU C C 51 174.540 174.540 175.447 -0.907 25155 6216 1 8 . 1 1 51 51 LEU CA C 51 52.950 52.950 53.011 -0.061 25155 6217 1 8 . 1 1 51 51 LEU CB C 51 43.190 43.190 43.319 -0.129 25155 6218 1 8 . 1 1 51 51 LEU H H 51 9.256 9.256 8.827 0.429 25155 6219 1 8 . 1 1 52 52 GLY N N 52 108.290 108.290 110.207 -1.917 25155 6220 1 8 . 1 1 52 52 GLY C C 52 174.330 174.330 171.459 2.871 25155 6221 1 8 . 1 1 52 52 GLY CA C 52 44.040 44.040 43.534 0.506 25155 6222 1 8 . 1 1 52 52 GLY H H 52 8.949 8.949 7.791 1.158 25155 6223 1 8 . 1 1 53 53 ILE N N 53 124.912 124.912 120.788 4.124 25155 6224 1 8 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.357 -0.182 25155 6225 1 8 . 1 1 53 53 ILE C C 53 174.470 174.470 172.744 1.726 25155 6226 1 8 . 1 1 53 53 ILE CA C 53 55.850 55.850 58.111 -2.261 25155 6227 1 8 . 1 1 53 53 ILE CB C 53 42.800 42.800 41.811 0.989 25155 6228 1 8 . 1 1 53 53 ILE H H 53 8.612 8.612 7.345 1.267 25155 6229 1 8 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.826 -0.014 25155 6230 1 8 . 1 1 54 54 PRO C C 54 174.565 174.565 175.874 -1.309 25155 6231 1 8 . 1 1 54 54 PRO CA C 54 61.850 61.850 62.349 -0.499 25155 6232 1 8 . 1 1 54 54 PRO CB C 54 32.400 32.400 31.992 0.408 25155 6233 1 8 . 1 1 55 55 THR N N 55 116.040 116.040 121.748 -5.708 25155 6234 1 8 . 1 1 55 55 THR HA H 55 4.522 4.522 4.327 0.195 25155 6235 1 8 . 1 1 55 55 THR C C 55 173.990 173.990 173.513 0.477 25155 6236 1 8 . 1 1 55 55 THR CA C 55 62.845 62.845 62.391 0.455 25155 6237 1 8 . 1 1 55 55 THR CB C 55 70.795 70.795 69.343 1.452 25155 6238 1 8 . 1 1 55 55 THR H H 55 7.663 7.663 8.781 -1.119 25155 6239 1 8 . 1 1 56 56 TRP N N 56 130.540 130.540 128.579 1.961 25155 6240 1 8 . 1 1 56 56 TRP CA C 56 54.800 54.800 57.984 -3.184 25155 6241 1 8 . 1 1 56 56 TRP H H 56 9.075 9.075 8.403 0.672 25155 6242 1 8 . 1 1 58 58 PHE HA H 58 4.540 4.540 4.712 -0.172 25155 6243 1 8 . 1 1 58 58 PHE C C 58 177.070 177.070 175.269 1.801 25155 6244 1 8 . 1 1 58 58 PHE CA C 58 55.460 55.460 57.651 -2.191 25155 6245 1 8 . 1 1 58 58 PHE CB C 58 41.200 41.200 41.444 -0.244 25155 6246 1 8 . 1 1 59 59 GLY N N 59 109.796 109.796 111.724 -1.928 25155 6247 1 8 . 1 1 59 59 GLY CA C 59 45.763 45.763 45.021 0.742 25155 6248 1 8 . 1 1 59 59 GLY H H 59 8.392 8.392 7.958 0.434 25155 6249 1 8 . 1 1 60 60 GLU C C 60 175.660 175.660 175.662 -0.002 25155 6250 1 8 . 1 1 61 61 ILE N N 61 122.380 122.380 121.202 1.178 25155 6251 1 8 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.354 1.086 25155 6252 1 8 . 1 1 61 61 ILE CA C 61 62.100 62.100 62.482 -0.382 25155 6253 1 8 . 1 1 61 61 ILE CB C 61 38.750 38.750 37.073 1.677 25155 6254 1 8 . 1 1 61 61 ILE H H 61 8.436 8.436 8.000 0.436 25155 6255 1 8 . 1 1 62 62 GLN CB C 62 30.570 30.570 29.311 1.258 25155 6256 1 8 . 1 1 63 63 GLU HA H 63 4.030 4.030 3.932 0.098 25155 6257 1 8 . 1 1 63 63 GLU C C 63 177.134 177.134 177.933 -0.799 25155 6258 1 8 . 1 1 63 63 GLU CA C 63 60.520 60.520 60.659 -0.139 25155 6259 1 8 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.621 0.029 25155 6260 1 8 . 1 1 64 64 ASP N N 64 119.630 119.630 117.294 2.336 25155 6261 1 8 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.480 0.112 25155 6262 1 8 . 1 1 64 64 ASP C C 64 178.680 178.680 177.543 1.137 25155 6263 1 8 . 1 1 64 64 ASP CA C 64 57.823 57.823 56.741 1.082 25155 6264 1 8 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.422 0.678 25155 6265 1 8 . 1 1 65 65 TRP N N 65 120.535 120.535 121.434 -0.899 25155 6266 1 8 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.679 -0.354 25155 6267 1 8 . 1 1 65 65 TRP C C 65 178.684 178.684 177.284 1.400 25155 6268 1 8 . 1 1 65 65 TRP CA C 65 60.500 60.500 59.934 0.566 25155 6269 1 8 . 1 1 65 65 TRP CB C 65 30.100 30.100 31.700 -1.600 25155 6270 1 8 . 1 1 65 65 TRP H H 65 7.416 7.416 7.767 -0.351 25155 6271 1 8 . 1 1 66 66 GLU N N 66 120.760 120.760 120.925 -0.165 25155 6272 1 8 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.242 -0.422 25155 6273 1 8 . 1 1 66 66 GLU C C 66 178.860 178.860 178.829 0.031 25155 6274 1 8 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.758 0.342 25155 6275 1 8 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.590 -0.580 25155 6276 1 8 . 1 1 67 67 ALA N N 67 118.972 118.972 121.836 -2.864 25155 6277 1 8 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.192 0.055 25155 6278 1 8 . 1 1 67 67 ALA C C 67 179.610 179.610 178.922 0.688 25155 6279 1 8 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.907 -0.307 25155 6280 1 8 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.871 -0.083 25155 6281 1 8 . 1 1 67 67 ALA H H 67 7.690 7.690 8.475 -0.784 25155 6282 1 8 . 1 1 68 68 VAL N N 68 107.530 107.530 110.753 -3.223 25155 6283 1 8 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.329 0.381 25155 6284 1 8 . 1 1 68 68 VAL C C 68 176.800 176.800 177.236 -0.436 25155 6285 1 8 . 1 1 68 68 VAL CA C 68 60.060 60.060 62.548 -2.489 25155 6286 1 8 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.440 0.160 25155 6287 1 8 . 1 1 68 68 VAL H H 68 7.240 7.240 7.492 -0.252 25155 6288 1 8 . 1 1 69 69 TRP N N 69 126.960 126.960 125.642 1.318 25155 6289 1 8 . 1 1 69 69 TRP HA H 69 4.182 4.182 4.076 0.106 25155 6290 1 8 . 1 1 69 69 TRP C C 69 178.640 178.640 176.805 1.835 25155 6291 1 8 . 1 1 69 69 TRP CA C 69 61.300 61.300 62.372 -1.072 25155 6292 1 8 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.399 2.171 25155 6293 1 8 . 1 1 69 69 TRP H H 69 7.810 7.810 7.965 -0.155 25155 6294 1 8 . 1 1 70 70 ASP N N 70 114.644 114.644 116.618 -1.974 25155 6295 1 8 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.176 0.343 25155 6296 1 8 . 1 1 70 70 ASP C C 70 178.685 178.685 178.083 0.602 25155 6297 1 8 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.401 -0.401 25155 6298 1 8 . 1 1 70 70 ASP CB C 70 39.810 39.810 41.004 -1.194 25155 6299 1 8 . 1 1 71 71 GLN N N 71 120.100 120.100 117.062 3.038 25155 6300 1 8 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.237 -0.047 25155 6301 1 8 . 1 1 71 71 GLN C C 71 178.870 178.870 178.249 0.621 25155 6302 1 8 . 1 1 71 71 GLN CA C 71 57.617 57.617 56.964 0.653 25155 6303 1 8 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.492 -0.672 25155 6304 1 8 . 1 1 71 71 GLN H H 71 7.980 7.980 7.867 0.113 25155 6305 1 8 . 1 1 72 72 LEU N N 72 117.535 117.535 119.671 -2.136 25155 6306 1 8 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.911 -0.114 25155 6307 1 8 . 1 1 72 72 LEU C C 72 178.308 178.308 177.675 0.633 25155 6308 1 8 . 1 1 72 72 LEU CA C 72 57.340 57.340 57.145 0.195 25155 6309 1 8 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.635 0.065 25155 6310 1 8 . 1 1 72 72 LEU H H 72 7.435 7.435 7.592 -0.157 25155 6311 1 8 . 1 1 73 73 ASP N N 73 115.534 115.534 116.695 -1.161 25155 6312 1 8 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.404 -0.254 25155 6313 1 8 . 1 1 73 73 ASP C C 73 177.553 177.553 177.090 0.463 25155 6314 1 8 . 1 1 73 73 ASP CA C 73 57.350 57.350 56.194 1.156 25155 6315 1 8 . 1 1 73 73 ASP CB C 73 40.040 40.040 41.378 -1.338 25155 6316 1 8 . 1 1 74 74 ASP N N 74 117.300 117.300 120.111 -2.811 25155 6317 1 8 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.489 0.217 25155 6318 1 8 . 1 1 74 74 ASP C C 74 176.424 176.424 177.289 -0.865 25155 6319 1 8 . 1 1 74 74 ASP CA C 74 54.170 54.170 55.596 -1.426 25155 6320 1 8 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.337 0.482 25155 6321 1 8 . 1 1 75 75 LEU N N 75 118.500 118.500 120.543 -2.043 25155 6322 1 8 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.179 0.116 25155 6323 1 8 . 1 1 75 75 LEU C C 75 176.800 176.800 176.538 0.262 25155 6324 1 8 . 1 1 75 75 LEU CA C 75 54.400 54.400 55.155 -0.755 25155 6325 1 8 . 1 1 75 75 LEU CB C 75 43.280 43.280 41.671 1.609 25155 6326 1 8 . 1 1 75 75 LEU H H 75 6.966 6.966 7.396 -0.430 25155 6327 1 8 . 1 1 76 76 ASN N N 76 123.040 123.040 121.202 1.838 25155 6328 1 8 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.645 0.217 25155 6329 1 8 . 1 1 76 76 ASN C C 76 174.927 174.927 174.343 0.584 25155 6330 1 8 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.694 -1.812 25155 6331 1 8 . 1 1 76 76 ASN CB C 76 37.510 37.510 38.716 -1.206 25155 6332 1 8 . 1 1 76 76 ASN H H 76 9.882 9.882 8.985 0.897 25155 6333 1 8 . 1 1 77 77 LEU N N 77 123.614 123.614 123.716 -0.102 25155 6334 1 8 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.575 -0.205 25155 6335 1 8 . 1 1 77 77 LEU C C 77 175.110 175.110 176.349 -1.239 25155 6336 1 8 . 1 1 77 77 LEU CA C 77 52.200 52.200 54.258 -2.058 25155 6337 1 8 . 1 1 77 77 LEU CB C 77 42.786 42.786 43.168 -0.382 25155 6338 1 8 . 1 1 77 77 LEU H H 77 8.700 8.700 8.262 0.438 25155 6339 1 8 . 1 1 78 78 GLU N N 78 120.822 120.822 121.603 -0.781 25155 6340 1 8 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.268 -0.368 25155 6341 1 8 . 1 1 78 78 GLU C C 78 178.670 178.670 178.339 0.331 25155 6342 1 8 . 1 1 78 78 GLU CA C 78 58.700 58.700 58.270 0.430 25155 6343 1 8 . 1 1 78 78 GLU CB C 78 29.467 29.467 29.588 -0.121 25155 6344 1 8 . 1 1 79 79 GLY N N 79 113.160 113.160 114.890 -1.730 25155 6345 1 8 . 1 1 79 79 GLY C C 79 174.523 174.523 173.507 1.016 25155 6346 1 8 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.689 -0.269 25155 6347 1 8 . 1 1 79 79 GLY H H 79 8.450 8.450 8.541 -0.091 25155 6348 1 8 . 1 1 80 80 LYS N N 80 120.283 120.283 119.911 0.372 25155 6349 1 8 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.350 0.008 25155 6350 1 8 . 1 1 80 80 LYS C C 80 175.304 175.304 176.009 -0.705 25155 6351 1 8 . 1 1 80 80 LYS CA C 80 56.890 56.890 56.087 0.803 25155 6352 1 8 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.649 -0.529 25155 6353 1 8 . 1 1 81 81 ILE N N 81 122.288 122.288 121.777 0.511 25155 6354 1 8 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.300 0.506 25155 6355 1 8 . 1 1 81 81 ILE C C 81 174.750 174.750 175.534 -0.784 25155 6356 1 8 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.581 -1.762 25155 6357 1 8 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.235 0.615 25155 6358 1 8 . 1 1 81 81 ILE H H 81 7.405 7.405 7.871 -0.466 25155 6359 1 8 . 1 1 82 82 VAL N N 82 127.793 127.793 125.760 2.033 25155 6360 1 8 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.204 0.076 25155 6361 1 8 . 1 1 82 82 VAL C C 82 172.680 172.680 174.140 -1.460 25155 6362 1 8 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.064 0.036 25155 6363 1 8 . 1 1 82 82 VAL CB C 82 35.280 35.280 36.169 -0.889 25155 6364 1 8 . 1 1 82 82 VAL H H 82 8.800 8.800 8.984 -0.184 25155 6365 1 8 . 1 1 83 83 ALA N N 83 130.911 130.911 128.282 2.629 25155 6366 1 8 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.462 -0.073 25155 6367 1 8 . 1 1 83 83 ALA C C 83 175.870 175.870 175.883 -0.013 25155 6368 1 8 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.368 0.632 25155 6369 1 8 . 1 1 83 83 ALA CB C 83 23.722 23.722 22.646 1.075 25155 6370 1 8 . 1 1 83 83 ALA H H 83 9.252 9.252 9.013 0.239 25155 6371 1 8 . 1 1 84 84 LEU N N 84 124.269 124.269 122.236 2.033 25155 6372 1 8 . 1 1 84 84 LEU HA H 84 5.508 5.508 5.384 0.124 25155 6373 1 8 . 1 1 84 84 LEU C C 84 175.490 175.490 175.534 -0.044 25155 6374 1 8 . 1 1 84 84 LEU CA C 84 53.670 53.670 53.957 -0.287 25155 6375 1 8 . 1 1 84 84 LEU CB C 84 45.000 45.000 45.815 -0.815 25155 6376 1 8 . 1 1 84 84 LEU H H 84 10.378 10.378 9.141 1.237 25155 6377 1 8 . 1 1 85 85 TYR N N 85 115.826 115.826 119.615 -3.789 25155 6378 1 8 . 1 1 85 85 TYR HA H 85 4.950 4.950 5.261 -0.311 25155 6379 1 8 . 1 1 85 85 TYR C C 85 172.661 172.661 173.622 -0.961 25155 6380 1 8 . 1 1 85 85 TYR CA C 85 55.853 55.853 55.380 0.472 25155 6381 1 8 . 1 1 85 85 TYR CB C 85 43.200 43.200 41.396 1.804 25155 6382 1 8 . 1 1 85 85 TYR H H 85 9.200 9.200 8.664 0.536 25155 6383 1 8 . 1 1 86 86 GLY N N 86 106.802 106.802 105.311 1.491 25155 6384 1 8 . 1 1 86 86 GLY C C 86 170.348 170.348 170.907 -0.559 25155 6385 1 8 . 1 1 86 86 GLY CA C 86 44.687 44.687 44.708 -0.021 25155 6386 1 8 . 1 1 86 86 GLY H H 86 8.752 8.752 8.338 0.414 25155 6387 1 8 . 1 1 87 87 LEU N N 87 120.860 120.860 121.138 -0.278 25155 6388 1 8 . 1 1 87 87 LEU HA H 87 5.476 5.476 5.280 0.196 25155 6389 1 8 . 1 1 87 87 LEU C C 87 177.720 177.720 175.029 2.691 25155 6390 1 8 . 1 1 87 87 LEU CA C 87 52.630 52.630 52.263 0.367 25155 6391 1 8 . 1 1 87 87 LEU CB C 87 45.900 45.900 45.217 0.683 25155 6392 1 8 . 1 1 87 87 LEU H H 87 6.320 6.320 7.711 -1.391 25155 6393 1 8 . 1 1 88 88 GLY N N 88 109.910 109.910 109.637 0.273 25155 6394 1 8 . 1 1 88 88 GLY C C 88 171.386 171.386 171.539 -0.153 25155 6395 1 8 . 1 1 88 88 GLY CA C 88 45.710 45.710 45.635 0.075 25155 6396 1 8 . 1 1 88 88 GLY H H 88 8.320 8.320 7.856 0.464 25155 6397 1 8 . 1 1 89 89 ASP N N 89 121.580 121.580 119.022 2.558 25155 6398 1 8 . 1 1 89 89 ASP HA H 89 5.190 5.190 5.441 -0.251 25155 6399 1 8 . 1 1 89 89 ASP C C 89 176.608 176.608 177.247 -0.639 25155 6400 1 8 . 1 1 89 89 ASP CA C 89 52.200 52.200 52.498 -0.298 25155 6401 1 8 . 1 1 89 89 ASP CB C 89 41.900 41.900 43.540 -1.640 25155 6402 1 8 . 1 1 90 90 GLN N N 90 123.900 123.900 124.361 -0.461 25155 6403 1 8 . 1 1 90 90 GLN HA H 90 3.645 3.645 4.164 -0.519 25155 6404 1 8 . 1 1 90 90 GLN C C 90 173.523 173.523 176.199 -2.676 25155 6405 1 8 . 1 1 90 90 GLN CA C 90 58.706 58.706 57.236 1.470 25155 6406 1 8 . 1 1 90 90 GLN CB C 90 28.800 28.800 28.845 -0.045 25155 6407 1 8 . 1 1 90 90 GLN H H 90 8.726 8.726 8.503 0.223 25155 6408 1 8 . 1 1 91 91 LEU N N 91 117.080 117.080 119.090 -2.010 25155 6409 1 8 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.166 0.304 25155 6410 1 8 . 1 1 91 91 LEU C C 91 179.840 179.840 178.870 0.970 25155 6411 1 8 . 1 1 91 91 LEU CA C 91 55.800 55.800 55.536 0.264 25155 6412 1 8 . 1 1 91 91 LEU CB C 91 41.640 41.640 42.185 -0.545 25155 6413 1 8 . 1 1 91 91 LEU H H 91 7.092 7.092 8.528 -1.436 25155 6414 1 8 . 1 1 92 92 GLY N N 92 110.460 110.460 105.585 4.875 25155 6415 1 8 . 1 1 92 92 GLY C C 92 174.824 174.824 174.673 0.151 25155 6416 1 8 . 1 1 92 92 GLY CA C 92 46.390 46.390 46.944 -0.554 25155 6417 1 8 . 1 1 92 92 GLY H H 92 9.243 9.243 8.706 0.537 25155 6418 1 8 . 1 1 93 93 TYR N N 93 118.140 118.140 119.581 -1.441 25155 6419 1 8 . 1 1 93 93 TYR HA H 93 5.173 5.173 4.490 0.683 25155 6420 1 8 . 1 1 93 93 TYR C C 93 177.805 177.805 177.027 0.778 25155 6421 1 8 . 1 1 93 93 TYR CA C 93 57.430 57.430 58.076 -0.646 25155 6422 1 8 . 1 1 93 93 TYR CB C 93 39.300 39.300 40.495 -1.195 25155 6423 1 8 . 1 1 93 93 TYR H H 93 7.252 7.252 7.699 -0.447 25155 6424 1 8 . 1 1 94 94 GLY N N 94 112.455 112.455 108.596 3.859 25155 6425 1 8 . 1 1 94 94 GLY C C 94 177.740 177.740 175.987 1.753 25155 6426 1 8 . 1 1 94 94 GLY CA C 94 49.880 49.880 46.605 3.275 25155 6427 1 8 . 1 1 94 94 GLY H H 94 8.154 8.154 8.642 -0.488 25155 6428 1 8 . 1 1 95 95 GLU N N 95 123.040 123.040 122.000 1.040 25155 6429 1 8 . 1 1 95 95 GLU HA H 95 4.000 4.000 4.037 -0.037 25155 6430 1 8 . 1 1 95 95 GLU C C 95 175.145 175.145 177.442 -2.297 25155 6431 1 8 . 1 1 95 95 GLU CA C 95 57.950 57.950 58.615 -0.665 25155 6432 1 8 . 1 1 95 95 GLU CB C 95 27.400 27.400 29.226 -1.826 25155 6433 1 8 . 1 1 96 96 TRP N N 96 118.000 118.000 116.463 1.537 25155 6434 1 8 . 1 1 96 96 TRP HA H 96 5.213 5.213 4.713 0.500 25155 6435 1 8 . 1 1 96 96 TRP C C 96 176.616 176.616 176.085 0.531 25155 6436 1 8 . 1 1 96 96 TRP CA C 96 57.120 57.120 54.919 2.201 25155 6437 1 8 . 1 1 96 96 TRP CB C 96 29.970 29.970 27.556 2.414 25155 6438 1 8 . 1 1 96 96 TRP H H 96 7.785 7.785 7.564 0.221 25155 6439 1 8 . 1 1 97 97 PHE N N 97 123.268 123.268 120.718 2.550 25155 6440 1 8 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.417 0.243 25155 6441 1 8 . 1 1 97 97 PHE CA C 97 58.742 58.742 60.236 -1.494 25155 6442 1 8 . 1 1 97 97 PHE CB C 97 40.835 40.835 40.449 0.386 25155 6443 1 8 . 1 1 97 97 PHE H H 97 7.054 7.054 7.836 -0.782 25155 6444 1 8 . 1 1 98 98 LEU HA H 98 3.440 3.440 4.298 -0.858 25155 6445 1 8 . 1 1 98 98 LEU C C 98 176.613 176.613 175.816 0.797 25155 6446 1 8 . 1 1 98 98 LEU CA C 98 56.000 56.000 53.413 2.587 25155 6447 1 8 . 1 1 98 98 LEU CB C 98 38.600 38.600 40.922 -2.321 25155 6448 1 8 . 1 1 98 98 LEU H H 98 8.584 8.584 8.076 0.508 25155 6449 1 8 . 1 1 99 99 ASP N N 99 123.268 123.268 122.189 1.079 25155 6450 1 8 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.294 -0.329 25155 6451 1 8 . 1 1 99 99 ASP C C 99 178.876 178.876 177.191 1.685 25155 6452 1 8 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.459 1.801 25155 6453 1 8 . 1 1 99 99 ASP CB C 99 40.350 40.350 40.963 -0.613 25155 6454 1 8 . 1 1 100 100 ALA N N 100 119.124 119.124 120.845 -1.721 25155 6455 1 8 . 1 1 100 100 ALA HA H 100 3.822 3.822 3.839 -0.017 25155 6456 1 8 . 1 1 100 100 ALA C C 100 178.490 178.490 178.741 -0.251 25155 6457 1 8 . 1 1 100 100 ALA CA C 100 55.100 55.100 54.640 0.460 25155 6458 1 8 . 1 1 100 100 ALA CB C 100 19.700 19.700 18.310 1.390 25155 6459 1 8 . 1 1 100 100 ALA H H 100 8.400 8.400 7.408 0.992 25155 6460 1 8 . 1 1 101 101 LEU N N 101 118.687 118.687 120.558 -1.871 25155 6461 1 8 . 1 1 101 101 LEU HA H 101 3.674 3.674 3.912 -0.238 25155 6462 1 8 . 1 1 101 101 LEU C C 101 179.050 179.050 178.667 0.383 25155 6463 1 8 . 1 1 101 101 LEU CA C 101 57.800 57.800 57.190 0.610 25155 6464 1 8 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.560 1.090 25155 6465 1 8 . 1 1 101 101 LEU H H 101 6.518 6.518 7.476 -0.958 25155 6466 1 8 . 1 1 102 102 GLY N N 102 104.410 104.410 106.513 -2.103 25155 6467 1 8 . 1 1 102 102 GLY C C 102 176.056 176.056 176.058 -0.002 25155 6468 1 8 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.260 0.490 25155 6469 1 8 . 1 1 102 102 GLY H H 102 7.712 7.712 7.949 -0.237 25155 6470 1 8 . 1 1 103 103 MET N N 103 120.550 120.550 121.351 -0.801 25155 6471 1 8 . 1 1 103 103 MET HA H 103 4.256 4.256 4.231 0.025 25155 6472 1 8 . 1 1 103 103 MET C C 103 179.650 179.650 178.074 1.576 25155 6473 1 8 . 1 1 103 103 MET CA C 103 59.450 59.450 59.581 -0.131 25155 6474 1 8 . 1 1 103 103 MET CB C 103 32.300 32.300 32.804 -0.504 25155 6475 1 8 . 1 1 103 103 MET H H 103 8.485 8.485 8.305 0.180 25155 6476 1 8 . 1 1 104 104 LEU N N 104 123.480 123.480 120.520 2.960 25155 6477 1 8 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.317 -0.256 25155 6478 1 8 . 1 1 104 104 LEU C C 104 177.750 177.750 178.081 -0.331 25155 6479 1 8 . 1 1 104 104 LEU CA C 104 58.100 58.100 57.267 0.832 25155 6480 1 8 . 1 1 104 104 LEU CB C 104 41.450 41.450 41.575 -0.125 25155 6481 1 8 . 1 1 104 104 LEU H H 104 8.392 8.392 8.054 0.338 25155 6482 1 8 . 1 1 105 105 HIS N N 105 119.570 119.570 120.144 -0.574 25155 6483 1 8 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.216 -0.364 25155 6484 1 8 . 1 1 105 105 HIS C C 105 177.550 177.550 176.903 0.647 25155 6485 1 8 . 1 1 105 105 HIS CA C 105 61.000 61.000 60.271 0.729 25155 6486 1 8 . 1 1 105 105 HIS CB C 105 28.820 28.820 29.507 -0.687 25155 6487 1 8 . 1 1 105 105 HIS H H 105 8.247 8.247 8.403 -0.156 25155 6488 1 8 . 1 1 106 106 ASP N N 106 119.780 119.780 118.659 1.121 25155 6489 1 8 . 1 1 106 106 ASP HA H 106 4.333 4.333 3.843 0.490 25155 6490 1 8 . 1 1 106 106 ASP C C 106 179.410 179.410 178.461 0.949 25155 6491 1 8 . 1 1 106 106 ASP CA C 106 57.800 57.800 56.992 0.808 25155 6492 1 8 . 1 1 106 106 ASP CB C 106 40.600 40.600 40.906 -0.306 25155 6493 1 8 . 1 1 107 107 LYS N N 107 121.660 121.660 119.267 2.393 25155 6494 1 8 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.064 0.036 25155 6495 1 8 . 1 1 107 107 LYS C C 107 178.316 178.316 178.764 -0.448 25155 6496 1 8 . 1 1 107 107 LYS CA C 107 58.750 58.750 58.987 -0.237 25155 6497 1 8 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.589 -0.739 25155 6498 1 8 . 1 1 108 108 LEU N N 108 116.050 116.050 118.010 -1.960 25155 6499 1 8 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.418 -0.408 25155 6500 1 8 . 1 1 108 108 LEU C C 108 179.050 179.050 178.807 0.243 25155 6501 1 8 . 1 1 108 108 LEU CA C 108 56.240 56.240 56.444 -0.204 25155 6502 1 8 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.471 -0.671 25155 6503 1 8 . 1 1 108 108 LEU H H 108 8.072 8.072 7.830 0.242 25155 6504 1 8 . 1 1 109 109 SER N N 109 116.280 116.280 116.105 0.175 25155 6505 1 8 . 1 1 109 109 SER HA H 109 4.300 4.300 4.384 -0.084 25155 6506 1 8 . 1 1 109 109 SER C C 109 175.848 175.848 176.334 -0.486 25155 6507 1 8 . 1 1 109 109 SER CA C 109 62.410 62.410 61.875 0.535 25155 6508 1 8 . 1 1 109 109 SER CB C 109 62.850 62.850 63.028 -0.178 25155 6509 1 8 . 1 1 109 109 SER H H 109 8.366 8.366 8.428 -0.062 25155 6510 1 8 . 1 1 110 110 THR N N 110 110.416 110.416 111.462 -1.046 25155 6511 1 8 . 1 1 110 110 THR HA H 110 4.614 4.614 4.343 0.271 25155 6512 1 8 . 1 1 110 110 THR C C 110 175.675 175.675 175.662 0.013 25155 6513 1 8 . 1 1 110 110 THR CA C 110 62.030 62.030 63.564 -1.534 25155 6514 1 8 . 1 1 110 110 THR CB C 110 68.810 68.810 68.883 -0.073 25155 6515 1 8 . 1 1 110 110 THR H H 110 7.185 7.185 8.093 -0.908 25155 6516 1 8 . 1 1 111 111 LYS N N 111 120.090 120.090 120.816 -0.726 25155 6517 1 8 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.436 0.077 25155 6518 1 8 . 1 1 111 111 LYS C C 111 176.814 176.814 176.621 0.193 25155 6519 1 8 . 1 1 111 111 LYS CA C 111 55.730 55.730 55.734 -0.004 25155 6520 1 8 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.447 -1.517 25155 6521 1 8 . 1 1 112 112 GLY N N 112 107.540 107.540 107.770 -0.230 25155 6522 1 8 . 1 1 112 112 GLY C C 112 176.223 176.223 174.505 1.718 25155 6523 1 8 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.501 1.425 25155 6524 1 8 . 1 1 112 112 GLY H H 112 8.315 8.315 7.623 0.692 25155 6525 1 8 . 1 1 113 113 VAL N N 113 113.536 113.536 116.113 -2.577 25155 6526 1 8 . 1 1 113 113 VAL HA H 113 4.494 4.494 4.388 0.106 25155 6527 1 8 . 1 1 113 113 VAL C C 113 174.560 174.560 174.977 -0.417 25155 6528 1 8 . 1 1 113 113 VAL CA C 113 59.550 59.550 60.972 -1.422 25155 6529 1 8 . 1 1 113 113 VAL CB C 113 32.800 32.800 32.016 0.784 25155 6530 1 8 . 1 1 113 113 VAL H H 113 6.835 6.835 7.124 -0.289 25155 6531 1 8 . 1 1 114 114 LYS N N 114 122.920 122.920 121.012 1.908 25155 6532 1 8 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.373 0.121 25155 6533 1 8 . 1 1 114 114 LYS C C 114 174.925 174.925 174.736 0.189 25155 6534 1 8 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.058 0.222 25155 6535 1 8 . 1 1 114 114 LYS CB C 114 33.630 33.630 34.774 -1.144 25155 6536 1 8 . 1 1 115 115 PHE N N 115 123.140 123.140 123.153 -0.013 25155 6537 1 8 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.419 0.281 25155 6538 1 8 . 1 1 115 115 PHE C C 115 177.580 177.580 176.239 1.341 25155 6539 1 8 . 1 1 115 115 PHE CA C 115 58.677 58.677 56.824 1.853 25155 6540 1 8 . 1 1 115 115 PHE CB C 115 41.120 41.120 40.179 0.941 25155 6541 1 8 . 1 1 115 115 PHE H H 115 8.506 8.506 8.469 0.037 25155 6542 1 8 . 1 1 116 116 VAL N N 116 115.737 115.737 116.253 -0.516 25155 6543 1 8 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.390 0.088 25155 6544 1 8 . 1 1 116 116 VAL C C 116 175.300 175.300 175.223 0.077 25155 6545 1 8 . 1 1 116 116 VAL CA C 116 58.877 58.877 59.102 -0.225 25155 6546 1 8 . 1 1 116 116 VAL CB C 116 34.120 34.120 34.400 -0.280 25155 6547 1 8 . 1 1 116 116 VAL H H 116 8.860 8.860 8.648 0.212 25155 6548 1 8 . 1 1 117 117 GLY N N 117 108.137 108.137 110.027 -1.890 25155 6549 1 8 . 1 1 117 117 GLY C C 117 176.110 176.110 174.529 1.581 25155 6550 1 8 . 1 1 117 117 GLY CA C 117 47.500 47.500 45.073 2.427 25155 6551 1 8 . 1 1 117 117 GLY H H 117 9.838 9.838 8.067 1.771 25155 6552 1 8 . 1 1 118 118 TYR N N 118 120.380 120.380 120.309 0.071 25155 6553 1 8 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.469 0.501 25155 6554 1 8 . 1 1 118 118 TYR C C 118 177.630 177.630 174.868 2.762 25155 6555 1 8 . 1 1 118 118 TYR CA C 118 55.800 55.800 59.577 -3.777 25155 6556 1 8 . 1 1 118 118 TYR CB C 118 35.970 35.970 37.761 -1.791 25155 6557 1 8 . 1 1 118 118 TYR H H 118 8.652 8.652 8.215 0.437 25155 6558 1 8 . 1 1 119 119 TRP N N 119 126.040 126.040 118.696 7.344 25155 6559 1 8 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.091 0.930 25155 6560 1 8 . 1 1 119 119 TRP C C 119 173.000 173.000 173.916 -0.916 25155 6561 1 8 . 1 1 119 119 TRP CA C 119 53.820 53.820 55.989 -2.169 25155 6562 1 8 . 1 1 119 119 TRP CB C 119 36.050 36.050 33.378 2.672 25155 6563 1 8 . 1 1 119 119 TRP H H 119 8.070 8.070 8.200 -0.130 25155 6564 1 8 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.581 0.203 25155 6565 1 8 . 1 1 120 120 PRO C C 120 176.870 176.870 176.564 0.306 25155 6566 1 8 . 1 1 120 120 PRO CA C 120 63.780 63.780 62.831 0.949 25155 6567 1 8 . 1 1 120 120 PRO CB C 120 31.990 31.990 32.199 -0.209 25155 6568 1 8 . 1 1 121 121 THR N N 121 109.310 109.310 112.756 -3.446 25155 6569 1 8 . 1 1 121 121 THR HA H 121 4.073 4.073 3.940 0.133 25155 6570 1 8 . 1 1 121 121 THR C C 121 176.324 176.324 175.443 0.881 25155 6571 1 8 . 1 1 121 121 THR CA C 121 61.250 61.250 63.361 -2.111 25155 6572 1 8 . 1 1 121 121 THR CB C 121 69.730 69.730 68.572 1.158 25155 6573 1 8 . 1 1 121 121 THR H H 121 7.370 7.370 8.418 -1.048 25155 6574 1 8 . 1 1 122 122 GLU N N 122 123.937 123.937 122.594 1.343 25155 6575 1 8 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.149 0.075 25155 6576 1 8 . 1 1 122 122 GLU C C 122 177.737 177.737 177.717 0.020 25155 6577 1 8 . 1 1 122 122 GLU CA C 122 58.200 58.200 57.447 0.753 25155 6578 1 8 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.438 0.362 25155 6579 1 8 . 1 1 123 123 GLY N N 123 114.563 114.563 112.857 1.706 25155 6580 1 8 . 1 1 123 123 GLY C C 123 173.783 173.783 174.243 -0.460 25155 6581 1 8 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.320 0.060 25155 6582 1 8 . 1 1 123 123 GLY H H 123 9.144 9.144 8.800 0.344 25155 6583 1 8 . 1 1 124 124 TYR N N 124 118.800 118.800 121.696 -2.896 25155 6584 1 8 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.586 0.632 25155 6585 1 8 . 1 1 124 124 TYR C C 124 175.673 175.673 175.832 -0.159 25155 6586 1 8 . 1 1 124 124 TYR CA C 124 56.950 56.950 59.545 -2.595 25155 6587 1 8 . 1 1 124 124 TYR CB C 124 41.100 41.100 40.210 0.890 25155 6588 1 8 . 1 1 124 124 TYR H H 124 7.895 7.895 7.943 -0.048 25155 6589 1 8 . 1 1 125 125 GLU N N 125 124.790 124.790 125.381 -0.591 25155 6590 1 8 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.543 0.142 25155 6591 1 8 . 1 1 125 125 GLU C C 125 172.877 172.877 175.345 -2.468 25155 6592 1 8 . 1 1 125 125 GLU CA C 125 55.700 55.700 55.508 0.192 25155 6593 1 8 . 1 1 125 125 GLU CB C 125 31.340 31.340 30.561 0.779 25155 6594 1 8 . 1 1 126 126 PHE N N 126 118.670 118.670 120.249 -1.579 25155 6595 1 8 . 1 1 126 126 PHE HA H 126 4.841 4.841 5.021 -0.180 25155 6596 1 8 . 1 1 126 126 PHE C C 126 173.800 173.800 174.039 -0.239 25155 6597 1 8 . 1 1 126 126 PHE CA C 126 56.950 56.950 56.826 0.124 25155 6598 1 8 . 1 1 126 126 PHE CB C 126 40.300 40.300 40.706 -0.406 25155 6599 1 8 . 1 1 126 126 PHE H H 126 7.645 7.645 7.947 -0.302 25155 6600 1 8 . 1 1 127 127 THR N N 127 107.038 107.038 114.062 -7.024 25155 6601 1 8 . 1 1 127 127 THR HA H 127 4.370 4.370 4.317 0.053 25155 6602 1 8 . 1 1 127 127 THR C C 127 175.100 175.100 174.586 0.514 25155 6603 1 8 . 1 1 127 127 THR CA C 127 61.080 61.080 62.002 -0.922 25155 6604 1 8 . 1 1 127 127 THR CB C 127 70.500 70.500 69.376 1.123 25155 6605 1 8 . 1 1 127 127 THR H H 127 7.306 7.306 8.994 -1.688 25155 6606 1 8 . 1 1 128 128 SER N N 128 118.150 118.150 120.616 -2.466 25155 6607 1 8 . 1 1 128 128 SER HA H 128 4.650 4.650 4.756 -0.106 25155 6608 1 8 . 1 1 128 128 SER C C 128 175.760 175.760 174.136 1.624 25155 6609 1 8 . 1 1 128 128 SER CA C 128 55.813 55.813 56.762 -0.949 25155 6610 1 8 . 1 1 128 128 SER CB C 128 65.300 65.300 63.651 1.649 25155 6611 1 8 . 1 1 128 128 SER H H 128 7.354 7.354 8.358 -1.004 25155 6612 1 8 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.505 0.259 25155 6613 1 8 . 1 1 129 129 PRO C C 129 178.860 178.860 178.509 0.351 25155 6614 1 8 . 1 1 129 129 PRO CA C 129 62.728 62.728 64.572 -1.844 25155 6615 1 8 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.407 -0.007 25155 6616 1 8 . 1 1 130 130 LYS N N 130 122.158 122.158 119.275 2.883 25155 6617 1 8 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.216 -0.006 25155 6618 1 8 . 1 1 130 130 LYS C C 130 176.890 176.890 175.536 1.354 25155 6619 1 8 . 1 1 130 130 LYS CA C 130 61.375 61.375 60.590 0.785 25155 6620 1 8 . 1 1 130 130 LYS CB C 130 30.350 30.350 31.140 -0.790 25155 6621 1 8 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.419 0.114 25155 6622 1 8 . 1 1 131 131 PRO C C 131 173.810 173.810 175.722 -1.912 25155 6623 1 8 . 1 1 131 131 PRO CA C 131 64.510 64.510 63.165 1.345 25155 6624 1 8 . 1 1 131 131 PRO CB C 131 31.745 31.745 31.199 0.546 25155 6625 1 8 . 1 1 132 132 VAL N N 132 114.480 114.480 114.028 0.452 25155 6626 1 8 . 1 1 132 132 VAL HA H 132 5.158 5.158 4.887 0.271 25155 6627 1 8 . 1 1 132 132 VAL C C 132 175.137 175.137 173.829 1.308 25155 6628 1 8 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.355 0.445 25155 6629 1 8 . 1 1 132 132 VAL CB C 132 34.780 34.780 35.710 -0.930 25155 6630 1 8 . 1 1 132 132 VAL H H 132 6.716 6.716 7.562 -0.846 25155 6631 1 8 . 1 1 133 133 ILE N N 133 120.670 120.670 112.923 7.747 25155 6632 1 8 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.512 -0.120 25155 6633 1 8 . 1 1 133 133 ILE C C 133 175.485 175.485 174.952 0.533 25155 6634 1 8 . 1 1 133 133 ILE CA C 133 60.000 60.000 59.099 0.901 25155 6635 1 8 . 1 1 133 133 ILE CB C 133 42.020 42.020 41.288 0.733 25155 6636 1 8 . 1 1 133 133 ILE H H 133 8.740 8.740 8.363 0.377 25155 6637 1 8 . 1 1 134 134 ALA N N 134 122.454 122.454 123.193 -0.739 25155 6638 1 8 . 1 1 134 134 ALA HA H 134 3.953 3.953 3.921 0.032 25155 6639 1 8 . 1 1 134 134 ALA C C 134 178.387 178.387 177.271 1.116 25155 6640 1 8 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.399 -0.349 25155 6641 1 8 . 1 1 134 134 ALA CB C 134 16.982 16.982 17.078 -0.095 25155 6642 1 8 . 1 1 134 134 ALA H H 134 8.490 8.490 8.551 -0.061 25155 6643 1 8 . 1 1 135 135 ASP N N 135 117.310 117.310 116.422 0.888 25155 6644 1 8 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.324 -0.080 25155 6645 1 8 . 1 1 135 135 ASP C C 135 176.390 176.390 176.917 -0.527 25155 6646 1 8 . 1 1 135 135 ASP CA C 135 55.120 55.120 54.394 0.726 25155 6647 1 8 . 1 1 135 135 ASP CB C 135 39.865 39.865 40.068 -0.203 25155 6648 1 8 . 1 1 136 136 GLY N N 136 104.336 104.336 103.861 0.475 25155 6649 1 8 . 1 1 136 136 GLY C C 136 174.940 174.940 175.358 -0.418 25155 6650 1 8 . 1 1 136 136 GLY CA C 136 45.150 45.150 45.306 -0.156 25155 6651 1 8 . 1 1 136 136 GLY H H 136 7.592 7.592 7.940 -0.348 25155 6652 1 8 . 1 1 137 137 GLN N N 137 118.675 118.675 118.937 -0.262 25155 6653 1 8 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.368 -0.306 25155 6654 1 8 . 1 1 137 137 GLN C C 137 176.420 176.420 175.266 1.154 25155 6655 1 8 . 1 1 137 137 GLN CA C 137 57.760 57.760 56.546 1.214 25155 6656 1 8 . 1 1 137 137 GLN CB C 137 30.400 30.400 29.937 0.463 25155 6657 1 8 . 1 1 137 137 GLN H H 137 7.843 7.843 7.773 0.070 25155 6658 1 8 . 1 1 138 138 LEU N N 138 118.160 118.160 118.645 -0.485 25155 6659 1 8 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.396 0.565 25155 6660 1 8 . 1 1 138 138 LEU C C 138 175.700 175.700 174.111 1.589 25155 6661 1 8 . 1 1 138 138 LEU CA C 138 53.705 53.705 54.560 -0.855 25155 6662 1 8 . 1 1 138 138 LEU CB C 138 46.480 46.480 46.168 0.312 25155 6663 1 8 . 1 1 138 138 LEU H H 138 7.356 7.356 7.246 0.110 25155 6664 1 8 . 1 1 139 139 PHE N N 139 119.060 119.060 121.716 -2.656 25155 6665 1 8 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.631 0.713 25155 6666 1 8 . 1 1 139 139 PHE C C 139 178.850 178.850 176.605 2.245 25155 6667 1 8 . 1 1 139 139 PHE CA C 139 56.670 56.670 58.456 -1.786 25155 6668 1 8 . 1 1 139 139 PHE CB C 139 43.652 43.652 39.674 3.978 25155 6669 1 8 . 1 1 139 139 PHE H H 139 10.026 10.026 9.188 0.838 25155 6670 1 8 . 1 1 140 140 VAL N N 140 109.905 109.905 121.994 -12.089 25155 6671 1 8 . 1 1 140 140 VAL HA H 140 3.500 3.500 3.302 0.198 25155 6672 1 8 . 1 1 140 140 VAL C C 140 172.860 172.860 175.007 -2.147 25155 6673 1 8 . 1 1 140 140 VAL CA C 140 61.812 61.812 61.160 0.652 25155 6674 1 8 . 1 1 140 140 VAL CB C 140 30.250 30.250 30.844 -0.594 25155 6675 1 8 . 1 1 140 140 VAL H H 140 7.550 7.550 8.386 -0.836 25155 6676 1 8 . 1 1 141 141 GLY N N 141 106.600 106.600 106.278 0.322 25155 6677 1 8 . 1 1 141 141 GLY C C 141 171.350 171.350 172.622 -1.272 25155 6678 1 8 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.888 0.572 25155 6679 1 8 . 1 1 141 141 GLY H H 141 7.052 7.052 7.325 -0.273 25155 6680 1 8 . 1 1 142 142 LEU N N 142 117.820 117.820 120.033 -2.213 25155 6681 1 8 . 1 1 142 142 LEU HA H 142 4.962 4.962 4.094 0.868 25155 6682 1 8 . 1 1 142 142 LEU CA C 142 55.600 55.600 54.025 1.575 25155 6683 1 8 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.534 -4.604 25155 6684 1 8 . 1 1 142 142 LEU H H 142 7.643 7.643 8.194 -0.551 25155 6685 1 8 . 1 1 143 143 ALA HA H 143 4.220 4.220 3.808 0.412 25155 6686 1 8 . 1 1 143 143 ALA C C 143 175.505 175.505 175.462 0.043 25155 6687 1 8 . 1 1 143 143 ALA CA C 143 49.600 49.600 49.820 -0.220 25155 6688 1 8 . 1 1 143 143 ALA CB C 143 23.330 23.330 18.471 4.859 25155 6689 1 8 . 1 1 144 144 LEU N N 144 124.960 124.960 124.774 0.186 25155 6690 1 8 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.441 0.339 25155 6691 1 8 . 1 1 144 144 LEU C C 144 174.700 174.700 174.926 -0.226 25155 6692 1 8 . 1 1 144 144 LEU CA C 144 52.790 52.790 53.875 -1.085 25155 6693 1 8 . 1 1 144 144 LEU CB C 144 45.300 45.300 44.391 0.909 25155 6694 1 8 . 1 1 144 144 LEU H H 144 8.583 8.583 8.154 0.429 25155 6695 1 8 . 1 1 145 145 ASP N N 145 119.100 119.100 121.819 -2.719 25155 6696 1 8 . 1 1 145 145 ASP HA H 145 5.422 5.422 5.214 0.208 25155 6697 1 8 . 1 1 145 145 ASP C C 145 176.180 176.180 175.049 1.131 25155 6698 1 8 . 1 1 145 145 ASP CA C 145 53.600 53.600 53.206 0.393 25155 6699 1 8 . 1 1 145 145 ASP CB C 145 43.180 43.180 43.261 -0.081 25155 6700 1 8 . 1 1 147 147 THR HA H 147 4.093 4.093 4.518 -0.425 25155 6701 1 8 . 1 1 147 147 THR C C 147 175.858 175.858 175.291 0.567 25155 6702 1 8 . 1 1 147 147 THR CA C 147 66.400 66.400 63.618 2.781 25155 6703 1 8 . 1 1 147 147 THR CB C 147 69.400 69.400 70.329 -0.929 25155 6704 1 8 . 1 1 147 147 THR H H 147 8.745 8.745 8.663 0.082 25155 6705 1 8 . 1 1 148 148 ASN N N 148 115.408 115.408 118.579 -3.171 25155 6706 1 8 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.703 0.307 25155 6707 1 8 . 1 1 148 148 ASN C C 148 175.750 175.750 174.739 1.011 25155 6708 1 8 . 1 1 148 148 ASN CA C 148 53.400 53.400 54.779 -1.379 25155 6709 1 8 . 1 1 148 148 ASN CB C 148 41.900 41.900 39.828 2.072 25155 6710 1 8 . 1 1 148 148 ASN H H 148 8.975 8.975 8.827 0.148 25155 6711 1 8 . 1 1 149 149 GLN N N 149 117.900 117.900 116.442 1.458 25155 6712 1 8 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.572 0.364 25155 6713 1 8 . 1 1 149 149 GLN C C 149 178.280 178.280 174.039 4.241 25155 6714 1 8 . 1 1 149 149 GLN CA C 149 53.730 53.730 55.046 -1.316 25155 6715 1 8 . 1 1 149 149 GLN CB C 149 29.790 29.790 32.307 -2.517 25155 6716 1 8 . 1 1 149 149 GLN H H 149 7.430 7.430 7.416 0.014 25155 6717 1 8 . 1 1 150 150 TYR N N 150 121.060 121.060 119.069 1.991 25155 6718 1 8 . 1 1 150 150 TYR HA H 150 4.671 4.671 4.638 0.033 25155 6719 1 8 . 1 1 150 150 TYR C C 150 178.680 178.680 177.667 1.013 25155 6720 1 8 . 1 1 150 150 TYR CA C 150 57.930 57.930 59.015 -1.085 25155 6721 1 8 . 1 1 150 150 TYR CB C 150 38.860 38.860 40.103 -1.243 25155 6722 1 8 . 1 1 150 150 TYR H H 150 8.115 8.115 8.701 -0.586 25155 6723 1 8 . 1 1 151 151 ASP N N 151 121.175 121.175 121.645 -0.470 25155 6724 1 8 . 1 1 151 151 ASP CA C 151 57.000 57.000 56.855 0.145 25155 6725 1 8 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.712 1.288 25155 6726 1 8 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.674 -0.084 25155 6727 1 8 . 1 1 152 152 LEU C C 152 178.300 178.300 177.414 0.886 25155 6728 1 8 . 1 1 152 152 LEU CA C 152 54.788 54.788 55.414 -0.626 25155 6729 1 8 . 1 1 152 152 LEU CB C 152 42.200 42.200 41.788 0.412 25155 6730 1 8 . 1 1 153 153 SER N N 153 116.170 116.170 118.087 -1.917 25155 6731 1 8 . 1 1 153 153 SER HA H 153 3.911 3.911 4.022 -0.111 25155 6732 1 8 . 1 1 153 153 SER CA C 153 63.400 63.400 62.101 1.299 25155 6733 1 8 . 1 1 153 153 SER CB C 153 63.200 63.200 63.050 0.150 25155 6734 1 8 . 1 1 153 153 SER H H 153 7.378 7.378 7.775 -0.397 25155 6735 1 8 . 1 1 154 154 ASP N N 154 121.640 121.640 120.922 0.718 25155 6736 1 8 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.333 -0.093 25155 6737 1 8 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.594 1.706 25155 6738 1 8 . 1 1 154 154 ASP CB C 154 40.000 40.000 40.948 -0.948 25155 6739 1 8 . 1 1 155 155 GLU HA H 155 4.170 4.170 4.029 0.141 25155 6740 1 8 . 1 1 155 155 GLU C C 155 179.420 179.420 178.919 0.501 25155 6741 1 8 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.361 -0.161 25155 6742 1 8 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.535 -0.055 25155 6743 1 8 . 1 1 156 156 ARG N N 156 121.230 121.230 119.026 2.204 25155 6744 1 8 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.204 0.072 25155 6745 1 8 . 1 1 156 156 ARG C C 156 177.350 177.350 179.406 -2.056 25155 6746 1 8 . 1 1 156 156 ARG CA C 156 59.950 59.950 59.544 0.406 25155 6747 1 8 . 1 1 156 156 ARG CB C 156 31.100 31.100 30.197 0.903 25155 6748 1 8 . 1 1 157 157 ILE N N 157 118.190 118.190 119.126 -0.936 25155 6749 1 8 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.724 -0.294 25155 6750 1 8 . 1 1 157 157 ILE C C 157 178.480 178.480 178.241 0.239 25155 6751 1 8 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.047 1.512 25155 6752 1 8 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.963 0.517 25155 6753 1 8 . 1 1 157 157 ILE H H 157 8.705 8.705 8.016 0.689 25155 6754 1 8 . 1 1 158 158 GLN N N 158 119.975 119.975 120.982 -1.007 25155 6755 1 8 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.898 0.058 25155 6756 1 8 . 1 1 158 158 GLN C C 158 178.730 178.730 178.219 0.511 25155 6757 1 8 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.305 1.395 25155 6758 1 8 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.340 0.142 25155 6759 1 8 . 1 1 158 158 GLN H H 158 8.262 8.262 8.566 -0.304 25155 6760 1 8 . 1 1 159 159 SER N N 159 115.466 115.466 115.201 0.265 25155 6761 1 8 . 1 1 159 159 SER HA H 159 4.446 4.446 4.288 0.158 25155 6762 1 8 . 1 1 159 159 SER C C 159 177.320 177.320 176.803 0.517 25155 6763 1 8 . 1 1 159 159 SER CA C 159 63.500 63.500 61.097 2.403 25155 6764 1 8 . 1 1 159 159 SER CB C 159 63.818 63.818 63.207 0.611 25155 6765 1 8 . 1 1 159 159 SER H H 159 8.440 8.440 8.194 0.246 25155 6766 1 8 . 1 1 160 160 TRP N N 160 126.784 126.784 124.968 1.816 25155 6767 1 8 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.417 0.037 25155 6768 1 8 . 1 1 160 160 TRP C C 160 177.934 177.934 177.768 0.166 25155 6769 1 8 . 1 1 160 160 TRP CA C 160 62.745 62.745 62.231 0.514 25155 6770 1 8 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.379 -0.029 25155 6771 1 8 . 1 1 160 160 TRP H H 160 9.243 9.243 7.701 1.542 25155 6772 1 8 . 1 1 161 161 CYS N N 161 116.395 116.395 118.691 -2.296 25155 6773 1 8 . 1 1 161 161 CYS HA H 161 3.886 3.886 3.811 0.075 25155 6774 1 8 . 1 1 161 161 CYS C C 161 176.245 176.245 177.011 -0.766 25155 6775 1 8 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.738 0.562 25155 6776 1 8 . 1 1 161 161 CYS CB C 161 27.723 27.723 27.022 0.701 25155 6777 1 8 . 1 1 161 161 CYS H H 161 8.845 8.845 9.040 -0.195 25155 6778 1 8 . 1 1 162 162 GLU N N 162 118.030 118.030 119.499 -1.469 25155 6779 1 8 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.874 0.046 25155 6780 1 8 . 1 1 162 162 GLU C C 162 178.700 178.700 178.757 -0.057 25155 6781 1 8 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.475 0.325 25155 6782 1 8 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.254 0.246 25155 6783 1 8 . 1 1 163 163 GLN N N 163 120.650 120.650 119.655 0.995 25155 6784 1 8 . 1 1 163 163 GLN HA H 163 4.173 4.173 4.030 0.143 25155 6785 1 8 . 1 1 163 163 GLN C C 163 179.700 179.700 178.434 1.266 25155 6786 1 8 . 1 1 163 163 GLN CA C 163 59.688 59.688 58.944 0.744 25155 6787 1 8 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.757 0.143 25155 6788 1 8 . 1 1 163 163 GLN H H 163 8.148 8.148 7.887 0.261 25155 6789 1 8 . 1 1 164 164 ILE N N 164 114.836 114.836 117.439 -2.603 25155 6790 1 8 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.514 0.546 25155 6791 1 8 . 1 1 164 164 ILE C C 164 178.676 178.676 177.474 1.202 25155 6792 1 8 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.499 1.661 25155 6793 1 8 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.240 0.390 25155 6794 1 8 . 1 1 164 164 ILE H H 164 8.958 8.958 8.174 0.784 25155 6795 1 8 . 1 1 165 165 LEU N N 165 123.700 123.700 119.781 3.919 25155 6796 1 8 . 1 1 165 165 LEU HA H 165 4.100 4.100 4.029 0.071 25155 6797 1 8 . 1 1 165 165 LEU C C 165 180.548 180.548 178.386 2.162 25155 6798 1 8 . 1 1 165 165 LEU CA C 165 58.150 58.150 58.193 -0.043 25155 6799 1 8 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.437 -0.307 25155 6800 1 8 . 1 1 165 165 LEU H H 165 7.830 7.830 7.793 0.037 25155 6801 1 8 . 1 1 166 166 ASN N N 166 120.160 120.160 118.691 1.469 25155 6802 1 8 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.354 0.216 25155 6803 1 8 . 1 1 166 166 ASN C C 166 175.690 175.690 177.522 -1.832 25155 6804 1 8 . 1 1 166 166 ASN CA C 166 55.946 55.946 56.760 -0.814 25155 6805 1 8 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.205 0.275 25155 6806 1 8 . 1 1 166 166 ASN H H 166 7.706 7.706 7.745 -0.039 25155 6807 1 8 . 1 1 167 167 GLU N N 167 121.286 121.286 121.169 0.117 25155 6808 1 8 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.052 0.052 25155 6809 1 8 . 1 1 167 167 GLU C C 167 180.520 180.520 179.154 1.366 25155 6810 1 8 . 1 1 167 167 GLU CA C 167 59.920 59.920 59.159 0.761 25155 6811 1 8 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.526 1.399 25155 6812 1 8 . 1 1 168 168 MET N N 168 118.622 118.622 115.068 3.554 25155 6813 1 8 . 1 1 168 168 MET HA H 168 3.996 3.996 4.317 -0.321 25155 6814 1 8 . 1 1 168 168 MET C C 168 176.856 176.856 177.971 -1.115 25155 6815 1 8 . 1 1 168 168 MET CA C 168 59.500 59.500 58.788 0.712 25155 6816 1 8 . 1 1 168 168 MET CB C 168 33.700 33.700 32.631 1.069 25155 6817 1 8 . 1 1 168 168 MET H H 168 8.723 8.723 8.476 0.247 25155 6818 1 8 . 1 1 169 169 ALA N N 169 121.760 121.760 123.423 -1.663 25155 6819 1 8 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.188 -0.032 25155 6820 1 8 . 1 1 169 169 ALA C C 169 179.790 179.790 179.677 0.113 25155 6821 1 8 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.615 0.184 25155 6822 1 8 . 1 1 169 169 ALA CB C 169 18.220 18.220 18.589 -0.369 25155 6823 1 8 . 1 1 169 169 ALA H H 169 7.494 7.494 7.738 -0.244 25155 6824 1 8 . 1 1 170 170 GLU N N 170 116.970 116.970 118.537 -1.567 25155 6825 1 8 . 1 1 170 170 GLU HA H 170 4.091 4.091 4.048 0.043 25155 6826 1 8 . 1 1 170 170 GLU C C 170 177.745 177.745 178.464 -0.719 25155 6827 1 8 . 1 1 170 170 GLU CA C 170 58.000 58.000 58.807 -0.807 25155 6828 1 8 . 1 1 170 170 GLU CB C 170 29.730 29.730 29.610 0.120 25155 6829 1 8 . 1 1 171 171 HIS N N 171 118.150 118.150 117.103 1.047 25155 6830 1 8 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.362 0.108 25155 6831 1 8 . 1 1 171 171 HIS C C 171 175.848 175.848 176.136 -0.288 25155 6832 1 8 . 1 1 171 171 HIS CA C 171 57.600 57.600 58.172 -0.572 25155 6833 1 8 . 1 1 171 171 HIS CB C 171 30.800 30.800 29.980 0.820 25155 6834 1 8 . 1 1 171 171 HIS H H 171 7.717 7.717 7.918 -0.201 25155 6835 1 8 . 1 1 172 172 TYR N N 172 119.483 119.483 118.813 0.670 25155 6836 1 8 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.236 0.355 25155 6837 1 8 . 1 1 172 172 TYR C C 172 174.590 174.590 176.023 -1.433 25155 6838 1 8 . 1 1 172 172 TYR CA C 172 57.813 57.813 59.029 -1.216 25155 6839 1 8 . 1 1 172 172 TYR CB C 172 38.900 38.900 39.089 -0.189 25155 6840 1 8 . 1 1 172 172 TYR H H 172 7.778 7.778 7.547 0.231 25155 6841 1 9 . 1 1 2 2 ASN N N 2 122.966 122.966 118.856 4.110 25155 6842 1 9 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.113 0.062 25155 6843 1 9 . 1 1 2 2 ASN C C 2 175.200 175.200 173.330 1.870 25155 6844 1 9 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.319 0.601 25155 6845 1 9 . 1 1 2 2 ASN CB C 2 40.000 40.000 41.554 -1.554 25155 6846 1 9 . 1 1 2 2 ASN H H 2 9.392 9.392 8.129 1.263 25155 6847 1 9 . 1 1 3 3 MET N N 3 120.660 120.660 117.102 3.558 25155 6848 1 9 . 1 1 3 3 MET HA H 3 5.565 5.565 5.214 0.351 25155 6849 1 9 . 1 1 3 3 MET C C 3 174.200 174.200 175.380 -1.180 25155 6850 1 9 . 1 1 3 3 MET CA C 3 54.550 54.550 54.522 0.028 25155 6851 1 9 . 1 1 3 3 MET CB C 3 34.100 34.100 36.599 -2.499 25155 6852 1 9 . 1 1 3 3 MET H H 3 8.745 8.745 8.881 -0.136 25155 6853 1 9 . 1 1 4 4 GLY N N 4 115.792 115.792 109.270 6.522 25155 6854 1 9 . 1 1 4 4 GLY C C 4 170.444 170.444 171.619 -1.175 25155 6855 1 9 . 1 1 4 4 GLY CA C 4 42.887 42.887 42.818 0.069 25155 6856 1 9 . 1 1 4 4 GLY H H 4 8.989 8.989 8.886 0.103 25155 6857 1 9 . 1 1 5 5 LEU N N 5 131.175 131.175 125.871 5.304 25155 6858 1 9 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.232 1.090 25155 6859 1 9 . 1 1 5 5 LEU C C 5 175.700 175.700 174.588 1.112 25155 6860 1 9 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.358 -0.038 25155 6861 1 9 . 1 1 5 5 LEU CB C 5 44.700 44.700 43.620 1.080 25155 6862 1 9 . 1 1 5 5 LEU H H 5 8.917 8.917 8.286 0.631 25155 6863 1 9 . 1 1 6 6 PHE N N 6 125.990 125.990 125.452 0.538 25155 6864 1 9 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.534 0.204 25155 6865 1 9 . 1 1 6 6 PHE C C 6 174.358 174.358 173.629 0.729 25155 6866 1 9 . 1 1 6 6 PHE CA C 6 55.480 55.480 54.948 0.532 25155 6867 1 9 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.434 -0.384 25155 6868 1 9 . 1 1 6 6 PHE H H 6 9.225 9.225 9.085 0.140 25155 6869 1 9 . 1 1 7 7 TYR N N 7 118.040 118.040 115.946 2.094 25155 6870 1 9 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.615 0.314 25155 6871 1 9 . 1 1 7 7 TYR C C 7 171.690 171.690 174.328 -2.638 25155 6872 1 9 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.377 -0.917 25155 6873 1 9 . 1 1 7 7 TYR CB C 7 40.800 40.800 40.417 0.383 25155 6874 1 9 . 1 1 7 7 TYR H H 7 8.235 8.235 8.018 0.217 25155 6875 1 9 . 1 1 8 8 GLY N N 8 106.640 106.640 107.153 -0.513 25155 6876 1 9 . 1 1 8 8 GLY C C 8 171.682 171.682 173.685 -2.003 25155 6877 1 9 . 1 1 8 8 GLY CA C 8 44.050 44.050 43.683 0.367 25155 6878 1 9 . 1 1 8 8 GLY H H 8 6.996 6.996 8.735 -1.739 25155 6879 1 9 . 1 1 9 9 SER N N 9 118.164 118.164 112.615 5.549 25155 6880 1 9 . 1 1 9 9 SER C C 9 174.560 174.560 173.737 0.823 25155 6881 1 9 . 1 1 9 9 SER CA C 9 57.140 57.140 58.983 -1.843 25155 6882 1 9 . 1 1 9 9 SER H H 9 9.680 9.680 8.851 0.829 25155 6883 1 9 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.892 -0.262 25155 6884 1 9 . 1 1 17 17 ALA C C 17 177.740 177.740 178.650 -0.910 25155 6885 1 9 . 1 1 17 17 ALA CA C 17 54.900 54.900 55.538 -0.638 25155 6886 1 9 . 1 1 17 17 ALA CB C 17 17.790 17.790 17.843 -0.053 25155 6887 1 9 . 1 1 17 17 ALA H H 17 8.055 8.055 7.709 0.346 25155 6888 1 9 . 1 1 18 18 ALA N N 18 120.026 120.026 120.322 -0.296 25155 6889 1 9 . 1 1 18 18 ALA HA H 18 3.713 3.713 3.736 -0.023 25155 6890 1 9 . 1 1 18 18 ALA C C 18 179.040 179.040 179.465 -0.425 25155 6891 1 9 . 1 1 18 18 ALA CA C 18 54.860 54.860 55.185 -0.325 25155 6892 1 9 . 1 1 18 18 ALA CB C 18 18.200 18.200 17.349 0.851 25155 6893 1 9 . 1 1 18 18 ALA H H 18 7.015 7.015 7.615 -0.600 25155 6894 1 9 . 1 1 19 19 GLU N N 19 116.656 116.656 118.446 -1.790 25155 6895 1 9 . 1 1 19 19 GLU HA H 19 3.580 3.580 4.021 -0.441 25155 6896 1 9 . 1 1 19 19 GLU C C 19 178.487 178.487 179.008 -0.521 25155 6897 1 9 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.308 0.362 25155 6898 1 9 . 1 1 19 19 GLU CB C 19 29.400 29.400 29.373 0.027 25155 6899 1 9 . 1 1 20 20 LYS N N 20 120.100 120.100 119.515 0.585 25155 6900 1 9 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.096 0.250 25155 6901 1 9 . 1 1 20 20 LYS C C 20 175.330 175.330 179.261 -3.931 25155 6902 1 9 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.342 -2.242 25155 6903 1 9 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.558 0.442 25155 6904 1 9 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.760 -0.295 25155 6905 1 9 . 1 1 21 21 ILE C C 21 177.680 177.680 178.043 -0.363 25155 6906 1 9 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.534 0.106 25155 6907 1 9 . 1 1 21 21 ILE CB C 21 38.030 38.030 37.904 0.126 25155 6908 1 9 . 1 1 21 21 ILE H H 21 8.220 8.220 8.605 -0.385 25155 6909 1 9 . 1 1 22 22 ARG N N 22 119.433 119.433 118.391 1.042 25155 6910 1 9 . 1 1 22 22 ARG HA H 22 3.550 3.550 3.978 -0.428 25155 6911 1 9 . 1 1 22 22 ARG C C 22 177.268 177.268 178.257 -0.989 25155 6912 1 9 . 1 1 22 22 ARG CA C 22 59.760 59.760 59.371 0.389 25155 6913 1 9 . 1 1 22 22 ARG CB C 22 28.900 28.900 29.480 -0.580 25155 6914 1 9 . 1 1 23 23 ASP N N 23 118.945 118.945 119.439 -0.494 25155 6915 1 9 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.455 -0.113 25155 6916 1 9 . 1 1 23 23 ASP C C 23 178.470 178.470 178.618 -0.148 25155 6917 1 9 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.139 0.311 25155 6918 1 9 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.898 -0.528 25155 6919 1 9 . 1 1 24 24 ILE N N 24 121.200 121.200 119.267 1.933 25155 6920 1 9 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.839 -0.105 25155 6921 1 9 . 1 1 24 24 ILE C C 24 178.297 178.297 177.938 0.359 25155 6922 1 9 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.492 0.008 25155 6923 1 9 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.561 0.179 25155 6924 1 9 . 1 1 24 24 ILE H H 24 8.160 8.160 7.993 0.167 25155 6925 1 9 . 1 1 25 25 ILE N N 25 121.166 121.166 117.860 3.306 25155 6926 1 9 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.861 -0.218 25155 6927 1 9 . 1 1 25 25 ILE C C 25 176.825 176.825 176.810 0.015 25155 6928 1 9 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.372 2.518 25155 6929 1 9 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.852 -1.102 25155 6930 1 9 . 1 1 25 25 ILE H H 25 8.480 8.480 8.008 0.472 25155 6931 1 9 . 1 1 26 26 GLY N N 26 109.050 109.050 105.078 3.972 25155 6932 1 9 . 1 1 26 26 GLY C C 26 173.800 173.800 172.625 1.175 25155 6933 1 9 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.492 -0.092 25155 6934 1 9 . 1 1 26 26 GLY H H 26 7.945 7.945 7.872 0.073 25155 6935 1 9 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.355 0.008 25155 6936 1 9 . 1 1 27 27 PRO C C 27 177.157 177.157 178.014 -0.857 25155 6937 1 9 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.916 0.614 25155 6938 1 9 . 1 1 27 27 PRO CB C 27 32.000 32.000 31.904 0.096 25155 6939 1 9 . 1 1 28 28 GLU N N 28 116.510 116.510 118.117 -1.607 25155 6940 1 9 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.214 0.046 25155 6941 1 9 . 1 1 28 28 GLU C C 28 177.000 177.000 176.937 0.063 25155 6942 1 9 . 1 1 28 28 GLU CA C 28 57.680 57.680 58.331 -0.651 25155 6943 1 9 . 1 1 28 28 GLU CB C 28 28.620 28.620 28.870 -0.251 25155 6944 1 9 . 1 1 29 29 LEU N N 29 120.334 120.334 113.144 7.190 25155 6945 1 9 . 1 1 29 29 LEU HA H 29 4.650 4.650 4.758 -0.108 25155 6946 1 9 . 1 1 29 29 LEU C C 29 175.676 175.676 174.692 0.984 25155 6947 1 9 . 1 1 29 29 LEU CA C 29 55.924 55.924 54.429 1.495 25155 6948 1 9 . 1 1 29 29 LEU CB C 29 44.880 44.880 43.485 1.395 25155 6949 1 9 . 1 1 29 29 LEU H H 29 7.924 7.924 7.575 0.349 25155 6950 1 9 . 1 1 30 30 VAL N N 30 118.900 118.900 119.903 -1.003 25155 6951 1 9 . 1 1 30 30 VAL HA H 30 4.639 4.639 4.959 -0.320 25155 6952 1 9 . 1 1 30 30 VAL C C 30 174.368 174.368 175.830 -1.462 25155 6953 1 9 . 1 1 30 30 VAL CA C 30 61.110 61.110 60.859 0.251 25155 6954 1 9 . 1 1 30 30 VAL CB C 30 34.500 34.500 35.710 -1.210 25155 6955 1 9 . 1 1 30 30 VAL H H 30 7.486 7.486 7.209 0.277 25155 6956 1 9 . 1 1 31 31 THR N N 31 124.000 124.000 119.797 4.203 25155 6957 1 9 . 1 1 31 31 THR HA H 31 4.331 4.331 4.778 -0.447 25155 6958 1 9 . 1 1 31 31 THR C C 31 172.670 172.670 172.957 -0.287 25155 6959 1 9 . 1 1 31 31 THR CA C 31 61.784 61.784 61.139 0.645 25155 6960 1 9 . 1 1 31 31 THR CB C 31 70.483 70.483 71.388 -0.905 25155 6961 1 9 . 1 1 31 31 THR H H 31 7.947 7.947 8.491 -0.544 25155 6962 1 9 . 1 1 32 32 LEU N N 32 127.408 127.408 125.349 2.059 25155 6963 1 9 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.438 0.199 25155 6964 1 9 . 1 1 32 32 LEU C C 32 176.425 176.425 176.752 -0.327 25155 6965 1 9 . 1 1 32 32 LEU CA C 32 54.760 54.760 55.202 -0.442 25155 6966 1 9 . 1 1 32 32 LEU CB C 32 43.809 43.809 42.909 0.900 25155 6967 1 9 . 1 1 32 32 LEU H H 32 8.614 8.614 8.547 0.067 25155 6968 1 9 . 1 1 33 33 HIS N N 33 120.230 120.230 121.985 -1.755 25155 6969 1 9 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.671 -0.251 25155 6970 1 9 . 1 1 33 33 HIS C C 33 171.914 171.914 173.943 -2.029 25155 6971 1 9 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.476 0.824 25155 6972 1 9 . 1 1 33 33 HIS CB C 33 32.050 32.050 31.286 0.764 25155 6973 1 9 . 1 1 33 33 HIS H H 33 9.130 9.130 8.881 0.249 25155 6974 1 9 . 1 1 34 34 ASN N N 34 123.987 123.987 120.396 3.591 25155 6975 1 9 . 1 1 34 34 ASN HA H 34 3.600 3.600 3.863 -0.263 25155 6976 1 9 . 1 1 34 34 ASN C C 34 177.930 177.930 175.351 2.579 25155 6977 1 9 . 1 1 34 34 ASN CA C 34 51.730 51.730 54.000 -2.270 25155 6978 1 9 . 1 1 34 34 ASN CB C 34 38.747 38.747 38.706 0.041 25155 6979 1 9 . 1 1 34 34 ASN H H 34 8.759 8.759 8.220 0.539 25155 6980 1 9 . 1 1 35 35 LEU N N 35 128.751 128.751 124.823 3.928 25155 6981 1 9 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.168 0.122 25155 6982 1 9 . 1 1 35 35 LEU C C 35 177.363 177.363 178.353 -0.990 25155 6983 1 9 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.475 0.075 25155 6984 1 9 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.866 0.896 25155 6985 1 9 . 1 1 35 35 LEU H H 35 8.758 8.758 8.808 -0.050 25155 6986 1 9 . 1 1 36 36 LYS N N 36 120.870 120.870 118.703 2.167 25155 6987 1 9 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.045 -0.112 25155 6988 1 9 . 1 1 36 36 LYS C C 36 176.540 176.540 177.710 -1.170 25155 6989 1 9 . 1 1 36 36 LYS CA C 36 59.260 59.260 58.391 0.869 25155 6990 1 9 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.370 0.430 25155 6991 1 9 . 1 1 37 37 ASP N N 37 115.288 115.288 118.241 -2.953 25155 6992 1 9 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.497 0.250 25155 6993 1 9 . 1 1 37 37 ASP C C 37 175.500 175.500 176.454 -0.954 25155 6994 1 9 . 1 1 37 37 ASP CA C 37 54.805 54.805 55.874 -1.069 25155 6995 1 9 . 1 1 37 37 ASP CB C 37 44.650 44.650 42.012 2.638 25155 6996 1 9 . 1 1 38 38 ASP N N 38 121.550 121.550 116.161 5.389 25155 6997 1 9 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.918 -0.053 25155 6998 1 9 . 1 1 38 38 ASP C C 38 174.895 174.895 174.600 0.295 25155 6999 1 9 . 1 1 38 38 ASP CA C 38 52.840 52.840 53.043 -0.203 25155 7000 1 9 . 1 1 38 38 ASP CB C 38 42.240 42.240 44.679 -2.439 25155 7001 1 9 . 1 1 39 39 SER N N 39 115.170 115.170 116.896 -1.726 25155 7002 1 9 . 1 1 39 39 SER HA H 39 4.600 4.600 4.706 -0.106 25155 7003 1 9 . 1 1 39 39 SER C C 39 174.930 174.930 174.123 0.807 25155 7004 1 9 . 1 1 39 39 SER CA C 39 54.786 54.786 57.562 -2.776 25155 7005 1 9 . 1 1 39 39 SER CB C 39 64.840 64.840 63.429 1.411 25155 7006 1 9 . 1 1 39 39 SER H H 39 8.330 8.330 8.478 -0.148 25155 7007 1 9 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.448 -0.448 25155 7008 1 9 . 1 1 40 40 PRO C C 40 176.620 176.620 177.996 -1.376 25155 7009 1 9 . 1 1 40 40 PRO CA C 40 63.870 63.870 65.003 -1.133 25155 7010 1 9 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.789 -0.429 25155 7011 1 9 . 1 1 41 41 LYS N N 41 120.913 120.913 117.803 3.110 25155 7012 1 9 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.207 -0.311 25155 7013 1 9 . 1 1 41 41 LYS C C 41 179.580 179.580 178.545 1.035 25155 7014 1 9 . 1 1 41 41 LYS CA C 41 58.000 58.000 57.907 0.093 25155 7015 1 9 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.258 0.842 25155 7016 1 9 . 1 1 42 42 LEU N N 42 118.206 118.206 120.758 -2.552 25155 7017 1 9 . 1 1 42 42 LEU HA H 42 4.025 4.025 4.036 -0.011 25155 7018 1 9 . 1 1 42 42 LEU C C 42 178.630 178.630 178.569 0.061 25155 7019 1 9 . 1 1 42 42 LEU CA C 42 57.030 57.030 57.086 -0.056 25155 7020 1 9 . 1 1 42 42 LEU CB C 42 41.820 41.820 40.770 1.050 25155 7021 1 9 . 1 1 42 42 LEU H H 42 7.598 7.598 7.597 0.001 25155 7022 1 9 . 1 1 43 43 MET N N 43 118.913 118.913 116.921 1.992 25155 7023 1 9 . 1 1 43 43 MET HA H 43 3.760 3.760 4.170 -0.410 25155 7024 1 9 . 1 1 43 43 MET C C 43 177.710 177.710 178.073 -0.363 25155 7025 1 9 . 1 1 43 43 MET CA C 43 59.864 59.864 58.485 1.379 25155 7026 1 9 . 1 1 43 43 MET CB C 43 32.680 32.680 31.893 0.787 25155 7027 1 9 . 1 1 43 43 MET H H 43 8.180 8.180 8.063 0.117 25155 7028 1 9 . 1 1 44 44 GLU N N 44 110.906 110.906 118.404 -7.498 25155 7029 1 9 . 1 1 44 44 GLU HA H 44 3.732 3.732 4.099 -0.367 25155 7030 1 9 . 1 1 44 44 GLU C C 44 178.120 178.120 179.061 -0.941 25155 7031 1 9 . 1 1 44 44 GLU CA C 44 59.450 59.450 58.963 0.487 25155 7032 1 9 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.497 0.303 25155 7033 1 9 . 1 1 45 45 GLN N N 45 115.770 115.770 117.888 -2.118 25155 7034 1 9 . 1 1 45 45 GLN HA H 45 4.190 4.190 3.968 0.222 25155 7035 1 9 . 1 1 45 45 GLN C C 45 175.480 175.480 176.445 -0.965 25155 7036 1 9 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.333 -1.232 25155 7037 1 9 . 1 1 45 45 GLN CB C 45 28.490 28.490 28.769 -0.279 25155 7038 1 9 . 1 1 45 45 GLN H H 45 7.517 7.517 7.500 0.017 25155 7039 1 9 . 1 1 46 46 TYR N N 46 117.840 117.840 117.337 0.503 25155 7040 1 9 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.511 0.149 25155 7041 1 9 . 1 1 46 46 TYR C C 46 175.480 175.480 176.695 -1.215 25155 7042 1 9 . 1 1 46 46 TYR CA C 46 58.827 58.827 58.210 0.617 25155 7043 1 9 . 1 1 46 46 TYR CB C 46 41.720 41.720 38.533 3.187 25155 7044 1 9 . 1 1 46 46 TYR H H 46 6.955 6.955 7.396 -0.441 25155 7045 1 9 . 1 1 47 47 ASP N N 47 121.540 121.540 122.633 -1.093 25155 7046 1 9 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.534 0.162 25155 7047 1 9 . 1 1 47 47 ASP C C 47 175.677 175.677 175.966 -0.289 25155 7048 1 9 . 1 1 47 47 ASP CA C 47 56.812 56.812 57.028 -0.216 25155 7049 1 9 . 1 1 47 47 ASP CB C 47 42.978 42.978 41.536 1.442 25155 7050 1 9 . 1 1 48 48 VAL N N 48 118.666 118.666 117.162 1.504 25155 7051 1 9 . 1 1 48 48 VAL HA H 48 5.057 5.057 4.911 0.146 25155 7052 1 9 . 1 1 48 48 VAL C C 48 174.180 174.180 174.489 -0.309 25155 7053 1 9 . 1 1 48 48 VAL CA C 48 60.000 60.000 60.712 -0.712 25155 7054 1 9 . 1 1 48 48 VAL CB C 48 36.200 36.200 32.996 3.204 25155 7055 1 9 . 1 1 48 48 VAL H H 48 7.631 7.631 8.202 -0.571 25155 7056 1 9 . 1 1 49 49 LEU N N 49 128.300 128.300 128.769 -0.469 25155 7057 1 9 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.102 0.498 25155 7058 1 9 . 1 1 49 49 LEU C C 49 174.810 174.810 174.971 -0.161 25155 7059 1 9 . 1 1 49 49 LEU CA C 49 52.230 52.230 53.879 -1.649 25155 7060 1 9 . 1 1 49 49 LEU CB C 49 45.400 45.400 45.459 -0.059 25155 7061 1 9 . 1 1 49 49 LEU H H 49 9.469 9.469 8.918 0.551 25155 7062 1 9 . 1 1 50 50 ILE N N 50 124.400 124.400 127.400 -3.000 25155 7063 1 9 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.665 0.985 25155 7064 1 9 . 1 1 50 50 ILE C C 50 175.286 175.286 174.499 0.787 25155 7065 1 9 . 1 1 50 50 ILE CA C 50 59.900 59.900 61.406 -1.506 25155 7066 1 9 . 1 1 50 50 ILE CB C 50 40.200 40.200 39.517 0.683 25155 7067 1 9 . 1 1 50 50 ILE H H 50 9.213 9.213 9.218 -0.005 25155 7068 1 9 . 1 1 51 51 LEU N N 51 127.410 127.410 127.899 -0.489 25155 7069 1 9 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.027 2.043 25155 7070 1 9 . 1 1 51 51 LEU C C 51 174.540 174.540 175.858 -1.318 25155 7071 1 9 . 1 1 51 51 LEU CA C 51 52.950 52.950 53.105 -0.155 25155 7072 1 9 . 1 1 51 51 LEU CB C 51 43.190 43.190 43.627 -0.437 25155 7073 1 9 . 1 1 51 51 LEU H H 51 9.256 9.256 9.042 0.214 25155 7074 1 9 . 1 1 52 52 GLY N N 52 108.290 108.290 110.010 -1.720 25155 7075 1 9 . 1 1 52 52 GLY C C 52 174.330 174.330 171.979 2.351 25155 7076 1 9 . 1 1 52 52 GLY CA C 52 44.040 44.040 44.274 -0.234 25155 7077 1 9 . 1 1 52 52 GLY H H 52 8.949 8.949 7.989 0.960 25155 7078 1 9 . 1 1 53 53 ILE N N 53 124.912 124.912 119.229 5.683 25155 7079 1 9 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.526 -0.351 25155 7080 1 9 . 1 1 53 53 ILE C C 53 174.470 174.470 173.374 1.096 25155 7081 1 9 . 1 1 53 53 ILE CA C 53 55.850 55.850 57.806 -1.956 25155 7082 1 9 . 1 1 53 53 ILE CB C 53 42.800 42.800 42.224 0.576 25155 7083 1 9 . 1 1 53 53 ILE H H 53 8.612 8.612 7.696 0.916 25155 7084 1 9 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.515 0.297 25155 7085 1 9 . 1 1 54 54 PRO C C 54 174.565 174.565 177.074 -2.509 25155 7086 1 9 . 1 1 54 54 PRO CA C 54 61.850 61.850 63.098 -1.248 25155 7087 1 9 . 1 1 54 54 PRO CB C 54 32.400 32.400 30.086 2.314 25155 7088 1 9 . 1 1 55 55 THR N N 55 116.040 116.040 112.527 3.513 25155 7089 1 9 . 1 1 55 55 THR HA H 55 4.522 4.522 3.499 1.023 25155 7090 1 9 . 1 1 55 55 THR C C 55 173.990 173.990 173.343 0.647 25155 7091 1 9 . 1 1 55 55 THR CA C 55 62.845 62.845 65.152 -2.307 25155 7092 1 9 . 1 1 55 55 THR CB C 55 70.795 70.795 68.171 2.624 25155 7093 1 9 . 1 1 55 55 THR H H 55 7.663 7.663 8.101 -0.438 25155 7094 1 9 . 1 1 56 56 TRP N N 56 130.540 130.540 118.527 12.013 25155 7095 1 9 . 1 1 56 56 TRP CA C 56 54.800 54.800 54.668 0.132 25155 7096 1 9 . 1 1 56 56 TRP H H 56 9.075 9.075 7.878 1.198 25155 7097 1 9 . 1 1 58 58 PHE HA H 58 4.540 4.540 2.194 2.346 25155 7098 1 9 . 1 1 58 58 PHE C C 58 177.070 177.070 174.793 2.277 25155 7099 1 9 . 1 1 58 58 PHE CA C 58 55.460 55.460 57.439 -1.979 25155 7100 1 9 . 1 1 58 58 PHE CB C 58 41.200 41.200 37.481 3.719 25155 7101 1 9 . 1 1 59 59 GLY N N 59 109.796 109.796 105.308 4.488 25155 7102 1 9 . 1 1 59 59 GLY CA C 59 45.763 45.763 45.928 -0.165 25155 7103 1 9 . 1 1 59 59 GLY H H 59 8.392 8.392 7.791 0.601 25155 7104 1 9 . 1 1 60 60 GLU C C 60 175.660 175.660 175.006 0.654 25155 7105 1 9 . 1 1 61 61 ILE N N 61 122.380 122.380 121.277 1.103 25155 7106 1 9 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.738 0.702 25155 7107 1 9 . 1 1 61 61 ILE CA C 61 62.100 62.100 62.740 -0.640 25155 7108 1 9 . 1 1 61 61 ILE CB C 61 38.750 38.750 37.759 0.991 25155 7109 1 9 . 1 1 61 61 ILE H H 61 8.436 8.436 8.542 -0.106 25155 7110 1 9 . 1 1 62 62 GLN CB C 62 30.570 30.570 29.199 1.371 25155 7111 1 9 . 1 1 63 63 GLU HA H 63 4.030 4.030 3.951 0.079 25155 7112 1 9 . 1 1 63 63 GLU C C 63 177.134 177.134 177.981 -0.847 25155 7113 1 9 . 1 1 63 63 GLU CA C 63 60.520 60.520 60.311 0.209 25155 7114 1 9 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.518 0.132 25155 7115 1 9 . 1 1 64 64 ASP N N 64 119.630 119.630 117.976 1.654 25155 7116 1 9 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.496 0.096 25155 7117 1 9 . 1 1 64 64 ASP C C 64 178.680 178.680 177.633 1.047 25155 7118 1 9 . 1 1 64 64 ASP CA C 64 57.823 57.823 56.734 1.089 25155 7119 1 9 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.327 0.773 25155 7120 1 9 . 1 1 65 65 TRP N N 65 120.535 120.535 121.847 -1.312 25155 7121 1 9 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.672 -0.347 25155 7122 1 9 . 1 1 65 65 TRP C C 65 178.684 178.684 177.245 1.439 25155 7123 1 9 . 1 1 65 65 TRP CA C 65 60.500 60.500 60.393 0.107 25155 7124 1 9 . 1 1 65 65 TRP CB C 65 30.100 30.100 31.648 -1.548 25155 7125 1 9 . 1 1 65 65 TRP H H 65 7.416 7.416 7.915 -0.499 25155 7126 1 9 . 1 1 66 66 GLU N N 66 120.760 120.760 120.814 -0.054 25155 7127 1 9 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.242 -0.422 25155 7128 1 9 . 1 1 66 66 GLU C C 66 178.860 178.860 178.921 -0.061 25155 7129 1 9 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.817 0.283 25155 7130 1 9 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.660 -0.650 25155 7131 1 9 . 1 1 67 67 ALA N N 67 118.972 118.972 121.898 -2.926 25155 7132 1 9 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.222 0.025 25155 7133 1 9 . 1 1 67 67 ALA C C 67 179.610 179.610 179.023 0.587 25155 7134 1 9 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.955 -0.355 25155 7135 1 9 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.859 -0.071 25155 7136 1 9 . 1 1 67 67 ALA H H 67 7.690 7.690 8.476 -0.786 25155 7137 1 9 . 1 1 68 68 VAL N N 68 107.530 107.530 111.547 -4.017 25155 7138 1 9 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.289 0.421 25155 7139 1 9 . 1 1 68 68 VAL C C 68 176.800 176.800 177.358 -0.558 25155 7140 1 9 . 1 1 68 68 VAL CA C 68 60.060 60.060 62.758 -2.698 25155 7141 1 9 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.196 0.404 25155 7142 1 9 . 1 1 68 68 VAL H H 68 7.240 7.240 7.524 -0.284 25155 7143 1 9 . 1 1 69 69 TRP N N 69 126.960 126.960 124.990 1.970 25155 7144 1 9 . 1 1 69 69 TRP HA H 69 4.182 4.182 3.993 0.189 25155 7145 1 9 . 1 1 69 69 TRP C C 69 178.640 178.640 176.831 1.809 25155 7146 1 9 . 1 1 69 69 TRP CA C 69 61.300 61.300 62.748 -1.448 25155 7147 1 9 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.523 2.047 25155 7148 1 9 . 1 1 69 69 TRP H H 69 7.810 7.810 8.173 -0.363 25155 7149 1 9 . 1 1 70 70 ASP N N 70 114.644 114.644 116.444 -1.800 25155 7150 1 9 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.160 0.359 25155 7151 1 9 . 1 1 70 70 ASP C C 70 178.685 178.685 178.263 0.422 25155 7152 1 9 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.478 -0.478 25155 7153 1 9 . 1 1 70 70 ASP CB C 70 39.810 39.810 40.968 -1.158 25155 7154 1 9 . 1 1 71 71 GLN N N 71 120.100 120.100 116.949 3.151 25155 7155 1 9 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.235 -0.045 25155 7156 1 9 . 1 1 71 71 GLN C C 71 178.870 178.870 178.176 0.694 25155 7157 1 9 . 1 1 71 71 GLN CA C 71 57.617 57.617 57.074 0.543 25155 7158 1 9 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.541 -0.722 25155 7159 1 9 . 1 1 71 71 GLN H H 71 7.980 7.980 7.922 0.058 25155 7160 1 9 . 1 1 72 72 LEU N N 72 117.535 117.535 119.958 -2.423 25155 7161 1 9 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.929 -0.132 25155 7162 1 9 . 1 1 72 72 LEU C C 72 178.308 178.308 177.922 0.386 25155 7163 1 9 . 1 1 72 72 LEU CA C 72 57.340 57.340 57.002 0.338 25155 7164 1 9 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.454 0.246 25155 7165 1 9 . 1 1 72 72 LEU H H 72 7.435 7.435 7.658 -0.223 25155 7166 1 9 . 1 1 73 73 ASP N N 73 115.534 115.534 117.473 -1.939 25155 7167 1 9 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.371 -0.221 25155 7168 1 9 . 1 1 73 73 ASP C C 73 177.553 177.553 176.725 0.828 25155 7169 1 9 . 1 1 73 73 ASP CA C 73 57.350 57.350 56.103 1.247 25155 7170 1 9 . 1 1 73 73 ASP CB C 73 40.040 40.040 41.621 -1.581 25155 7171 1 9 . 1 1 74 74 ASP N N 74 117.300 117.300 120.144 -2.844 25155 7172 1 9 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.464 0.242 25155 7173 1 9 . 1 1 74 74 ASP C C 74 176.424 176.424 177.253 -0.829 25155 7174 1 9 . 1 1 74 74 ASP CA C 74 54.170 54.170 55.591 -1.421 25155 7175 1 9 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.297 0.523 25155 7176 1 9 . 1 1 75 75 LEU N N 75 118.500 118.500 120.071 -1.571 25155 7177 1 9 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.175 0.120 25155 7178 1 9 . 1 1 75 75 LEU C C 75 176.800 176.800 176.598 0.202 25155 7179 1 9 . 1 1 75 75 LEU CA C 75 54.400 54.400 55.106 -0.706 25155 7180 1 9 . 1 1 75 75 LEU CB C 75 43.280 43.280 41.868 1.412 25155 7181 1 9 . 1 1 75 75 LEU H H 75 6.966 6.966 7.311 -0.345 25155 7182 1 9 . 1 1 76 76 ASN N N 76 123.040 123.040 120.441 2.599 25155 7183 1 9 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.632 0.230 25155 7184 1 9 . 1 1 76 76 ASN C C 76 174.927 174.927 174.754 0.173 25155 7185 1 9 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.562 -1.681 25155 7186 1 9 . 1 1 76 76 ASN CB C 76 37.510 37.510 38.559 -1.049 25155 7187 1 9 . 1 1 76 76 ASN H H 76 9.882 9.882 8.980 0.902 25155 7188 1 9 . 1 1 77 77 LEU N N 77 123.614 123.614 123.480 0.134 25155 7189 1 9 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.554 -0.184 25155 7190 1 9 . 1 1 77 77 LEU C C 77 175.110 175.110 176.636 -1.526 25155 7191 1 9 . 1 1 77 77 LEU CA C 77 52.200 52.200 54.111 -1.911 25155 7192 1 9 . 1 1 77 77 LEU CB C 77 42.786 42.786 42.830 -0.044 25155 7193 1 9 . 1 1 77 77 LEU H H 77 8.700 8.700 8.046 0.654 25155 7194 1 9 . 1 1 78 78 GLU N N 78 120.822 120.822 121.550 -0.728 25155 7195 1 9 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.242 -0.342 25155 7196 1 9 . 1 1 78 78 GLU C C 78 178.670 178.670 178.048 0.622 25155 7197 1 9 . 1 1 78 78 GLU CA C 78 58.700 58.700 58.001 0.699 25155 7198 1 9 . 1 1 78 78 GLU CB C 78 29.467 29.467 29.453 0.014 25155 7199 1 9 . 1 1 79 79 GLY N N 79 113.160 113.160 112.978 0.182 25155 7200 1 9 . 1 1 79 79 GLY C C 79 174.523 174.523 174.099 0.424 25155 7201 1 9 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.345 0.075 25155 7202 1 9 . 1 1 79 79 GLY H H 79 8.450 8.450 8.515 -0.065 25155 7203 1 9 . 1 1 80 80 LYS N N 80 120.283 120.283 120.616 -0.333 25155 7204 1 9 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.320 0.038 25155 7205 1 9 . 1 1 80 80 LYS C C 80 175.304 175.304 176.193 -0.889 25155 7206 1 9 . 1 1 80 80 LYS CA C 80 56.890 56.890 56.063 0.827 25155 7207 1 9 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.893 -0.773 25155 7208 1 9 . 1 1 81 81 ILE N N 81 122.288 122.288 122.278 0.010 25155 7209 1 9 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.465 0.341 25155 7210 1 9 . 1 1 81 81 ILE C C 81 174.750 174.750 175.657 -0.907 25155 7211 1 9 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.666 -1.846 25155 7212 1 9 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.258 0.592 25155 7213 1 9 . 1 1 81 81 ILE H H 81 7.405 7.405 8.146 -0.741 25155 7214 1 9 . 1 1 82 82 VAL N N 82 127.793 127.793 126.103 1.690 25155 7215 1 9 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.254 0.026 25155 7216 1 9 . 1 1 82 82 VAL C C 82 172.680 172.680 174.102 -1.422 25155 7217 1 9 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.117 -0.017 25155 7218 1 9 . 1 1 82 82 VAL CB C 82 35.280 35.280 36.275 -0.995 25155 7219 1 9 . 1 1 82 82 VAL H H 82 8.800 8.800 8.976 -0.176 25155 7220 1 9 . 1 1 83 83 ALA N N 83 130.911 130.911 127.507 3.404 25155 7221 1 9 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.187 0.202 25155 7222 1 9 . 1 1 83 83 ALA C C 83 175.870 175.870 175.600 0.270 25155 7223 1 9 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.851 0.149 25155 7224 1 9 . 1 1 83 83 ALA CB C 83 23.722 23.722 23.005 0.717 25155 7225 1 9 . 1 1 83 83 ALA H H 83 9.252 9.252 9.056 0.196 25155 7226 1 9 . 1 1 84 84 LEU N N 84 124.269 124.269 122.968 1.301 25155 7227 1 9 . 1 1 84 84 LEU HA H 84 5.508 5.508 4.875 0.633 25155 7228 1 9 . 1 1 84 84 LEU C C 84 175.490 175.490 175.261 0.229 25155 7229 1 9 . 1 1 84 84 LEU CA C 84 53.670 53.670 54.437 -0.767 25155 7230 1 9 . 1 1 84 84 LEU CB C 84 45.000 45.000 44.285 0.715 25155 7231 1 9 . 1 1 84 84 LEU H H 84 10.378 10.378 9.231 1.147 25155 7232 1 9 . 1 1 85 85 TYR N N 85 115.826 115.826 122.748 -6.922 25155 7233 1 9 . 1 1 85 85 TYR HA H 85 4.950 4.950 4.661 0.289 25155 7234 1 9 . 1 1 85 85 TYR C C 85 172.661 172.661 175.906 -3.245 25155 7235 1 9 . 1 1 85 85 TYR CA C 85 55.853 55.853 56.099 -0.246 25155 7236 1 9 . 1 1 85 85 TYR CB C 85 43.200 43.200 42.065 1.135 25155 7237 1 9 . 1 1 85 85 TYR H H 85 9.200 9.200 9.148 0.052 25155 7238 1 9 . 1 1 86 86 GLY N N 86 106.802 106.802 107.932 -1.130 25155 7239 1 9 . 1 1 86 86 GLY C C 86 170.348 170.348 171.224 -0.876 25155 7240 1 9 . 1 1 86 86 GLY CA C 86 44.687 44.687 44.785 -0.098 25155 7241 1 9 . 1 1 86 86 GLY H H 86 8.752 8.752 8.092 0.660 25155 7242 1 9 . 1 1 87 87 LEU N N 87 120.860 120.860 123.849 -2.989 25155 7243 1 9 . 1 1 87 87 LEU HA H 87 5.476 5.476 5.147 0.329 25155 7244 1 9 . 1 1 87 87 LEU C C 87 177.720 177.720 175.284 2.436 25155 7245 1 9 . 1 1 87 87 LEU CA C 87 52.630 52.630 52.353 0.277 25155 7246 1 9 . 1 1 87 87 LEU CB C 87 45.900 45.900 45.238 0.662 25155 7247 1 9 . 1 1 87 87 LEU H H 87 6.320 6.320 8.091 -1.771 25155 7248 1 9 . 1 1 88 88 GLY N N 88 109.910 109.910 110.482 -0.572 25155 7249 1 9 . 1 1 88 88 GLY C C 88 171.386 171.386 171.303 0.083 25155 7250 1 9 . 1 1 88 88 GLY CA C 88 45.710 45.710 45.749 -0.039 25155 7251 1 9 . 1 1 88 88 GLY H H 88 8.320 8.320 8.087 0.233 25155 7252 1 9 . 1 1 89 89 ASP N N 89 121.580 121.580 117.692 3.888 25155 7253 1 9 . 1 1 89 89 ASP HA H 89 5.190 5.190 5.023 0.167 25155 7254 1 9 . 1 1 89 89 ASP C C 89 176.608 176.608 176.351 0.257 25155 7255 1 9 . 1 1 89 89 ASP CA C 89 52.200 52.200 52.796 -0.596 25155 7256 1 9 . 1 1 89 89 ASP CB C 89 41.900 41.900 43.163 -1.263 25155 7257 1 9 . 1 1 90 90 GLN N N 90 123.900 123.900 123.657 0.243 25155 7258 1 9 . 1 1 90 90 GLN HA H 90 3.645 3.645 4.144 -0.499 25155 7259 1 9 . 1 1 90 90 GLN C C 90 173.523 173.523 176.147 -2.624 25155 7260 1 9 . 1 1 90 90 GLN CA C 90 58.706 58.706 57.936 0.770 25155 7261 1 9 . 1 1 90 90 GLN CB C 90 28.800 28.800 28.439 0.361 25155 7262 1 9 . 1 1 90 90 GLN H H 90 8.726 8.726 8.861 -0.135 25155 7263 1 9 . 1 1 91 91 LEU N N 91 117.080 117.080 120.317 -3.237 25155 7264 1 9 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.233 0.237 25155 7265 1 9 . 1 1 91 91 LEU C C 91 179.840 179.840 178.986 0.854 25155 7266 1 9 . 1 1 91 91 LEU CA C 91 55.800 55.800 55.804 -0.004 25155 7267 1 9 . 1 1 91 91 LEU CB C 91 41.640 41.640 42.141 -0.501 25155 7268 1 9 . 1 1 91 91 LEU H H 91 7.092 7.092 8.710 -1.618 25155 7269 1 9 . 1 1 92 92 GLY N N 92 110.460 110.460 106.193 4.267 25155 7270 1 9 . 1 1 92 92 GLY C C 92 174.824 174.824 175.040 -0.216 25155 7271 1 9 . 1 1 92 92 GLY CA C 92 46.390 46.390 47.273 -0.883 25155 7272 1 9 . 1 1 92 92 GLY H H 92 9.243 9.243 8.733 0.510 25155 7273 1 9 . 1 1 93 93 TYR N N 93 118.140 118.140 119.687 -1.547 25155 7274 1 9 . 1 1 93 93 TYR HA H 93 5.173 5.173 4.664 0.509 25155 7275 1 9 . 1 1 93 93 TYR C C 93 177.805 177.805 177.159 0.646 25155 7276 1 9 . 1 1 93 93 TYR CA C 93 57.430 57.430 58.651 -1.221 25155 7277 1 9 . 1 1 93 93 TYR CB C 93 39.300 39.300 40.709 -1.409 25155 7278 1 9 . 1 1 93 93 TYR H H 93 7.252 7.252 7.654 -0.402 25155 7279 1 9 . 1 1 94 94 GLY N N 94 112.455 112.455 108.565 3.890 25155 7280 1 9 . 1 1 94 94 GLY C C 94 177.740 177.740 175.766 1.974 25155 7281 1 9 . 1 1 94 94 GLY CA C 94 49.880 49.880 46.029 3.851 25155 7282 1 9 . 1 1 94 94 GLY H H 94 8.154 8.154 8.826 -0.672 25155 7283 1 9 . 1 1 95 95 GLU N N 95 123.040 123.040 120.285 2.755 25155 7284 1 9 . 1 1 95 95 GLU HA H 95 4.000 4.000 3.992 0.008 25155 7285 1 9 . 1 1 95 95 GLU C C 95 175.145 175.145 176.927 -1.782 25155 7286 1 9 . 1 1 95 95 GLU CA C 95 57.950 57.950 58.490 -0.540 25155 7287 1 9 . 1 1 95 95 GLU CB C 95 27.400 27.400 29.404 -2.004 25155 7288 1 9 . 1 1 96 96 TRP N N 96 118.000 118.000 116.856 1.144 25155 7289 1 9 . 1 1 96 96 TRP HA H 96 5.213 5.213 4.892 0.321 25155 7290 1 9 . 1 1 96 96 TRP C C 96 176.616 176.616 175.733 0.883 25155 7291 1 9 . 1 1 96 96 TRP CA C 96 57.120 57.120 54.377 2.743 25155 7292 1 9 . 1 1 96 96 TRP CB C 96 29.970 29.970 27.571 2.399 25155 7293 1 9 . 1 1 96 96 TRP H H 96 7.785 7.785 7.642 0.143 25155 7294 1 9 . 1 1 97 97 PHE N N 97 123.268 123.268 122.264 1.004 25155 7295 1 9 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.088 0.572 25155 7296 1 9 . 1 1 97 97 PHE CA C 97 58.742 58.742 59.717 -0.975 25155 7297 1 9 . 1 1 97 97 PHE CB C 97 40.835 40.835 39.523 1.312 25155 7298 1 9 . 1 1 97 97 PHE H H 97 7.054 7.054 7.635 -0.581 25155 7299 1 9 . 1 1 98 98 LEU HA H 98 3.440 3.440 3.391 0.049 25155 7300 1 9 . 1 1 98 98 LEU C C 98 176.613 176.613 177.159 -0.546 25155 7301 1 9 . 1 1 98 98 LEU CA C 98 56.000 56.000 54.894 1.106 25155 7302 1 9 . 1 1 98 98 LEU CB C 98 38.600 38.600 39.187 -0.587 25155 7303 1 9 . 1 1 98 98 LEU H H 98 8.584 8.584 8.133 0.451 25155 7304 1 9 . 1 1 99 99 ASP N N 99 123.268 123.268 120.359 2.909 25155 7305 1 9 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.176 -0.211 25155 7306 1 9 . 1 1 99 99 ASP C C 99 178.876 178.876 176.973 1.903 25155 7307 1 9 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.136 2.124 25155 7308 1 9 . 1 1 99 99 ASP CB C 99 40.350 40.350 40.834 -0.484 25155 7309 1 9 . 1 1 100 100 ALA N N 100 119.124 119.124 120.374 -1.250 25155 7310 1 9 . 1 1 100 100 ALA HA H 100 3.822 3.822 4.125 -0.303 25155 7311 1 9 . 1 1 100 100 ALA C C 100 178.490 178.490 179.060 -0.570 25155 7312 1 9 . 1 1 100 100 ALA CA C 100 55.100 55.100 53.684 1.415 25155 7313 1 9 . 1 1 100 100 ALA CB C 100 19.700 19.700 18.082 1.618 25155 7314 1 9 . 1 1 100 100 ALA H H 100 8.400 8.400 8.058 0.342 25155 7315 1 9 . 1 1 101 101 LEU N N 101 118.687 118.687 120.888 -2.201 25155 7316 1 9 . 1 1 101 101 LEU HA H 101 3.674 3.674 4.046 -0.372 25155 7317 1 9 . 1 1 101 101 LEU C C 101 179.050 179.050 178.565 0.485 25155 7318 1 9 . 1 1 101 101 LEU CA C 101 57.800 57.800 57.230 0.570 25155 7319 1 9 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.637 1.013 25155 7320 1 9 . 1 1 101 101 LEU H H 101 6.518 6.518 7.670 -1.152 25155 7321 1 9 . 1 1 102 102 GLY N N 102 104.410 104.410 106.458 -2.048 25155 7322 1 9 . 1 1 102 102 GLY C C 102 176.056 176.056 175.843 0.213 25155 7323 1 9 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.219 0.531 25155 7324 1 9 . 1 1 102 102 GLY H H 102 7.712 7.712 7.751 -0.039 25155 7325 1 9 . 1 1 103 103 MET N N 103 120.550 120.550 121.852 -1.302 25155 7326 1 9 . 1 1 103 103 MET HA H 103 4.256 4.256 4.377 -0.121 25155 7327 1 9 . 1 1 103 103 MET C C 103 179.650 179.650 178.446 1.204 25155 7328 1 9 . 1 1 103 103 MET CA C 103 59.450 59.450 59.508 -0.058 25155 7329 1 9 . 1 1 103 103 MET CB C 103 32.300 32.300 32.828 -0.528 25155 7330 1 9 . 1 1 103 103 MET H H 103 8.485 8.485 7.577 0.908 25155 7331 1 9 . 1 1 104 104 LEU N N 104 123.480 123.480 120.513 2.967 25155 7332 1 9 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.344 -0.283 25155 7333 1 9 . 1 1 104 104 LEU C C 104 177.750 177.750 178.745 -0.995 25155 7334 1 9 . 1 1 104 104 LEU CA C 104 58.100 58.100 57.662 0.438 25155 7335 1 9 . 1 1 104 104 LEU CB C 104 41.450 41.450 41.369 0.081 25155 7336 1 9 . 1 1 104 104 LEU H H 104 8.392 8.392 8.200 0.192 25155 7337 1 9 . 1 1 105 105 HIS N N 105 119.570 119.570 119.692 -0.122 25155 7338 1 9 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.203 -0.351 25155 7339 1 9 . 1 1 105 105 HIS C C 105 177.550 177.550 177.034 0.516 25155 7340 1 9 . 1 1 105 105 HIS CA C 105 61.000 61.000 60.499 0.501 25155 7341 1 9 . 1 1 105 105 HIS CB C 105 28.820 28.820 29.932 -1.112 25155 7342 1 9 . 1 1 105 105 HIS H H 105 8.247 8.247 8.620 -0.373 25155 7343 1 9 . 1 1 106 106 ASP N N 106 119.780 119.780 119.338 0.442 25155 7344 1 9 . 1 1 106 106 ASP HA H 106 4.333 4.333 4.316 0.017 25155 7345 1 9 . 1 1 106 106 ASP C C 106 179.410 179.410 178.394 1.016 25155 7346 1 9 . 1 1 106 106 ASP CA C 106 57.800 57.800 57.140 0.660 25155 7347 1 9 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.203 -0.603 25155 7348 1 9 . 1 1 107 107 LYS N N 107 121.660 121.660 118.463 3.197 25155 7349 1 9 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.068 0.032 25155 7350 1 9 . 1 1 107 107 LYS C C 107 178.316 178.316 178.107 0.209 25155 7351 1 9 . 1 1 107 107 LYS CA C 107 58.750 58.750 58.834 -0.084 25155 7352 1 9 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.523 -0.673 25155 7353 1 9 . 1 1 108 108 LEU N N 108 116.050 116.050 117.161 -1.111 25155 7354 1 9 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.458 -0.448 25155 7355 1 9 . 1 1 108 108 LEU C C 108 179.050 179.050 178.727 0.323 25155 7356 1 9 . 1 1 108 108 LEU CA C 108 56.240 56.240 55.790 0.450 25155 7357 1 9 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.663 -0.863 25155 7358 1 9 . 1 1 108 108 LEU H H 108 8.072 8.072 7.700 0.372 25155 7359 1 9 . 1 1 109 109 SER N N 109 116.280 116.280 116.634 -0.354 25155 7360 1 9 . 1 1 109 109 SER HA H 109 4.300 4.300 4.347 -0.047 25155 7361 1 9 . 1 1 109 109 SER C C 109 175.848 175.848 176.224 -0.376 25155 7362 1 9 . 1 1 109 109 SER CA C 109 62.410 62.410 61.752 0.658 25155 7363 1 9 . 1 1 109 109 SER CB C 109 62.850 62.850 63.137 -0.287 25155 7364 1 9 . 1 1 109 109 SER H H 109 8.366 8.366 7.976 0.390 25155 7365 1 9 . 1 1 110 110 THR N N 110 110.416 110.416 111.513 -1.097 25155 7366 1 9 . 1 1 110 110 THR HA H 110 4.614 4.614 4.327 0.287 25155 7367 1 9 . 1 1 110 110 THR C C 110 175.675 175.675 175.101 0.574 25155 7368 1 9 . 1 1 110 110 THR CA C 110 62.030 62.030 63.876 -1.846 25155 7369 1 9 . 1 1 110 110 THR CB C 110 68.810 68.810 68.652 0.158 25155 7370 1 9 . 1 1 110 110 THR H H 110 7.185 7.185 8.074 -0.889 25155 7371 1 9 . 1 1 111 111 LYS N N 111 120.090 120.090 120.480 -0.390 25155 7372 1 9 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.435 0.078 25155 7373 1 9 . 1 1 111 111 LYS C C 111 176.814 176.814 176.581 0.233 25155 7374 1 9 . 1 1 111 111 LYS CA C 111 55.730 55.730 55.660 0.070 25155 7375 1 9 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.440 -1.510 25155 7376 1 9 . 1 1 112 112 GLY N N 112 107.540 107.540 108.103 -0.563 25155 7377 1 9 . 1 1 112 112 GLY C C 112 176.223 176.223 174.326 1.897 25155 7378 1 9 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.518 1.408 25155 7379 1 9 . 1 1 112 112 GLY H H 112 8.315 8.315 7.624 0.691 25155 7380 1 9 . 1 1 113 113 VAL N N 113 113.536 113.536 115.917 -2.381 25155 7381 1 9 . 1 1 113 113 VAL HA H 113 4.494 4.494 4.321 0.173 25155 7382 1 9 . 1 1 113 113 VAL C C 113 174.560 174.560 175.081 -0.521 25155 7383 1 9 . 1 1 113 113 VAL CA C 113 59.550 59.550 61.048 -1.498 25155 7384 1 9 . 1 1 113 113 VAL CB C 113 32.800 32.800 32.309 0.491 25155 7385 1 9 . 1 1 113 113 VAL H H 113 6.835 6.835 7.028 -0.193 25155 7386 1 9 . 1 1 114 114 LYS N N 114 122.920 122.920 121.534 1.386 25155 7387 1 9 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.399 0.095 25155 7388 1 9 . 1 1 114 114 LYS C C 114 174.925 174.925 174.919 0.006 25155 7389 1 9 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.169 0.111 25155 7390 1 9 . 1 1 114 114 LYS CB C 114 33.630 33.630 33.846 -0.216 25155 7391 1 9 . 1 1 115 115 PHE N N 115 123.140 123.140 124.309 -1.169 25155 7392 1 9 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.373 0.327 25155 7393 1 9 . 1 1 115 115 PHE C C 115 177.580 177.580 176.221 1.359 25155 7394 1 9 . 1 1 115 115 PHE CA C 115 58.677 58.677 57.691 0.986 25155 7395 1 9 . 1 1 115 115 PHE CB C 115 41.120 41.120 40.183 0.937 25155 7396 1 9 . 1 1 115 115 PHE H H 115 8.506 8.506 8.623 -0.117 25155 7397 1 9 . 1 1 116 116 VAL N N 116 115.737 115.737 114.762 0.975 25155 7398 1 9 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.592 -0.114 25155 7399 1 9 . 1 1 116 116 VAL C C 116 175.300 175.300 175.722 -0.422 25155 7400 1 9 . 1 1 116 116 VAL CA C 116 58.877 58.877 59.444 -0.567 25155 7401 1 9 . 1 1 116 116 VAL CB C 116 34.120 34.120 34.794 -0.674 25155 7402 1 9 . 1 1 116 116 VAL H H 116 8.860 8.860 8.232 0.628 25155 7403 1 9 . 1 1 117 117 GLY N N 117 108.137 108.137 111.038 -2.901 25155 7404 1 9 . 1 1 117 117 GLY C C 117 176.110 176.110 174.306 1.804 25155 7405 1 9 . 1 1 117 117 GLY CA C 117 47.500 47.500 44.982 2.518 25155 7406 1 9 . 1 1 117 117 GLY H H 117 9.838 9.838 8.669 1.169 25155 7407 1 9 . 1 1 118 118 TYR N N 118 120.380 120.380 120.026 0.354 25155 7408 1 9 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.432 0.538 25155 7409 1 9 . 1 1 118 118 TYR C C 118 177.630 177.630 175.020 2.610 25155 7410 1 9 . 1 1 118 118 TYR CA C 118 55.800 55.800 59.373 -3.573 25155 7411 1 9 . 1 1 118 118 TYR CB C 118 35.970 35.970 37.566 -1.596 25155 7412 1 9 . 1 1 118 118 TYR H H 118 8.652 8.652 8.326 0.326 25155 7413 1 9 . 1 1 119 119 TRP N N 119 126.040 126.040 118.826 7.214 25155 7414 1 9 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.101 0.920 25155 7415 1 9 . 1 1 119 119 TRP C C 119 173.000 173.000 174.048 -1.048 25155 7416 1 9 . 1 1 119 119 TRP CA C 119 53.820 53.820 55.900 -2.080 25155 7417 1 9 . 1 1 119 119 TRP CB C 119 36.050 36.050 33.464 2.586 25155 7418 1 9 . 1 1 119 119 TRP H H 119 8.070 8.070 8.252 -0.182 25155 7419 1 9 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.618 0.166 25155 7420 1 9 . 1 1 120 120 PRO C C 120 176.870 176.870 176.809 0.061 25155 7421 1 9 . 1 1 120 120 PRO CA C 120 63.780 63.780 63.103 0.677 25155 7422 1 9 . 1 1 120 120 PRO CB C 120 31.990 31.990 32.429 -0.439 25155 7423 1 9 . 1 1 121 121 THR N N 121 109.310 109.310 113.009 -3.699 25155 7424 1 9 . 1 1 121 121 THR HA H 121 4.073 4.073 3.896 0.177 25155 7425 1 9 . 1 1 121 121 THR C C 121 176.324 176.324 175.586 0.738 25155 7426 1 9 . 1 1 121 121 THR CA C 121 61.250 61.250 63.962 -2.712 25155 7427 1 9 . 1 1 121 121 THR CB C 121 69.730 69.730 68.814 0.916 25155 7428 1 9 . 1 1 121 121 THR H H 121 7.370 7.370 8.106 -0.736 25155 7429 1 9 . 1 1 122 122 GLU N N 122 123.937 123.937 122.535 1.402 25155 7430 1 9 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.145 0.079 25155 7431 1 9 . 1 1 122 122 GLU C C 122 177.737 177.737 177.697 0.040 25155 7432 1 9 . 1 1 122 122 GLU CA C 122 58.200 58.200 57.762 0.438 25155 7433 1 9 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.548 0.252 25155 7434 1 9 . 1 1 123 123 GLY N N 123 114.563 114.563 111.914 2.649 25155 7435 1 9 . 1 1 123 123 GLY C C 123 173.783 173.783 174.600 -0.817 25155 7436 1 9 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.262 0.118 25155 7437 1 9 . 1 1 123 123 GLY H H 123 9.144 9.144 8.712 0.432 25155 7438 1 9 . 1 1 124 124 TYR N N 124 118.800 118.800 121.068 -2.268 25155 7439 1 9 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.466 0.752 25155 7440 1 9 . 1 1 124 124 TYR C C 124 175.673 175.673 175.513 0.160 25155 7441 1 9 . 1 1 124 124 TYR CA C 124 56.950 56.950 57.941 -0.991 25155 7442 1 9 . 1 1 124 124 TYR CB C 124 41.100 41.100 39.462 1.638 25155 7443 1 9 . 1 1 124 124 TYR H H 124 7.895 7.895 7.938 -0.043 25155 7444 1 9 . 1 1 125 125 GLU N N 125 124.790 124.790 122.565 2.225 25155 7445 1 9 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.641 0.044 25155 7446 1 9 . 1 1 125 125 GLU C C 125 172.877 172.877 174.857 -1.980 25155 7447 1 9 . 1 1 125 125 GLU CA C 125 55.700 55.700 55.479 0.221 25155 7448 1 9 . 1 1 125 125 GLU CB C 125 31.340 31.340 30.866 0.475 25155 7449 1 9 . 1 1 126 126 PHE N N 126 118.670 118.670 118.900 -0.230 25155 7450 1 9 . 1 1 126 126 PHE HA H 126 4.841 4.841 5.253 -0.412 25155 7451 1 9 . 1 1 126 126 PHE C C 126 173.800 173.800 174.480 -0.680 25155 7452 1 9 . 1 1 126 126 PHE CA C 126 56.950 56.950 56.889 0.061 25155 7453 1 9 . 1 1 126 126 PHE CB C 126 40.300 40.300 40.576 -0.276 25155 7454 1 9 . 1 1 126 126 PHE H H 126 7.645 7.645 7.906 -0.261 25155 7455 1 9 . 1 1 127 127 THR N N 127 107.038 107.038 116.079 -9.041 25155 7456 1 9 . 1 1 127 127 THR HA H 127 4.370 4.370 4.252 0.118 25155 7457 1 9 . 1 1 127 127 THR C C 127 175.100 175.100 175.443 -0.343 25155 7458 1 9 . 1 1 127 127 THR CA C 127 61.080 61.080 62.447 -1.367 25155 7459 1 9 . 1 1 127 127 THR CB C 127 70.500 70.500 69.339 1.161 25155 7460 1 9 . 1 1 127 127 THR H H 127 7.306 7.306 8.728 -1.422 25155 7461 1 9 . 1 1 128 128 SER N N 128 118.150 118.150 119.618 -1.468 25155 7462 1 9 . 1 1 128 128 SER HA H 128 4.650 4.650 4.605 0.045 25155 7463 1 9 . 1 1 128 128 SER C C 128 175.760 175.760 173.643 2.117 25155 7464 1 9 . 1 1 128 128 SER CA C 128 55.813 55.813 57.899 -2.086 25155 7465 1 9 . 1 1 128 128 SER CB C 128 65.300 65.300 63.803 1.497 25155 7466 1 9 . 1 1 128 128 SER H H 128 7.354 7.354 7.921 -0.567 25155 7467 1 9 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.525 0.239 25155 7468 1 9 . 1 1 129 129 PRO C C 129 178.860 178.860 178.181 0.679 25155 7469 1 9 . 1 1 129 129 PRO CA C 129 62.728 62.728 63.967 -1.239 25155 7470 1 9 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.468 -0.068 25155 7471 1 9 . 1 1 130 130 LYS N N 130 122.158 122.158 120.003 2.155 25155 7472 1 9 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.092 0.118 25155 7473 1 9 . 1 1 130 130 LYS C C 130 176.890 176.890 175.325 1.565 25155 7474 1 9 . 1 1 130 130 LYS CA C 130 61.375 61.375 60.683 0.692 25155 7475 1 9 . 1 1 130 130 LYS CB C 130 30.350 30.350 30.967 -0.617 25155 7476 1 9 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.323 0.210 25155 7477 1 9 . 1 1 131 131 PRO C C 131 173.810 173.810 175.656 -1.846 25155 7478 1 9 . 1 1 131 131 PRO CA C 131 64.510 64.510 63.282 1.228 25155 7479 1 9 . 1 1 131 131 PRO CB C 131 31.745 31.745 31.408 0.337 25155 7480 1 9 . 1 1 132 132 VAL N N 132 114.480 114.480 111.730 2.750 25155 7481 1 9 . 1 1 132 132 VAL HA H 132 5.158 5.158 5.048 0.110 25155 7482 1 9 . 1 1 132 132 VAL C C 132 175.137 175.137 173.972 1.165 25155 7483 1 9 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.068 0.732 25155 7484 1 9 . 1 1 132 132 VAL CB C 132 34.780 34.780 35.819 -1.039 25155 7485 1 9 . 1 1 132 132 VAL H H 132 6.716 6.716 7.603 -0.887 25155 7486 1 9 . 1 1 133 133 ILE N N 133 120.670 120.670 112.306 8.364 25155 7487 1 9 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.575 -0.183 25155 7488 1 9 . 1 1 133 133 ILE C C 133 175.485 175.485 175.055 0.430 25155 7489 1 9 . 1 1 133 133 ILE CA C 133 60.000 60.000 59.378 0.622 25155 7490 1 9 . 1 1 133 133 ILE CB C 133 42.020 42.020 41.006 1.014 25155 7491 1 9 . 1 1 133 133 ILE H H 133 8.740 8.740 8.578 0.162 25155 7492 1 9 . 1 1 134 134 ALA N N 134 122.454 122.454 122.702 -0.248 25155 7493 1 9 . 1 1 134 134 ALA HA H 134 3.953 3.953 3.925 0.028 25155 7494 1 9 . 1 1 134 134 ALA C C 134 178.387 178.387 177.306 1.081 25155 7495 1 9 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.362 -0.312 25155 7496 1 9 . 1 1 134 134 ALA CB C 134 16.982 16.982 17.129 -0.147 25155 7497 1 9 . 1 1 134 134 ALA H H 134 8.490 8.490 8.547 -0.057 25155 7498 1 9 . 1 1 135 135 ASP N N 135 117.310 117.310 116.955 0.355 25155 7499 1 9 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.295 -0.051 25155 7500 1 9 . 1 1 135 135 ASP C C 135 176.390 176.390 176.893 -0.503 25155 7501 1 9 . 1 1 135 135 ASP CA C 135 55.120 55.120 54.577 0.543 25155 7502 1 9 . 1 1 135 135 ASP CB C 135 39.865 39.865 40.051 -0.186 25155 7503 1 9 . 1 1 136 136 GLY N N 136 104.336 104.336 103.809 0.527 25155 7504 1 9 . 1 1 136 136 GLY C C 136 174.940 174.940 175.289 -0.349 25155 7505 1 9 . 1 1 136 136 GLY CA C 136 45.150 45.150 45.305 -0.155 25155 7506 1 9 . 1 1 136 136 GLY H H 136 7.592 7.592 7.881 -0.289 25155 7507 1 9 . 1 1 137 137 GLN N N 137 118.675 118.675 118.887 -0.212 25155 7508 1 9 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.485 -0.423 25155 7509 1 9 . 1 1 137 137 GLN C C 137 176.420 176.420 175.230 1.190 25155 7510 1 9 . 1 1 137 137 GLN CA C 137 57.760 57.760 56.371 1.389 25155 7511 1 9 . 1 1 137 137 GLN CB C 137 30.400 30.400 30.108 0.291 25155 7512 1 9 . 1 1 137 137 GLN H H 137 7.843 7.843 7.792 0.051 25155 7513 1 9 . 1 1 138 138 LEU N N 138 118.160 118.160 119.695 -1.535 25155 7514 1 9 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.775 0.186 25155 7515 1 9 . 1 1 138 138 LEU C C 138 175.700 175.700 174.354 1.346 25155 7516 1 9 . 1 1 138 138 LEU CA C 138 53.705 53.705 54.467 -0.762 25155 7517 1 9 . 1 1 138 138 LEU CB C 138 46.480 46.480 46.199 0.281 25155 7518 1 9 . 1 1 138 138 LEU H H 138 7.356 7.356 7.324 0.032 25155 7519 1 9 . 1 1 139 139 PHE N N 139 119.060 119.060 122.796 -3.736 25155 7520 1 9 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.770 0.574 25155 7521 1 9 . 1 1 139 139 PHE C C 139 178.850 178.850 177.366 1.484 25155 7522 1 9 . 1 1 139 139 PHE CA C 139 56.670 56.670 57.643 -0.973 25155 7523 1 9 . 1 1 139 139 PHE CB C 139 43.652 43.652 39.591 4.061 25155 7524 1 9 . 1 1 139 139 PHE H H 139 10.026 10.026 9.050 0.976 25155 7525 1 9 . 1 1 140 140 VAL N N 140 109.905 109.905 117.728 -7.823 25155 7526 1 9 . 1 1 140 140 VAL HA H 140 3.500 3.500 3.228 0.272 25155 7527 1 9 . 1 1 140 140 VAL C C 140 172.860 172.860 175.164 -2.304 25155 7528 1 9 . 1 1 140 140 VAL CA C 140 61.812 61.812 61.867 -0.055 25155 7529 1 9 . 1 1 140 140 VAL CB C 140 30.250 30.250 30.440 -0.190 25155 7530 1 9 . 1 1 140 140 VAL H H 140 7.550 7.550 8.480 -0.930 25155 7531 1 9 . 1 1 141 141 GLY N N 141 106.600 106.600 107.541 -0.941 25155 7532 1 9 . 1 1 141 141 GLY C C 141 171.350 171.350 172.520 -1.170 25155 7533 1 9 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.557 0.903 25155 7534 1 9 . 1 1 141 141 GLY H H 141 7.052 7.052 7.206 -0.154 25155 7535 1 9 . 1 1 142 142 LEU N N 142 117.820 117.820 120.463 -2.643 25155 7536 1 9 . 1 1 142 142 LEU HA H 142 4.962 4.962 3.673 1.289 25155 7537 1 9 . 1 1 142 142 LEU CA C 142 55.600 55.600 53.170 2.430 25155 7538 1 9 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.822 -4.891 25155 7539 1 9 . 1 1 142 142 LEU H H 142 7.643 7.643 7.965 -0.322 25155 7540 1 9 . 1 1 143 143 ALA HA H 143 4.220 4.220 3.626 0.594 25155 7541 1 9 . 1 1 143 143 ALA C C 143 175.505 175.505 175.770 -0.265 25155 7542 1 9 . 1 1 143 143 ALA CA C 143 49.600 49.600 50.934 -1.334 25155 7543 1 9 . 1 1 143 143 ALA CB C 143 23.330 23.330 17.948 5.382 25155 7544 1 9 . 1 1 144 144 LEU N N 144 124.960 124.960 124.330 0.630 25155 7545 1 9 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.480 0.300 25155 7546 1 9 . 1 1 144 144 LEU C C 144 174.700 174.700 175.312 -0.612 25155 7547 1 9 . 1 1 144 144 LEU CA C 144 52.790 52.790 53.875 -1.085 25155 7548 1 9 . 1 1 144 144 LEU CB C 144 45.300 45.300 43.911 1.389 25155 7549 1 9 . 1 1 144 144 LEU H H 144 8.583 8.583 7.543 1.040 25155 7550 1 9 . 1 1 145 145 ASP N N 145 119.100 119.100 121.663 -2.563 25155 7551 1 9 . 1 1 145 145 ASP HA H 145 5.422 5.422 5.148 0.274 25155 7552 1 9 . 1 1 145 145 ASP C C 145 176.180 176.180 175.123 1.057 25155 7553 1 9 . 1 1 145 145 ASP CA C 145 53.600 53.600 53.175 0.425 25155 7554 1 9 . 1 1 145 145 ASP CB C 145 43.180 43.180 44.149 -0.969 25155 7555 1 9 . 1 1 147 147 THR HA H 147 4.093 4.093 4.285 -0.192 25155 7556 1 9 . 1 1 147 147 THR C C 147 175.858 175.858 175.516 0.342 25155 7557 1 9 . 1 1 147 147 THR CA C 147 66.400 66.400 66.253 0.147 25155 7558 1 9 . 1 1 147 147 THR CB C 147 69.400 69.400 69.146 0.254 25155 7559 1 9 . 1 1 147 147 THR H H 147 8.745 8.745 8.484 0.261 25155 7560 1 9 . 1 1 148 148 ASN N N 148 115.408 115.408 117.189 -1.781 25155 7561 1 9 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.484 0.526 25155 7562 1 9 . 1 1 148 148 ASN C C 148 175.750 175.750 174.429 1.321 25155 7563 1 9 . 1 1 148 148 ASN CA C 148 53.400 53.400 54.590 -1.190 25155 7564 1 9 . 1 1 148 148 ASN CB C 148 41.900 41.900 39.342 2.558 25155 7565 1 9 . 1 1 148 148 ASN H H 148 8.975 8.975 8.101 0.874 25155 7566 1 9 . 1 1 149 149 GLN N N 149 117.900 117.900 115.660 2.240 25155 7567 1 9 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.217 0.719 25155 7568 1 9 . 1 1 149 149 GLN C C 149 178.280 178.280 174.613 3.667 25155 7569 1 9 . 1 1 149 149 GLN CA C 149 53.730 53.730 54.731 -1.002 25155 7570 1 9 . 1 1 149 149 GLN CB C 149 29.790 29.790 30.041 -0.251 25155 7571 1 9 . 1 1 149 149 GLN H H 149 7.430 7.430 7.347 0.083 25155 7572 1 9 . 1 1 150 150 TYR N N 150 121.060 121.060 120.749 0.311 25155 7573 1 9 . 1 1 150 150 TYR HA H 150 4.671 4.671 4.702 -0.031 25155 7574 1 9 . 1 1 150 150 TYR C C 150 178.680 178.680 177.057 1.623 25155 7575 1 9 . 1 1 150 150 TYR CA C 150 57.930 57.930 58.111 -0.181 25155 7576 1 9 . 1 1 150 150 TYR CB C 150 38.860 38.860 38.905 -0.045 25155 7577 1 9 . 1 1 150 150 TYR H H 150 8.115 8.115 8.420 -0.305 25155 7578 1 9 . 1 1 151 151 ASP N N 151 121.175 121.175 119.845 1.330 25155 7579 1 9 . 1 1 151 151 ASP CA C 151 57.000 57.000 55.248 1.752 25155 7580 1 9 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.994 1.006 25155 7581 1 9 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.291 0.299 25155 7582 1 9 . 1 1 152 152 LEU C C 152 178.300 178.300 178.136 0.164 25155 7583 1 9 . 1 1 152 152 LEU CA C 152 54.788 54.788 56.087 -1.300 25155 7584 1 9 . 1 1 152 152 LEU CB C 152 42.200 42.200 41.665 0.535 25155 7585 1 9 . 1 1 153 153 SER N N 153 116.170 116.170 115.490 0.680 25155 7586 1 9 . 1 1 153 153 SER HA H 153 3.911 3.911 4.079 -0.168 25155 7587 1 9 . 1 1 153 153 SER CA C 153 63.400 63.400 61.068 2.332 25155 7588 1 9 . 1 1 153 153 SER CB C 153 63.200 63.200 63.178 0.022 25155 7589 1 9 . 1 1 153 153 SER H H 153 7.378 7.378 8.079 -0.701 25155 7590 1 9 . 1 1 154 154 ASP N N 154 121.640 121.640 122.309 -0.669 25155 7591 1 9 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.445 -0.205 25155 7592 1 9 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.062 2.238 25155 7593 1 9 . 1 1 154 154 ASP CB C 154 40.000 40.000 41.038 -1.038 25155 7594 1 9 . 1 1 155 155 GLU HA H 155 4.170 4.170 4.061 0.109 25155 7595 1 9 . 1 1 155 155 GLU C C 155 179.420 179.420 179.015 0.405 25155 7596 1 9 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.362 -0.162 25155 7597 1 9 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.627 -0.147 25155 7598 1 9 . 1 1 156 156 ARG N N 156 121.230 121.230 118.993 2.237 25155 7599 1 9 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.301 -0.025 25155 7600 1 9 . 1 1 156 156 ARG C C 156 177.350 177.350 179.495 -2.145 25155 7601 1 9 . 1 1 156 156 ARG CA C 156 59.950 59.950 59.551 0.399 25155 7602 1 9 . 1 1 156 156 ARG CB C 156 31.100 31.100 30.242 0.858 25155 7603 1 9 . 1 1 157 157 ILE N N 157 118.190 118.190 119.640 -1.450 25155 7604 1 9 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.890 -0.460 25155 7605 1 9 . 1 1 157 157 ILE C C 157 178.480 178.480 178.441 0.039 25155 7606 1 9 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.282 1.278 25155 7607 1 9 . 1 1 157 157 ILE CB C 157 38.480 38.480 38.068 0.412 25155 7608 1 9 . 1 1 157 157 ILE H H 157 8.705 8.705 8.072 0.633 25155 7609 1 9 . 1 1 158 158 GLN N N 158 119.975 119.975 120.765 -0.790 25155 7610 1 9 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.990 -0.034 25155 7611 1 9 . 1 1 158 158 GLN C C 158 178.730 178.730 178.308 0.422 25155 7612 1 9 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.313 1.387 25155 7613 1 9 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.456 0.026 25155 7614 1 9 . 1 1 158 158 GLN H H 158 8.262 8.262 8.638 -0.376 25155 7615 1 9 . 1 1 159 159 SER N N 159 115.466 115.466 115.451 0.015 25155 7616 1 9 . 1 1 159 159 SER HA H 159 4.446 4.446 4.316 0.130 25155 7617 1 9 . 1 1 159 159 SER C C 159 177.320 177.320 176.894 0.426 25155 7618 1 9 . 1 1 159 159 SER CA C 159 63.500 63.500 61.254 2.246 25155 7619 1 9 . 1 1 159 159 SER CB C 159 63.818 63.818 63.238 0.580 25155 7620 1 9 . 1 1 159 159 SER H H 159 8.440 8.440 8.238 0.202 25155 7621 1 9 . 1 1 160 160 TRP N N 160 126.784 126.784 124.600 2.184 25155 7622 1 9 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.435 0.019 25155 7623 1 9 . 1 1 160 160 TRP C C 160 177.934 177.934 177.815 0.119 25155 7624 1 9 . 1 1 160 160 TRP CA C 160 62.745 62.745 62.218 0.527 25155 7625 1 9 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.473 -0.123 25155 7626 1 9 . 1 1 160 160 TRP H H 160 9.243 9.243 7.780 1.463 25155 7627 1 9 . 1 1 161 161 CYS N N 161 116.395 116.395 119.984 -3.589 25155 7628 1 9 . 1 1 161 161 CYS HA H 161 3.886 3.886 4.120 -0.234 25155 7629 1 9 . 1 1 161 161 CYS C C 161 176.245 176.245 177.372 -1.127 25155 7630 1 9 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.320 0.980 25155 7631 1 9 . 1 1 161 161 CYS CB C 161 27.723 27.723 27.427 0.296 25155 7632 1 9 . 1 1 161 161 CYS H H 161 8.845 8.845 9.109 -0.264 25155 7633 1 9 . 1 1 162 162 GLU N N 162 118.030 118.030 119.276 -1.246 25155 7634 1 9 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.929 -0.009 25155 7635 1 9 . 1 1 162 162 GLU C C 162 178.700 178.700 178.697 0.003 25155 7636 1 9 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.558 0.242 25155 7637 1 9 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.136 0.364 25155 7638 1 9 . 1 1 163 163 GLN N N 163 120.650 120.650 119.569 1.081 25155 7639 1 9 . 1 1 163 163 GLN HA H 163 4.173 4.173 4.020 0.153 25155 7640 1 9 . 1 1 163 163 GLN C C 163 179.700 179.700 178.467 1.233 25155 7641 1 9 . 1 1 163 163 GLN CA C 163 59.688 59.688 58.923 0.765 25155 7642 1 9 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.714 0.186 25155 7643 1 9 . 1 1 163 163 GLN H H 163 8.148 8.148 7.795 0.353 25155 7644 1 9 . 1 1 164 164 ILE N N 164 114.836 114.836 117.211 -2.375 25155 7645 1 9 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.533 0.527 25155 7646 1 9 . 1 1 164 164 ILE C C 164 178.676 178.676 177.706 0.970 25155 7647 1 9 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.474 1.686 25155 7648 1 9 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.429 0.201 25155 7649 1 9 . 1 1 164 164 ILE H H 164 8.958 8.958 8.207 0.751 25155 7650 1 9 . 1 1 165 165 LEU N N 165 123.700 123.700 119.883 3.817 25155 7651 1 9 . 1 1 165 165 LEU HA H 165 4.100 4.100 4.031 0.069 25155 7652 1 9 . 1 1 165 165 LEU C C 165 180.548 180.548 178.409 2.139 25155 7653 1 9 . 1 1 165 165 LEU CA C 165 58.150 58.150 58.444 -0.294 25155 7654 1 9 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.436 -0.306 25155 7655 1 9 . 1 1 165 165 LEU H H 165 7.830 7.830 7.999 -0.169 25155 7656 1 9 . 1 1 166 166 ASN N N 166 120.160 120.160 118.458 1.702 25155 7657 1 9 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.332 0.238 25155 7658 1 9 . 1 1 166 166 ASN C C 166 175.690 175.690 177.382 -1.692 25155 7659 1 9 . 1 1 166 166 ASN CA C 166 55.946 55.946 57.034 -1.088 25155 7660 1 9 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.279 0.201 25155 7661 1 9 . 1 1 166 166 ASN H H 166 7.706 7.706 7.787 -0.081 25155 7662 1 9 . 1 1 167 167 GLU N N 167 121.286 121.286 120.469 0.817 25155 7663 1 9 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.324 -0.220 25155 7664 1 9 . 1 1 167 167 GLU C C 167 180.520 180.520 178.363 2.157 25155 7665 1 9 . 1 1 167 167 GLU CA C 167 59.920 59.920 58.888 1.032 25155 7666 1 9 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.712 1.213 25155 7667 1 9 . 1 1 168 168 MET N N 168 118.622 118.622 116.128 2.494 25155 7668 1 9 . 1 1 168 168 MET HA H 168 3.996 3.996 4.903 -0.907 25155 7669 1 9 . 1 1 168 168 MET C C 168 176.856 176.856 178.515 -1.659 25155 7670 1 9 . 1 1 168 168 MET CA C 168 59.500 59.500 58.449 1.051 25155 7671 1 9 . 1 1 168 168 MET CB C 168 33.700 33.700 33.286 0.414 25155 7672 1 9 . 1 1 168 168 MET H H 168 8.723 8.723 8.324 0.399 25155 7673 1 9 . 1 1 169 169 ALA N N 169 121.760 121.760 123.253 -1.493 25155 7674 1 9 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.327 -0.171 25155 7675 1 9 . 1 1 169 169 ALA C C 169 179.790 179.790 179.668 0.122 25155 7676 1 9 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.235 0.565 25155 7677 1 9 . 1 1 169 169 ALA CB C 169 18.220 18.220 18.799 -0.579 25155 7678 1 9 . 1 1 169 169 ALA H H 169 7.494 7.494 7.991 -0.497 25155 7679 1 9 . 1 1 170 170 GLU N N 170 116.970 116.970 118.493 -1.523 25155 7680 1 9 . 1 1 170 170 GLU HA H 170 4.091 4.091 3.949 0.142 25155 7681 1 9 . 1 1 170 170 GLU C C 170 177.745 177.745 178.315 -0.570 25155 7682 1 9 . 1 1 170 170 GLU CA C 170 58.000 58.000 58.837 -0.837 25155 7683 1 9 . 1 1 170 170 GLU CB C 170 29.730 29.730 28.966 0.764 25155 7684 1 9 . 1 1 171 171 HIS N N 171 118.150 118.150 116.126 2.024 25155 7685 1 9 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.485 -0.015 25155 7686 1 9 . 1 1 171 171 HIS C C 171 175.848 175.848 175.802 0.046 25155 7687 1 9 . 1 1 171 171 HIS CA C 171 57.600 57.600 57.546 0.054 25155 7688 1 9 . 1 1 171 171 HIS CB C 171 30.800 30.800 30.024 0.776 25155 7689 1 9 . 1 1 171 171 HIS H H 171 7.717 7.717 7.425 0.292 25155 7690 1 9 . 1 1 172 172 TYR N N 172 119.483 119.483 117.165 2.318 25155 7691 1 9 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.559 0.032 25155 7692 1 9 . 1 1 172 172 TYR C C 172 174.590 174.590 175.805 -1.215 25155 7693 1 9 . 1 1 172 172 TYR CA C 172 57.813 57.813 57.788 0.025 25155 7694 1 9 . 1 1 172 172 TYR CB C 172 38.900 38.900 39.452 -0.552 25155 7695 1 9 . 1 1 172 172 TYR H H 172 7.778 7.778 7.991 -0.213 25155 7696 1 10 . 1 1 2 2 ASN N N 2 122.966 122.966 121.959 1.007 25155 7697 1 10 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.147 0.028 25155 7698 1 10 . 1 1 2 2 ASN C C 2 175.200 175.200 173.578 1.622 25155 7699 1 10 . 1 1 2 2 ASN CA C 2 52.920 52.920 53.245 -0.325 25155 7700 1 10 . 1 1 2 2 ASN CB C 2 40.000 40.000 42.282 -2.282 25155 7701 1 10 . 1 1 2 2 ASN H H 2 9.392 9.392 8.474 0.918 25155 7702 1 10 . 1 1 3 3 MET N N 3 120.660 120.660 121.077 -0.417 25155 7703 1 10 . 1 1 3 3 MET HA H 3 5.565 5.565 5.138 0.427 25155 7704 1 10 . 1 1 3 3 MET C C 3 174.200 174.200 175.630 -1.430 25155 7705 1 10 . 1 1 3 3 MET CA C 3 54.550 54.550 54.012 0.538 25155 7706 1 10 . 1 1 3 3 MET CB C 3 34.100 34.100 34.640 -0.540 25155 7707 1 10 . 1 1 3 3 MET H H 3 8.745 8.745 9.041 -0.296 25155 7708 1 10 . 1 1 4 4 GLY N N 4 115.792 115.792 109.569 6.223 25155 7709 1 10 . 1 1 4 4 GLY C C 4 170.444 170.444 172.154 -1.710 25155 7710 1 10 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.217 -0.330 25155 7711 1 10 . 1 1 4 4 GLY H H 4 8.989 8.989 8.910 0.079 25155 7712 1 10 . 1 1 5 5 LEU N N 5 131.175 131.175 124.619 6.556 25155 7713 1 10 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.271 1.051 25155 7714 1 10 . 1 1 5 5 LEU C C 5 175.700 175.700 174.711 0.989 25155 7715 1 10 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.644 -0.324 25155 7716 1 10 . 1 1 5 5 LEU CB C 5 44.700 44.700 43.853 0.847 25155 7717 1 10 . 1 1 5 5 LEU H H 5 8.917 8.917 8.035 0.882 25155 7718 1 10 . 1 1 6 6 PHE N N 6 125.990 125.990 125.264 0.726 25155 7719 1 10 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.709 0.029 25155 7720 1 10 . 1 1 6 6 PHE C C 6 174.358 174.358 173.427 0.931 25155 7721 1 10 . 1 1 6 6 PHE CA C 6 55.480 55.480 54.868 0.612 25155 7722 1 10 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.155 -0.105 25155 7723 1 10 . 1 1 6 6 PHE H H 6 9.225 9.225 9.235 -0.010 25155 7724 1 10 . 1 1 7 7 TYR N N 7 118.040 118.040 117.229 0.811 25155 7725 1 10 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.731 0.198 25155 7726 1 10 . 1 1 7 7 TYR C C 7 171.690 171.690 173.779 -2.089 25155 7727 1 10 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.304 -0.844 25155 7728 1 10 . 1 1 7 7 TYR CB C 7 40.800 40.800 41.118 -0.318 25155 7729 1 10 . 1 1 7 7 TYR H H 7 8.235 8.235 8.053 0.182 25155 7730 1 10 . 1 1 8 8 GLY N N 8 106.640 106.640 106.988 -0.348 25155 7731 1 10 . 1 1 8 8 GLY C C 8 171.682 171.682 173.394 -1.712 25155 7732 1 10 . 1 1 8 8 GLY CA C 8 44.050 44.050 45.922 -1.873 25155 7733 1 10 . 1 1 8 8 GLY H H 8 6.996 6.996 8.713 -1.717 25155 7734 1 10 . 1 1 9 9 SER N N 9 118.164 118.164 120.141 -1.977 25155 7735 1 10 . 1 1 9 9 SER C C 9 174.560 174.560 174.135 0.425 25155 7736 1 10 . 1 1 9 9 SER CA C 9 57.140 57.140 59.292 -2.152 25155 7737 1 10 . 1 1 9 9 SER H H 9 9.680 9.680 8.406 1.274 25155 7738 1 10 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.819 -0.189 25155 7739 1 10 . 1 1 17 17 ALA C C 17 177.740 177.740 178.834 -1.094 25155 7740 1 10 . 1 1 17 17 ALA CA C 17 54.900 54.900 55.046 -0.146 25155 7741 1 10 . 1 1 17 17 ALA CB C 17 17.790 17.790 17.808 -0.018 25155 7742 1 10 . 1 1 17 17 ALA H H 17 8.055 8.055 7.537 0.518 25155 7743 1 10 . 1 1 18 18 ALA N N 18 120.026 120.026 121.432 -1.406 25155 7744 1 10 . 1 1 18 18 ALA HA H 18 3.713 3.713 3.930 -0.217 25155 7745 1 10 . 1 1 18 18 ALA C C 18 179.040 179.040 179.707 -0.667 25155 7746 1 10 . 1 1 18 18 ALA CA C 18 54.860 54.860 54.954 -0.094 25155 7747 1 10 . 1 1 18 18 ALA CB C 18 18.200 18.200 18.017 0.183 25155 7748 1 10 . 1 1 18 18 ALA H H 18 7.015 7.015 8.129 -1.114 25155 7749 1 10 . 1 1 19 19 GLU N N 19 116.656 116.656 118.401 -1.745 25155 7750 1 10 . 1 1 19 19 GLU HA H 19 3.580 3.580 3.966 -0.386 25155 7751 1 10 . 1 1 19 19 GLU C C 19 178.487 178.487 179.244 -0.757 25155 7752 1 10 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.850 -0.180 25155 7753 1 10 . 1 1 19 19 GLU CB C 19 29.400 29.400 29.652 -0.252 25155 7754 1 10 . 1 1 20 20 LYS N N 20 120.100 120.100 119.837 0.263 25155 7755 1 10 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.081 0.265 25155 7756 1 10 . 1 1 20 20 LYS C C 20 175.330 175.330 179.143 -3.813 25155 7757 1 10 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.335 -2.235 25155 7758 1 10 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.499 0.500 25155 7759 1 10 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.637 -0.172 25155 7760 1 10 . 1 1 21 21 ILE C C 21 177.680 177.680 177.907 -0.227 25155 7761 1 10 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.782 -0.142 25155 7762 1 10 . 1 1 21 21 ILE CB C 21 38.030 38.030 37.850 0.180 25155 7763 1 10 . 1 1 21 21 ILE H H 21 8.220 8.220 8.682 -0.462 25155 7764 1 10 . 1 1 22 22 ARG N N 22 119.433 119.433 119.790 -0.357 25155 7765 1 10 . 1 1 22 22 ARG HA H 22 3.550 3.550 3.910 -0.360 25155 7766 1 10 . 1 1 22 22 ARG C C 22 177.268 177.268 178.284 -1.016 25155 7767 1 10 . 1 1 22 22 ARG CA C 22 59.760 59.760 59.692 0.068 25155 7768 1 10 . 1 1 22 22 ARG CB C 22 28.900 28.900 29.908 -1.008 25155 7769 1 10 . 1 1 23 23 ASP N N 23 118.945 118.945 119.618 -0.673 25155 7770 1 10 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.447 -0.105 25155 7771 1 10 . 1 1 23 23 ASP C C 23 178.470 178.470 178.879 -0.409 25155 7772 1 10 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.263 0.187 25155 7773 1 10 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.879 -0.509 25155 7774 1 10 . 1 1 24 24 ILE N N 24 121.200 121.200 119.288 1.912 25155 7775 1 10 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.815 -0.081 25155 7776 1 10 . 1 1 24 24 ILE C C 24 178.297 178.297 177.876 0.421 25155 7777 1 10 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.689 -0.189 25155 7778 1 10 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.485 0.255 25155 7779 1 10 . 1 1 24 24 ILE H H 24 8.160 8.160 8.062 0.098 25155 7780 1 10 . 1 1 25 25 ILE N N 25 121.166 121.166 117.715 3.451 25155 7781 1 10 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.908 -0.265 25155 7782 1 10 . 1 1 25 25 ILE C C 25 176.825 176.825 176.639 0.186 25155 7783 1 10 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.104 2.786 25155 7784 1 10 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.904 -1.154 25155 7785 1 10 . 1 1 25 25 ILE H H 25 8.480 8.480 8.034 0.446 25155 7786 1 10 . 1 1 26 26 GLY N N 26 109.050 109.050 105.115 3.935 25155 7787 1 10 . 1 1 26 26 GLY C C 26 173.800 173.800 172.289 1.511 25155 7788 1 10 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.504 -0.104 25155 7789 1 10 . 1 1 26 26 GLY H H 26 7.945 7.945 7.759 0.186 25155 7790 1 10 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.457 -0.094 25155 7791 1 10 . 1 1 27 27 PRO C C 27 177.157 177.157 176.942 0.215 25155 7792 1 10 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.796 0.734 25155 7793 1 10 . 1 1 27 27 PRO CB C 27 32.000 32.000 32.084 -0.084 25155 7794 1 10 . 1 1 28 28 GLU N N 28 116.510 116.510 116.867 -0.357 25155 7795 1 10 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.210 0.050 25155 7796 1 10 . 1 1 28 28 GLU C C 28 177.000 177.000 176.928 0.072 25155 7797 1 10 . 1 1 28 28 GLU CA C 28 57.680 57.680 57.929 -0.249 25155 7798 1 10 . 1 1 28 28 GLU CB C 28 28.620 28.620 29.254 -0.634 25155 7799 1 10 . 1 1 29 29 LEU N N 29 120.334 120.334 112.790 7.544 25155 7800 1 10 . 1 1 29 29 LEU HA H 29 4.650 4.650 4.989 -0.339 25155 7801 1 10 . 1 1 29 29 LEU C C 29 175.676 175.676 175.268 0.408 25155 7802 1 10 . 1 1 29 29 LEU CA C 29 55.924 55.924 54.798 1.125 25155 7803 1 10 . 1 1 29 29 LEU CB C 29 44.880 44.880 44.586 0.294 25155 7804 1 10 . 1 1 29 29 LEU H H 29 7.924 7.924 7.481 0.443 25155 7805 1 10 . 1 1 30 30 VAL N N 30 118.900 118.900 121.320 -2.420 25155 7806 1 10 . 1 1 30 30 VAL HA H 30 4.639 4.639 4.741 -0.102 25155 7807 1 10 . 1 1 30 30 VAL C C 30 174.368 174.368 176.019 -1.651 25155 7808 1 10 . 1 1 30 30 VAL CA C 30 61.110 61.110 61.916 -0.806 25155 7809 1 10 . 1 1 30 30 VAL CB C 30 34.500 34.500 33.656 0.844 25155 7810 1 10 . 1 1 30 30 VAL H H 30 7.486 7.486 7.644 -0.158 25155 7811 1 10 . 1 1 31 31 THR N N 31 124.000 124.000 120.073 3.927 25155 7812 1 10 . 1 1 31 31 THR HA H 31 4.331 4.331 4.652 -0.321 25155 7813 1 10 . 1 1 31 31 THR C C 31 172.670 172.670 172.761 -0.091 25155 7814 1 10 . 1 1 31 31 THR CA C 31 61.784 61.784 61.221 0.562 25155 7815 1 10 . 1 1 31 31 THR CB C 31 70.483 70.483 71.159 -0.675 25155 7816 1 10 . 1 1 31 31 THR H H 31 7.947 7.947 8.412 -0.465 25155 7817 1 10 . 1 1 32 32 LEU N N 32 127.408 127.408 125.224 2.184 25155 7818 1 10 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.387 0.250 25155 7819 1 10 . 1 1 32 32 LEU C C 32 176.425 176.425 176.291 0.134 25155 7820 1 10 . 1 1 32 32 LEU CA C 32 54.760 54.760 54.878 -0.118 25155 7821 1 10 . 1 1 32 32 LEU CB C 32 43.809 43.809 43.085 0.724 25155 7822 1 10 . 1 1 32 32 LEU H H 32 8.614 8.614 8.503 0.111 25155 7823 1 10 . 1 1 33 33 HIS N N 33 120.230 120.230 122.026 -1.796 25155 7824 1 10 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.955 -0.535 25155 7825 1 10 . 1 1 33 33 HIS C C 33 171.914 171.914 174.167 -2.253 25155 7826 1 10 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.575 0.724 25155 7827 1 10 . 1 1 33 33 HIS CB C 33 32.050 32.050 30.698 1.352 25155 7828 1 10 . 1 1 33 33 HIS H H 33 9.130 9.130 9.016 0.114 25155 7829 1 10 . 1 1 34 34 ASN N N 34 123.987 123.987 121.133 2.854 25155 7830 1 10 . 1 1 34 34 ASN HA H 34 3.600 3.600 4.069 -0.469 25155 7831 1 10 . 1 1 34 34 ASN C C 34 177.930 177.930 175.667 2.263 25155 7832 1 10 . 1 1 34 34 ASN CA C 34 51.730 51.730 52.329 -0.599 25155 7833 1 10 . 1 1 34 34 ASN CB C 34 38.747 38.747 38.341 0.406 25155 7834 1 10 . 1 1 34 34 ASN H H 34 8.759 8.759 8.097 0.662 25155 7835 1 10 . 1 1 35 35 LEU N N 35 128.751 128.751 126.740 2.011 25155 7836 1 10 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.186 0.104 25155 7837 1 10 . 1 1 35 35 LEU C C 35 177.363 177.363 177.898 -0.535 25155 7838 1 10 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.067 0.483 25155 7839 1 10 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.272 1.490 25155 7840 1 10 . 1 1 35 35 LEU H H 35 8.758 8.758 8.744 0.014 25155 7841 1 10 . 1 1 36 36 LYS N N 36 120.870 120.870 117.315 3.555 25155 7842 1 10 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.021 -0.088 25155 7843 1 10 . 1 1 36 36 LYS C C 36 176.540 176.540 177.163 -0.623 25155 7844 1 10 . 1 1 36 36 LYS CA C 36 59.260 59.260 58.340 0.920 25155 7845 1 10 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.408 0.392 25155 7846 1 10 . 1 1 37 37 ASP N N 37 115.288 115.288 116.234 -0.946 25155 7847 1 10 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.703 0.044 25155 7848 1 10 . 1 1 37 37 ASP C C 37 175.500 175.500 175.840 -0.340 25155 7849 1 10 . 1 1 37 37 ASP CA C 37 54.805 54.805 54.432 0.373 25155 7850 1 10 . 1 1 37 37 ASP CB C 37 44.650 44.650 43.691 0.959 25155 7851 1 10 . 1 1 38 38 ASP N N 38 121.550 121.550 121.440 0.110 25155 7852 1 10 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.861 0.004 25155 7853 1 10 . 1 1 38 38 ASP C C 38 174.895 174.895 176.009 -1.114 25155 7854 1 10 . 1 1 38 38 ASP CA C 38 52.840 52.840 54.379 -1.539 25155 7855 1 10 . 1 1 38 38 ASP CB C 38 42.240 42.240 42.179 0.061 25155 7856 1 10 . 1 1 39 39 SER N N 39 115.170 115.170 118.008 -2.838 25155 7857 1 10 . 1 1 39 39 SER HA H 39 4.600 4.600 4.646 -0.046 25155 7858 1 10 . 1 1 39 39 SER C C 39 174.930 174.930 174.403 0.527 25155 7859 1 10 . 1 1 39 39 SER CA C 39 54.786 54.786 56.798 -2.012 25155 7860 1 10 . 1 1 39 39 SER CB C 39 64.840 64.840 63.440 1.400 25155 7861 1 10 . 1 1 39 39 SER H H 39 8.330 8.330 8.652 -0.322 25155 7862 1 10 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.523 -0.523 25155 7863 1 10 . 1 1 40 40 PRO C C 40 176.620 176.620 178.240 -1.620 25155 7864 1 10 . 1 1 40 40 PRO CA C 40 63.870 63.870 64.984 -1.114 25155 7865 1 10 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.758 -0.398 25155 7866 1 10 . 1 1 41 41 LYS N N 41 120.913 120.913 119.354 1.559 25155 7867 1 10 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.140 -0.244 25155 7868 1 10 . 1 1 41 41 LYS C C 41 179.580 179.580 178.600 0.980 25155 7869 1 10 . 1 1 41 41 LYS CA C 41 58.000 58.000 58.423 -0.423 25155 7870 1 10 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.430 0.670 25155 7871 1 10 . 1 1 42 42 LEU N N 42 118.206 118.206 121.003 -2.797 25155 7872 1 10 . 1 1 42 42 LEU HA H 42 4.025 4.025 3.819 0.206 25155 7873 1 10 . 1 1 42 42 LEU C C 42 178.630 178.630 178.385 0.245 25155 7874 1 10 . 1 1 42 42 LEU CA C 42 57.030 57.030 57.359 -0.329 25155 7875 1 10 . 1 1 42 42 LEU CB C 42 41.820 41.820 41.041 0.779 25155 7876 1 10 . 1 1 42 42 LEU H H 42 7.598 7.598 7.507 0.091 25155 7877 1 10 . 1 1 43 43 MET N N 43 118.913 118.913 116.693 2.220 25155 7878 1 10 . 1 1 43 43 MET HA H 43 3.760 3.760 4.072 -0.312 25155 7879 1 10 . 1 1 43 43 MET C C 43 177.710 177.710 177.609 0.101 25155 7880 1 10 . 1 1 43 43 MET CA C 43 59.864 59.864 58.213 1.651 25155 7881 1 10 . 1 1 43 43 MET CB C 43 32.680 32.680 31.936 0.744 25155 7882 1 10 . 1 1 43 43 MET H H 43 8.180 8.180 7.968 0.212 25155 7883 1 10 . 1 1 44 44 GLU N N 44 110.906 110.906 117.349 -6.443 25155 7884 1 10 . 1 1 44 44 GLU HA H 44 3.732 3.732 4.034 -0.302 25155 7885 1 10 . 1 1 44 44 GLU C C 44 178.120 178.120 178.765 -0.645 25155 7886 1 10 . 1 1 44 44 GLU CA C 44 59.450 59.450 58.838 0.612 25155 7887 1 10 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.582 0.218 25155 7888 1 10 . 1 1 45 45 GLN N N 45 115.770 115.770 117.909 -2.139 25155 7889 1 10 . 1 1 45 45 GLN HA H 45 4.190 4.190 3.939 0.251 25155 7890 1 10 . 1 1 45 45 GLN C C 45 175.480 175.480 176.231 -0.751 25155 7891 1 10 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.301 -1.201 25155 7892 1 10 . 1 1 45 45 GLN CB C 45 28.490 28.490 28.701 -0.211 25155 7893 1 10 . 1 1 45 45 GLN H H 45 7.517 7.517 7.219 0.298 25155 7894 1 10 . 1 1 46 46 TYR N N 46 117.840 117.840 117.898 -0.058 25155 7895 1 10 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.332 0.328 25155 7896 1 10 . 1 1 46 46 TYR C C 46 175.480 175.480 176.598 -1.118 25155 7897 1 10 . 1 1 46 46 TYR CA C 46 58.827 58.827 57.476 1.351 25155 7898 1 10 . 1 1 46 46 TYR CB C 46 41.720 41.720 38.223 3.497 25155 7899 1 10 . 1 1 46 46 TYR H H 46 6.955 6.955 7.078 -0.123 25155 7900 1 10 . 1 1 47 47 ASP N N 47 121.540 121.540 122.078 -0.538 25155 7901 1 10 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.634 0.062 25155 7902 1 10 . 1 1 47 47 ASP C C 47 175.677 175.677 175.597 0.080 25155 7903 1 10 . 1 1 47 47 ASP CA C 47 56.812 56.812 57.563 -0.751 25155 7904 1 10 . 1 1 47 47 ASP CB C 47 42.978 42.978 41.927 1.051 25155 7905 1 10 . 1 1 48 48 VAL N N 48 118.666 118.666 117.128 1.538 25155 7906 1 10 . 1 1 48 48 VAL HA H 48 5.057 5.057 5.016 0.041 25155 7907 1 10 . 1 1 48 48 VAL C C 48 174.180 174.180 174.353 -0.173 25155 7908 1 10 . 1 1 48 48 VAL CA C 48 60.000 60.000 60.330 -0.330 25155 7909 1 10 . 1 1 48 48 VAL CB C 48 36.200 36.200 34.449 1.751 25155 7910 1 10 . 1 1 48 48 VAL H H 48 7.631 7.631 7.892 -0.261 25155 7911 1 10 . 1 1 49 49 LEU N N 49 128.300 128.300 127.946 0.354 25155 7912 1 10 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.041 0.559 25155 7913 1 10 . 1 1 49 49 LEU C C 49 174.810 174.810 175.011 -0.201 25155 7914 1 10 . 1 1 49 49 LEU CA C 49 52.230 52.230 54.150 -1.919 25155 7915 1 10 . 1 1 49 49 LEU CB C 49 45.400 45.400 45.096 0.304 25155 7916 1 10 . 1 1 49 49 LEU H H 49 9.469 9.469 8.812 0.657 25155 7917 1 10 . 1 1 50 50 ILE N N 50 124.400 124.400 127.579 -3.179 25155 7918 1 10 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.465 1.185 25155 7919 1 10 . 1 1 50 50 ILE C C 50 175.286 175.286 174.344 0.942 25155 7920 1 10 . 1 1 50 50 ILE CA C 50 59.900 59.900 61.474 -1.574 25155 7921 1 10 . 1 1 50 50 ILE CB C 50 40.200 40.200 39.452 0.748 25155 7922 1 10 . 1 1 50 50 ILE H H 50 9.213 9.213 9.242 -0.029 25155 7923 1 10 . 1 1 51 51 LEU N N 51 127.410 127.410 128.330 -0.920 25155 7924 1 10 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.100 1.970 25155 7925 1 10 . 1 1 51 51 LEU C C 51 174.540 174.540 175.432 -0.892 25155 7926 1 10 . 1 1 51 51 LEU CA C 51 52.950 52.950 53.236 -0.286 25155 7927 1 10 . 1 1 51 51 LEU CB C 51 43.190 43.190 43.278 -0.088 25155 7928 1 10 . 1 1 51 51 LEU H H 51 9.256 9.256 8.721 0.535 25155 7929 1 10 . 1 1 52 52 GLY N N 52 108.290 108.290 110.994 -2.704 25155 7930 1 10 . 1 1 52 52 GLY C C 52 174.330 174.330 171.508 2.822 25155 7931 1 10 . 1 1 52 52 GLY CA C 52 44.040 44.040 43.380 0.660 25155 7932 1 10 . 1 1 52 52 GLY H H 52 8.949 8.949 8.562 0.387 25155 7933 1 10 . 1 1 53 53 ILE N N 53 124.912 124.912 121.442 3.470 25155 7934 1 10 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.576 -0.401 25155 7935 1 10 . 1 1 53 53 ILE C C 53 174.470 174.470 172.807 1.663 25155 7936 1 10 . 1 1 53 53 ILE CA C 53 55.850 55.850 57.980 -2.130 25155 7937 1 10 . 1 1 53 53 ILE CB C 53 42.800 42.800 41.748 1.052 25155 7938 1 10 . 1 1 53 53 ILE H H 53 8.612 8.612 7.230 1.382 25155 7939 1 10 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.369 0.443 25155 7940 1 10 . 1 1 54 54 PRO C C 54 174.565 174.565 176.510 -1.945 25155 7941 1 10 . 1 1 54 54 PRO CA C 54 61.850 61.850 62.871 -1.021 25155 7942 1 10 . 1 1 54 54 PRO CB C 54 32.400 32.400 31.900 0.500 25155 7943 1 10 . 1 1 55 55 THR N N 55 116.040 116.040 110.664 5.376 25155 7944 1 10 . 1 1 55 55 THR HA H 55 4.522 4.522 3.776 0.746 25155 7945 1 10 . 1 1 55 55 THR C C 55 173.990 173.990 173.052 0.938 25155 7946 1 10 . 1 1 55 55 THR CA C 55 62.845 62.845 64.558 -1.713 25155 7947 1 10 . 1 1 55 55 THR CB C 55 70.795 70.795 68.481 2.314 25155 7948 1 10 . 1 1 55 55 THR H H 55 7.663 7.663 7.559 0.104 25155 7949 1 10 . 1 1 56 56 TRP N N 56 130.540 130.540 119.666 10.874 25155 7950 1 10 . 1 1 56 56 TRP CA C 56 54.800 54.800 56.210 -1.410 25155 7951 1 10 . 1 1 56 56 TRP H H 56 9.075 9.075 7.997 1.078 25155 7952 1 10 . 1 1 58 58 PHE HA H 58 4.540 4.540 2.505 2.035 25155 7953 1 10 . 1 1 58 58 PHE C C 58 177.070 177.070 174.332 2.738 25155 7954 1 10 . 1 1 58 58 PHE CA C 58 55.460 55.460 57.938 -2.478 25155 7955 1 10 . 1 1 58 58 PHE CB C 58 41.200 41.200 36.702 4.498 25155 7956 1 10 . 1 1 59 59 GLY N N 59 109.796 109.796 103.934 5.862 25155 7957 1 10 . 1 1 59 59 GLY CA C 59 45.763 45.763 43.810 1.953 25155 7958 1 10 . 1 1 59 59 GLY H H 59 8.392 8.392 6.997 1.395 25155 7959 1 10 . 1 1 60 60 GLU C C 60 175.660 175.660 176.215 -0.555 25155 7960 1 10 . 1 1 61 61 ILE N N 61 122.380 122.380 119.858 2.522 25155 7961 1 10 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.604 0.836 25155 7962 1 10 . 1 1 61 61 ILE CA C 61 62.100 62.100 61.876 0.224 25155 7963 1 10 . 1 1 61 61 ILE CB C 61 38.750 38.750 37.833 0.917 25155 7964 1 10 . 1 1 61 61 ILE H H 61 8.436 8.436 8.275 0.161 25155 7965 1 10 . 1 1 62 62 GLN CB C 62 30.570 30.570 28.588 1.982 25155 7966 1 10 . 1 1 63 63 GLU HA H 63 4.030 4.030 4.007 0.023 25155 7967 1 10 . 1 1 63 63 GLU C C 63 177.134 177.134 177.922 -0.788 25155 7968 1 10 . 1 1 63 63 GLU CA C 63 60.520 60.520 60.538 -0.019 25155 7969 1 10 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.678 -0.028 25155 7970 1 10 . 1 1 64 64 ASP N N 64 119.630 119.630 117.266 2.364 25155 7971 1 10 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.515 0.077 25155 7972 1 10 . 1 1 64 64 ASP C C 64 178.680 178.680 176.896 1.784 25155 7973 1 10 . 1 1 64 64 ASP CA C 64 57.823 57.823 56.545 1.278 25155 7974 1 10 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.602 0.498 25155 7975 1 10 . 1 1 65 65 TRP N N 65 120.535 120.535 122.337 -1.802 25155 7976 1 10 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.521 -0.196 25155 7977 1 10 . 1 1 65 65 TRP C C 65 178.684 178.684 177.745 0.939 25155 7978 1 10 . 1 1 65 65 TRP CA C 65 60.500 60.500 60.107 0.393 25155 7979 1 10 . 1 1 65 65 TRP CB C 65 30.100 30.100 30.995 -0.895 25155 7980 1 10 . 1 1 65 65 TRP H H 65 7.416 7.416 7.772 -0.356 25155 7981 1 10 . 1 1 66 66 GLU N N 66 120.760 120.760 120.626 0.134 25155 7982 1 10 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.208 -0.388 25155 7983 1 10 . 1 1 66 66 GLU C C 66 178.860 178.860 178.889 -0.029 25155 7984 1 10 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.734 0.366 25155 7985 1 10 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.700 -0.690 25155 7986 1 10 . 1 1 67 67 ALA N N 67 118.972 118.972 121.759 -2.787 25155 7987 1 10 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.243 0.004 25155 7988 1 10 . 1 1 67 67 ALA C C 67 179.610 179.610 179.006 0.604 25155 7989 1 10 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.913 -0.313 25155 7990 1 10 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.858 -0.070 25155 7991 1 10 . 1 1 67 67 ALA H H 67 7.690 7.690 8.469 -0.779 25155 7992 1 10 . 1 1 68 68 VAL N N 68 107.530 107.530 111.265 -3.735 25155 7993 1 10 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.362 0.348 25155 7994 1 10 . 1 1 68 68 VAL C C 68 176.800 176.800 176.880 -0.080 25155 7995 1 10 . 1 1 68 68 VAL CA C 68 60.060 60.060 62.640 -2.580 25155 7996 1 10 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.294 0.306 25155 7997 1 10 . 1 1 68 68 VAL H H 68 7.240 7.240 7.655 -0.415 25155 7998 1 10 . 1 1 69 69 TRP N N 69 126.960 126.960 125.347 1.613 25155 7999 1 10 . 1 1 69 69 TRP HA H 69 4.182 4.182 4.344 -0.162 25155 8000 1 10 . 1 1 69 69 TRP C C 69 178.640 178.640 176.631 2.009 25155 8001 1 10 . 1 1 69 69 TRP CA C 69 61.300 61.300 62.152 -0.852 25155 8002 1 10 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.521 2.049 25155 8003 1 10 . 1 1 69 69 TRP H H 69 7.810 7.810 7.462 0.348 25155 8004 1 10 . 1 1 70 70 ASP N N 70 114.644 114.644 115.728 -1.084 25155 8005 1 10 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.210 0.308 25155 8006 1 10 . 1 1 70 70 ASP C C 70 178.685 178.685 178.270 0.415 25155 8007 1 10 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.179 -0.180 25155 8008 1 10 . 1 1 70 70 ASP CB C 70 39.810 39.810 41.050 -1.240 25155 8009 1 10 . 1 1 71 71 GLN N N 71 120.100 120.100 117.378 2.722 25155 8010 1 10 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.246 -0.056 25155 8011 1 10 . 1 1 71 71 GLN C C 71 178.870 178.870 178.201 0.669 25155 8012 1 10 . 1 1 71 71 GLN CA C 71 57.617 57.617 57.346 0.271 25155 8013 1 10 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.600 -0.780 25155 8014 1 10 . 1 1 71 71 GLN H H 71 7.980 7.980 7.926 0.054 25155 8015 1 10 . 1 1 72 72 LEU N N 72 117.535 117.535 120.789 -3.254 25155 8016 1 10 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.978 -0.181 25155 8017 1 10 . 1 1 72 72 LEU C C 72 178.308 178.308 178.877 -0.569 25155 8018 1 10 . 1 1 72 72 LEU CA C 72 57.340 57.340 57.401 -0.061 25155 8019 1 10 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.363 0.337 25155 8020 1 10 . 1 1 72 72 LEU H H 72 7.435 7.435 7.787 -0.352 25155 8021 1 10 . 1 1 73 73 ASP N N 73 115.534 115.534 119.586 -4.052 25155 8022 1 10 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.353 -0.203 25155 8023 1 10 . 1 1 73 73 ASP C C 73 177.553 177.553 176.913 0.640 25155 8024 1 10 . 1 1 73 73 ASP CA C 73 57.350 57.350 56.786 0.564 25155 8025 1 10 . 1 1 73 73 ASP CB C 73 40.040 40.040 40.688 -0.648 25155 8026 1 10 . 1 1 74 74 ASP N N 74 117.300 117.300 118.965 -1.665 25155 8027 1 10 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.546 0.160 25155 8028 1 10 . 1 1 74 74 ASP C C 74 176.424 176.424 176.936 -0.512 25155 8029 1 10 . 1 1 74 74 ASP CA C 74 54.170 54.170 54.982 -0.812 25155 8030 1 10 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.439 0.381 25155 8031 1 10 . 1 1 75 75 LEU N N 75 118.500 118.500 119.957 -1.457 25155 8032 1 10 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.161 0.134 25155 8033 1 10 . 1 1 75 75 LEU C C 75 176.800 176.800 176.512 0.288 25155 8034 1 10 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.816 -0.416 25155 8035 1 10 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.281 0.999 25155 8036 1 10 . 1 1 75 75 LEU H H 75 6.966 6.966 7.266 -0.300 25155 8037 1 10 . 1 1 76 76 ASN N N 76 123.040 123.040 119.126 3.914 25155 8038 1 10 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.678 0.184 25155 8039 1 10 . 1 1 76 76 ASN C C 76 174.927 174.927 174.917 0.010 25155 8040 1 10 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.214 -1.333 25155 8041 1 10 . 1 1 76 76 ASN CB C 76 37.510 37.510 38.674 -1.164 25155 8042 1 10 . 1 1 76 76 ASN H H 76 9.882 9.882 9.061 0.821 25155 8043 1 10 . 1 1 77 77 LEU N N 77 123.614 123.614 123.406 0.208 25155 8044 1 10 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.538 -0.168 25155 8045 1 10 . 1 1 77 77 LEU C C 77 175.110 175.110 176.685 -1.575 25155 8046 1 10 . 1 1 77 77 LEU CA C 77 52.200 52.200 54.027 -1.827 25155 8047 1 10 . 1 1 77 77 LEU CB C 77 42.786 42.786 42.555 0.231 25155 8048 1 10 . 1 1 77 77 LEU H H 77 8.700 8.700 8.061 0.639 25155 8049 1 10 . 1 1 78 78 GLU N N 78 120.822 120.822 121.419 -0.597 25155 8050 1 10 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.266 -0.366 25155 8051 1 10 . 1 1 78 78 GLU C C 78 178.670 178.670 178.023 0.647 25155 8052 1 10 . 1 1 78 78 GLU CA C 78 58.700 58.700 57.960 0.740 25155 8053 1 10 . 1 1 78 78 GLU CB C 78 29.467 29.467 29.453 0.014 25155 8054 1 10 . 1 1 79 79 GLY N N 79 113.160 113.160 113.025 0.135 25155 8055 1 10 . 1 1 79 79 GLY C C 79 174.523 174.523 174.122 0.401 25155 8056 1 10 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.316 0.104 25155 8057 1 10 . 1 1 79 79 GLY H H 79 8.450 8.450 8.470 -0.020 25155 8058 1 10 . 1 1 80 80 LYS N N 80 120.283 120.283 120.619 -0.336 25155 8059 1 10 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.314 0.044 25155 8060 1 10 . 1 1 80 80 LYS C C 80 175.304 175.304 176.159 -0.855 25155 8061 1 10 . 1 1 80 80 LYS CA C 80 56.890 56.890 56.257 0.633 25155 8062 1 10 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.973 -0.853 25155 8063 1 10 . 1 1 81 81 ILE N N 81 122.288 122.288 121.457 0.831 25155 8064 1 10 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.366 0.440 25155 8065 1 10 . 1 1 81 81 ILE C C 81 174.750 174.750 175.247 -0.497 25155 8066 1 10 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.359 -1.539 25155 8067 1 10 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.620 0.230 25155 8068 1 10 . 1 1 81 81 ILE H H 81 7.405 7.405 8.218 -0.813 25155 8069 1 10 . 1 1 82 82 VAL N N 82 127.793 127.793 125.020 2.773 25155 8070 1 10 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.113 0.167 25155 8071 1 10 . 1 1 82 82 VAL C C 82 172.680 172.680 174.219 -1.539 25155 8072 1 10 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.160 -0.060 25155 8073 1 10 . 1 1 82 82 VAL CB C 82 35.280 35.280 36.062 -0.782 25155 8074 1 10 . 1 1 82 82 VAL H H 82 8.800 8.800 9.030 -0.230 25155 8075 1 10 . 1 1 83 83 ALA N N 83 130.911 130.911 128.892 2.019 25155 8076 1 10 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.618 -0.229 25155 8077 1 10 . 1 1 83 83 ALA C C 83 175.870 175.870 175.965 -0.095 25155 8078 1 10 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.287 0.713 25155 8079 1 10 . 1 1 83 83 ALA CB C 83 23.722 23.722 22.847 0.875 25155 8080 1 10 . 1 1 83 83 ALA H H 83 9.252 9.252 8.813 0.439 25155 8081 1 10 . 1 1 84 84 LEU N N 84 124.269 124.269 121.997 2.272 25155 8082 1 10 . 1 1 84 84 LEU HA H 84 5.508 5.508 5.381 0.127 25155 8083 1 10 . 1 1 84 84 LEU C C 84 175.490 175.490 175.357 0.133 25155 8084 1 10 . 1 1 84 84 LEU CA C 84 53.670 53.670 53.939 -0.269 25155 8085 1 10 . 1 1 84 84 LEU CB C 84 45.000 45.000 45.847 -0.847 25155 8086 1 10 . 1 1 84 84 LEU H H 84 10.378 10.378 9.034 1.344 25155 8087 1 10 . 1 1 85 85 TYR N N 85 115.826 115.826 119.862 -4.036 25155 8088 1 10 . 1 1 85 85 TYR HA H 85 4.950 4.950 5.289 -0.339 25155 8089 1 10 . 1 1 85 85 TYR C C 85 172.661 172.661 173.605 -0.944 25155 8090 1 10 . 1 1 85 85 TYR CA C 85 55.853 55.853 55.292 0.561 25155 8091 1 10 . 1 1 85 85 TYR CB C 85 43.200 43.200 41.469 1.731 25155 8092 1 10 . 1 1 85 85 TYR H H 85 9.200 9.200 8.774 0.426 25155 8093 1 10 . 1 1 86 86 GLY N N 86 106.802 106.802 105.642 1.160 25155 8094 1 10 . 1 1 86 86 GLY C C 86 170.348 170.348 171.003 -0.655 25155 8095 1 10 . 1 1 86 86 GLY CA C 86 44.687 44.687 44.572 0.116 25155 8096 1 10 . 1 1 86 86 GLY H H 86 8.752 8.752 8.413 0.339 25155 8097 1 10 . 1 1 87 87 LEU N N 87 120.860 120.860 121.738 -0.878 25155 8098 1 10 . 1 1 87 87 LEU HA H 87 5.476 5.476 4.976 0.500 25155 8099 1 10 . 1 1 87 87 LEU C C 87 177.720 177.720 174.892 2.828 25155 8100 1 10 . 1 1 87 87 LEU CA C 87 52.630 52.630 52.626 0.004 25155 8101 1 10 . 1 1 87 87 LEU CB C 87 45.900 45.900 45.141 0.759 25155 8102 1 10 . 1 1 87 87 LEU H H 87 6.320 6.320 7.760 -1.440 25155 8103 1 10 . 1 1 88 88 GLY N N 88 109.910 109.910 110.398 -0.488 25155 8104 1 10 . 1 1 88 88 GLY C C 88 171.386 171.386 172.785 -1.399 25155 8105 1 10 . 1 1 88 88 GLY CA C 88 45.710 45.710 44.480 1.230 25155 8106 1 10 . 1 1 88 88 GLY H H 88 8.320 8.320 8.006 0.314 25155 8107 1 10 . 1 1 89 89 ASP N N 89 121.580 121.580 119.686 1.894 25155 8108 1 10 . 1 1 89 89 ASP HA H 89 5.190 5.190 4.446 0.744 25155 8109 1 10 . 1 1 89 89 ASP C C 89 176.608 176.608 176.618 -0.010 25155 8110 1 10 . 1 1 89 89 ASP CA C 89 52.200 52.200 53.437 -1.237 25155 8111 1 10 . 1 1 89 89 ASP CB C 89 41.900 41.900 40.683 1.217 25155 8112 1 10 . 1 1 90 90 GLN N N 90 123.900 123.900 113.950 9.950 25155 8113 1 10 . 1 1 90 90 GLN HA H 90 3.645 3.645 3.936 -0.291 25155 8114 1 10 . 1 1 90 90 GLN C C 90 173.523 173.523 175.216 -1.693 25155 8115 1 10 . 1 1 90 90 GLN CA C 90 58.706 58.706 57.782 0.924 25155 8116 1 10 . 1 1 90 90 GLN CB C 90 28.800 28.800 26.674 2.126 25155 8117 1 10 . 1 1 90 90 GLN H H 90 8.726 8.726 8.503 0.223 25155 8118 1 10 . 1 1 91 91 LEU N N 91 117.080 117.080 116.227 0.853 25155 8119 1 10 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.447 0.023 25155 8120 1 10 . 1 1 91 91 LEU C C 91 179.840 179.840 177.580 2.260 25155 8121 1 10 . 1 1 91 91 LEU CA C 91 55.800 55.800 55.137 0.663 25155 8122 1 10 . 1 1 91 91 LEU CB C 91 41.640 41.640 42.854 -1.214 25155 8123 1 10 . 1 1 91 91 LEU H H 91 7.092 7.092 8.302 -1.210 25155 8124 1 10 . 1 1 92 92 GLY N N 92 110.460 110.460 106.422 4.038 25155 8125 1 10 . 1 1 92 92 GLY C C 92 174.824 174.824 175.428 -0.604 25155 8126 1 10 . 1 1 92 92 GLY CA C 92 46.390 46.390 45.585 0.805 25155 8127 1 10 . 1 1 92 92 GLY H H 92 9.243 9.243 8.845 0.398 25155 8128 1 10 . 1 1 93 93 TYR N N 93 118.140 118.140 123.807 -5.667 25155 8129 1 10 . 1 1 93 93 TYR HA H 93 5.173 5.173 4.447 0.726 25155 8130 1 10 . 1 1 93 93 TYR C C 93 177.805 177.805 175.686 2.119 25155 8131 1 10 . 1 1 93 93 TYR CA C 93 57.430 57.430 57.343 0.087 25155 8132 1 10 . 1 1 93 93 TYR CB C 93 39.300 39.300 35.944 3.356 25155 8133 1 10 . 1 1 93 93 TYR H H 93 7.252 7.252 9.403 -2.151 25155 8134 1 10 . 1 1 94 94 GLY N N 94 112.455 112.455 109.483 2.972 25155 8135 1 10 . 1 1 94 94 GLY C C 94 177.740 177.740 175.715 2.025 25155 8136 1 10 . 1 1 94 94 GLY CA C 94 49.880 49.880 45.932 3.948 25155 8137 1 10 . 1 1 94 94 GLY H H 94 8.154 8.154 8.247 -0.093 25155 8138 1 10 . 1 1 95 95 GLU N N 95 123.040 123.040 120.811 2.229 25155 8139 1 10 . 1 1 95 95 GLU HA H 95 4.000 4.000 4.347 -0.347 25155 8140 1 10 . 1 1 95 95 GLU C C 95 175.145 175.145 176.968 -1.823 25155 8141 1 10 . 1 1 95 95 GLU CA C 95 57.950 57.950 58.204 -0.254 25155 8142 1 10 . 1 1 95 95 GLU CB C 95 27.400 27.400 30.243 -2.843 25155 8143 1 10 . 1 1 96 96 TRP N N 96 118.000 118.000 119.579 -1.579 25155 8144 1 10 . 1 1 96 96 TRP HA H 96 5.213 5.213 4.684 0.529 25155 8145 1 10 . 1 1 96 96 TRP C C 96 176.616 176.616 175.820 0.796 25155 8146 1 10 . 1 1 96 96 TRP CA C 96 57.120 57.120 55.583 1.537 25155 8147 1 10 . 1 1 96 96 TRP CB C 96 29.970 29.970 28.637 1.333 25155 8148 1 10 . 1 1 96 96 TRP H H 96 7.785 7.785 7.982 -0.197 25155 8149 1 10 . 1 1 97 97 PHE N N 97 123.268 123.268 120.765 2.503 25155 8150 1 10 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.466 0.194 25155 8151 1 10 . 1 1 97 97 PHE CA C 97 58.742 58.742 60.782 -2.040 25155 8152 1 10 . 1 1 97 97 PHE CB C 97 40.835 40.835 39.767 1.068 25155 8153 1 10 . 1 1 97 97 PHE H H 97 7.054 7.054 7.560 -0.506 25155 8154 1 10 . 1 1 98 98 LEU HA H 98 3.440 3.440 4.250 -0.810 25155 8155 1 10 . 1 1 98 98 LEU C C 98 176.613 176.613 175.968 0.645 25155 8156 1 10 . 1 1 98 98 LEU CA C 98 56.000 56.000 53.179 2.821 25155 8157 1 10 . 1 1 98 98 LEU CB C 98 38.600 38.600 41.020 -2.420 25155 8158 1 10 . 1 1 98 98 LEU H H 98 8.584 8.584 7.596 0.988 25155 8159 1 10 . 1 1 99 99 ASP N N 99 123.268 123.268 122.632 0.636 25155 8160 1 10 . 1 1 99 99 ASP HA H 99 3.965 3.965 3.930 0.035 25155 8161 1 10 . 1 1 99 99 ASP C C 99 178.876 178.876 176.841 2.035 25155 8162 1 10 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.675 1.585 25155 8163 1 10 . 1 1 99 99 ASP CB C 99 40.350 40.350 40.443 -0.093 25155 8164 1 10 . 1 1 100 100 ALA N N 100 119.124 119.124 120.080 -0.956 25155 8165 1 10 . 1 1 100 100 ALA HA H 100 3.822 3.822 4.092 -0.270 25155 8166 1 10 . 1 1 100 100 ALA C C 100 178.490 178.490 179.141 -0.651 25155 8167 1 10 . 1 1 100 100 ALA CA C 100 55.100 55.100 53.889 1.211 25155 8168 1 10 . 1 1 100 100 ALA CB C 100 19.700 19.700 18.203 1.497 25155 8169 1 10 . 1 1 100 100 ALA H H 100 8.400 8.400 7.404 0.996 25155 8170 1 10 . 1 1 101 101 LEU N N 101 118.687 118.687 120.828 -2.141 25155 8171 1 10 . 1 1 101 101 LEU HA H 101 3.674 3.674 3.878 -0.204 25155 8172 1 10 . 1 1 101 101 LEU C C 101 179.050 179.050 178.477 0.573 25155 8173 1 10 . 1 1 101 101 LEU CA C 101 57.800 57.800 57.173 0.627 25155 8174 1 10 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.518 1.132 25155 8175 1 10 . 1 1 101 101 LEU H H 101 6.518 6.518 7.398 -0.880 25155 8176 1 10 . 1 1 102 102 GLY N N 102 104.410 104.410 106.240 -1.830 25155 8177 1 10 . 1 1 102 102 GLY C C 102 176.056 176.056 175.897 0.159 25155 8178 1 10 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.108 0.642 25155 8179 1 10 . 1 1 102 102 GLY H H 102 7.712 7.712 7.658 0.054 25155 8180 1 10 . 1 1 103 103 MET N N 103 120.550 120.550 121.394 -0.844 25155 8181 1 10 . 1 1 103 103 MET HA H 103 4.256 4.256 4.287 -0.031 25155 8182 1 10 . 1 1 103 103 MET C C 103 179.650 179.650 178.467 1.183 25155 8183 1 10 . 1 1 103 103 MET CA C 103 59.450 59.450 59.393 0.057 25155 8184 1 10 . 1 1 103 103 MET CB C 103 32.300 32.300 32.696 -0.396 25155 8185 1 10 . 1 1 103 103 MET H H 103 8.485 8.485 7.471 1.014 25155 8186 1 10 . 1 1 104 104 LEU N N 104 123.480 123.480 120.376 3.104 25155 8187 1 10 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.260 -0.199 25155 8188 1 10 . 1 1 104 104 LEU C C 104 177.750 177.750 178.623 -0.873 25155 8189 1 10 . 1 1 104 104 LEU CA C 104 58.100 58.100 57.520 0.580 25155 8190 1 10 . 1 1 104 104 LEU CB C 104 41.450 41.450 41.202 0.248 25155 8191 1 10 . 1 1 104 104 LEU H H 104 8.392 8.392 8.288 0.104 25155 8192 1 10 . 1 1 105 105 HIS N N 105 119.570 119.570 120.335 -0.765 25155 8193 1 10 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.110 -0.258 25155 8194 1 10 . 1 1 105 105 HIS C C 105 177.550 177.550 177.033 0.517 25155 8195 1 10 . 1 1 105 105 HIS CA C 105 61.000 61.000 60.864 0.136 25155 8196 1 10 . 1 1 105 105 HIS CB C 105 28.820 28.820 30.165 -1.345 25155 8197 1 10 . 1 1 105 105 HIS H H 105 8.247 8.247 8.045 0.202 25155 8198 1 10 . 1 1 106 106 ASP N N 106 119.780 119.780 119.688 0.092 25155 8199 1 10 . 1 1 106 106 ASP HA H 106 4.333 4.333 4.368 -0.035 25155 8200 1 10 . 1 1 106 106 ASP C C 106 179.410 179.410 178.392 1.018 25155 8201 1 10 . 1 1 106 106 ASP CA C 106 57.800 57.800 57.282 0.518 25155 8202 1 10 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.128 -0.528 25155 8203 1 10 . 1 1 107 107 LYS N N 107 121.660 121.660 118.555 3.105 25155 8204 1 10 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.093 0.007 25155 8205 1 10 . 1 1 107 107 LYS C C 107 178.316 178.316 178.385 -0.069 25155 8206 1 10 . 1 1 107 107 LYS CA C 107 58.750 58.750 59.037 -0.287 25155 8207 1 10 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.612 -0.762 25155 8208 1 10 . 1 1 108 108 LEU N N 108 116.050 116.050 117.666 -1.616 25155 8209 1 10 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.407 -0.397 25155 8210 1 10 . 1 1 108 108 LEU C C 108 179.050 179.050 178.103 0.947 25155 8211 1 10 . 1 1 108 108 LEU CA C 108 56.240 56.240 55.835 0.405 25155 8212 1 10 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.513 -0.713 25155 8213 1 10 . 1 1 108 108 LEU H H 108 8.072 8.072 7.623 0.449 25155 8214 1 10 . 1 1 109 109 SER N N 109 116.280 116.280 115.402 0.878 25155 8215 1 10 . 1 1 109 109 SER HA H 109 4.300 4.300 4.263 0.037 25155 8216 1 10 . 1 1 109 109 SER C C 109 175.848 175.848 175.791 0.057 25155 8217 1 10 . 1 1 109 109 SER CA C 109 62.410 62.410 61.591 0.819 25155 8218 1 10 . 1 1 109 109 SER CB C 109 62.850 62.850 63.358 -0.507 25155 8219 1 10 . 1 1 109 109 SER H H 109 8.366 8.366 8.046 0.320 25155 8220 1 10 . 1 1 110 110 THR N N 110 110.416 110.416 110.436 -0.020 25155 8221 1 10 . 1 1 110 110 THR HA H 110 4.614 4.614 4.283 0.331 25155 8222 1 10 . 1 1 110 110 THR C C 110 175.675 175.675 175.319 0.356 25155 8223 1 10 . 1 1 110 110 THR CA C 110 62.030 62.030 63.894 -1.863 25155 8224 1 10 . 1 1 110 110 THR CB C 110 68.810 68.810 68.752 0.057 25155 8225 1 10 . 1 1 110 110 THR H H 110 7.185 7.185 7.938 -0.753 25155 8226 1 10 . 1 1 111 111 LYS N N 111 120.090 120.090 120.350 -0.260 25155 8227 1 10 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.412 0.101 25155 8228 1 10 . 1 1 111 111 LYS C C 111 176.814 176.814 176.624 0.190 25155 8229 1 10 . 1 1 111 111 LYS CA C 111 55.730 55.730 55.739 -0.008 25155 8230 1 10 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.484 -1.554 25155 8231 1 10 . 1 1 112 112 GLY N N 112 107.540 107.540 108.103 -0.563 25155 8232 1 10 . 1 1 112 112 GLY C C 112 176.223 176.223 174.164 2.059 25155 8233 1 10 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.334 1.592 25155 8234 1 10 . 1 1 112 112 GLY H H 112 8.315 8.315 7.529 0.786 25155 8235 1 10 . 1 1 113 113 VAL N N 113 113.536 113.536 114.486 -0.950 25155 8236 1 10 . 1 1 113 113 VAL HA H 113 4.494 4.494 4.416 0.078 25155 8237 1 10 . 1 1 113 113 VAL C C 113 174.560 174.560 174.746 -0.186 25155 8238 1 10 . 1 1 113 113 VAL CA C 113 59.550 59.550 60.655 -1.105 25155 8239 1 10 . 1 1 113 113 VAL CB C 113 32.800 32.800 32.376 0.424 25155 8240 1 10 . 1 1 113 113 VAL H H 113 6.835 6.835 6.947 -0.112 25155 8241 1 10 . 1 1 114 114 LYS N N 114 122.920 122.920 121.574 1.346 25155 8242 1 10 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.473 0.022 25155 8243 1 10 . 1 1 114 114 LYS C C 114 174.925 174.925 174.746 0.179 25155 8244 1 10 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.403 -0.123 25155 8245 1 10 . 1 1 114 114 LYS CB C 114 33.630 33.630 33.777 -0.147 25155 8246 1 10 . 1 1 115 115 PHE N N 115 123.140 123.140 124.561 -1.421 25155 8247 1 10 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.249 0.451 25155 8248 1 10 . 1 1 115 115 PHE C C 115 177.580 177.580 176.603 0.977 25155 8249 1 10 . 1 1 115 115 PHE CA C 115 58.677 58.677 57.201 1.476 25155 8250 1 10 . 1 1 115 115 PHE CB C 115 41.120 41.120 39.979 1.141 25155 8251 1 10 . 1 1 115 115 PHE H H 115 8.506 8.506 8.714 -0.208 25155 8252 1 10 . 1 1 116 116 VAL N N 116 115.737 115.737 119.961 -4.224 25155 8253 1 10 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.669 -0.191 25155 8254 1 10 . 1 1 116 116 VAL C C 116 175.300 175.300 175.636 -0.336 25155 8255 1 10 . 1 1 116 116 VAL CA C 116 58.877 58.877 60.211 -1.333 25155 8256 1 10 . 1 1 116 116 VAL CB C 116 34.120 34.120 33.557 0.563 25155 8257 1 10 . 1 1 116 116 VAL H H 116 8.860 8.860 8.948 -0.088 25155 8258 1 10 . 1 1 117 117 GLY N N 117 108.137 108.137 112.747 -4.610 25155 8259 1 10 . 1 1 117 117 GLY C C 117 176.110 176.110 174.181 1.929 25155 8260 1 10 . 1 1 117 117 GLY CA C 117 47.500 47.500 45.077 2.423 25155 8261 1 10 . 1 1 117 117 GLY H H 117 9.838 9.838 9.489 0.349 25155 8262 1 10 . 1 1 118 118 TYR N N 118 120.380 120.380 119.752 0.628 25155 8263 1 10 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.490 0.480 25155 8264 1 10 . 1 1 118 118 TYR C C 118 177.630 177.630 174.747 2.883 25155 8265 1 10 . 1 1 118 118 TYR CA C 118 55.800 55.800 60.336 -4.536 25155 8266 1 10 . 1 1 118 118 TYR CB C 118 35.970 35.970 38.151 -2.181 25155 8267 1 10 . 1 1 118 118 TYR H H 118 8.652 8.652 8.201 0.451 25155 8268 1 10 . 1 1 119 119 TRP N N 119 126.040 126.040 118.529 7.511 25155 8269 1 10 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.210 0.811 25155 8270 1 10 . 1 1 119 119 TRP C C 119 173.000 173.000 173.927 -0.927 25155 8271 1 10 . 1 1 119 119 TRP CA C 119 53.820 53.820 56.079 -2.259 25155 8272 1 10 . 1 1 119 119 TRP CB C 119 36.050 36.050 33.555 2.495 25155 8273 1 10 . 1 1 119 119 TRP H H 119 8.070 8.070 8.469 -0.399 25155 8274 1 10 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.602 0.182 25155 8275 1 10 . 1 1 120 120 PRO C C 120 176.870 176.870 176.496 0.374 25155 8276 1 10 . 1 1 120 120 PRO CA C 120 63.780 63.780 62.875 0.905 25155 8277 1 10 . 1 1 120 120 PRO CB C 120 31.990 31.990 32.336 -0.346 25155 8278 1 10 . 1 1 121 121 THR N N 121 109.310 109.310 114.583 -5.273 25155 8279 1 10 . 1 1 121 121 THR HA H 121 4.073 4.073 4.515 -0.442 25155 8280 1 10 . 1 1 121 121 THR C C 121 176.324 176.324 175.148 1.176 25155 8281 1 10 . 1 1 121 121 THR CA C 121 61.250 61.250 62.720 -1.470 25155 8282 1 10 . 1 1 121 121 THR CB C 121 69.730 69.730 69.326 0.404 25155 8283 1 10 . 1 1 121 121 THR H H 121 7.370 7.370 8.275 -0.905 25155 8284 1 10 . 1 1 122 122 GLU N N 122 123.937 123.937 120.624 3.313 25155 8285 1 10 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.067 0.157 25155 8286 1 10 . 1 1 122 122 GLU C C 122 177.737 177.737 177.615 0.122 25155 8287 1 10 . 1 1 122 122 GLU CA C 122 58.200 58.200 57.195 1.005 25155 8288 1 10 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.525 0.275 25155 8289 1 10 . 1 1 123 123 GLY N N 123 114.563 114.563 111.319 3.244 25155 8290 1 10 . 1 1 123 123 GLY C C 123 173.783 173.783 173.537 0.246 25155 8291 1 10 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.215 0.165 25155 8292 1 10 . 1 1 123 123 GLY H H 123 9.144 9.144 8.687 0.457 25155 8293 1 10 . 1 1 124 124 TYR N N 124 118.800 118.800 116.484 2.316 25155 8294 1 10 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.441 0.777 25155 8295 1 10 . 1 1 124 124 TYR C C 124 175.673 175.673 175.745 -0.072 25155 8296 1 10 . 1 1 124 124 TYR CA C 124 56.950 56.950 55.690 1.260 25155 8297 1 10 . 1 1 124 124 TYR CB C 124 41.100 41.100 38.366 2.734 25155 8298 1 10 . 1 1 124 124 TYR H H 124 7.895 7.895 7.243 0.652 25155 8299 1 10 . 1 1 125 125 GLU N N 125 124.790 124.790 119.780 5.010 25155 8300 1 10 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.270 0.415 25155 8301 1 10 . 1 1 125 125 GLU C C 125 172.877 172.877 175.662 -2.785 25155 8302 1 10 . 1 1 125 125 GLU CA C 125 55.700 55.700 55.838 -0.138 25155 8303 1 10 . 1 1 125 125 GLU CB C 125 31.340 31.340 30.396 0.944 25155 8304 1 10 . 1 1 126 126 PHE N N 126 118.670 118.670 116.048 2.622 25155 8305 1 10 . 1 1 126 126 PHE HA H 126 4.841 4.841 4.745 0.096 25155 8306 1 10 . 1 1 126 126 PHE C C 126 173.800 173.800 175.485 -1.685 25155 8307 1 10 . 1 1 126 126 PHE CA C 126 56.950 56.950 56.573 0.377 25155 8308 1 10 . 1 1 126 126 PHE CB C 126 40.300 40.300 39.512 0.788 25155 8309 1 10 . 1 1 126 126 PHE H H 126 7.645 7.645 7.393 0.252 25155 8310 1 10 . 1 1 127 127 THR N N 127 107.038 107.038 113.360 -6.322 25155 8311 1 10 . 1 1 127 127 THR HA H 127 4.370 4.370 4.506 -0.136 25155 8312 1 10 . 1 1 127 127 THR C C 127 175.100 175.100 174.884 0.216 25155 8313 1 10 . 1 1 127 127 THR CA C 127 61.080 61.080 62.217 -1.137 25155 8314 1 10 . 1 1 127 127 THR CB C 127 70.500 70.500 69.667 0.833 25155 8315 1 10 . 1 1 127 127 THR H H 127 7.306 7.306 8.893 -1.587 25155 8316 1 10 . 1 1 128 128 SER N N 128 118.150 118.150 121.088 -2.938 25155 8317 1 10 . 1 1 128 128 SER HA H 128 4.650 4.650 4.633 0.017 25155 8318 1 10 . 1 1 128 128 SER C C 128 175.760 175.760 173.787 1.973 25155 8319 1 10 . 1 1 128 128 SER CA C 128 55.813 55.813 57.814 -2.001 25155 8320 1 10 . 1 1 128 128 SER CB C 128 65.300 65.300 63.751 1.550 25155 8321 1 10 . 1 1 128 128 SER H H 128 7.354 7.354 8.364 -1.010 25155 8322 1 10 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.334 0.430 25155 8323 1 10 . 1 1 129 129 PRO C C 129 178.860 178.860 178.115 0.745 25155 8324 1 10 . 1 1 129 129 PRO CA C 129 62.728 62.728 63.673 -0.945 25155 8325 1 10 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.411 -0.011 25155 8326 1 10 . 1 1 130 130 LYS N N 130 122.158 122.158 119.719 2.439 25155 8327 1 10 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.017 0.193 25155 8328 1 10 . 1 1 130 130 LYS C C 130 176.890 176.890 175.245 1.645 25155 8329 1 10 . 1 1 130 130 LYS CA C 130 61.375 61.375 60.464 0.911 25155 8330 1 10 . 1 1 130 130 LYS CB C 130 30.350 30.350 30.988 -0.637 25155 8331 1 10 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.348 0.185 25155 8332 1 10 . 1 1 131 131 PRO C C 131 173.810 173.810 175.607 -1.797 25155 8333 1 10 . 1 1 131 131 PRO CA C 131 64.510 64.510 63.165 1.345 25155 8334 1 10 . 1 1 131 131 PRO CB C 131 31.745 31.745 31.212 0.533 25155 8335 1 10 . 1 1 132 132 VAL N N 132 114.480 114.480 112.566 1.914 25155 8336 1 10 . 1 1 132 132 VAL HA H 132 5.158 5.158 5.122 0.036 25155 8337 1 10 . 1 1 132 132 VAL C C 132 175.137 175.137 174.025 1.112 25155 8338 1 10 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.296 0.504 25155 8339 1 10 . 1 1 132 132 VAL CB C 132 34.780 34.780 35.654 -0.875 25155 8340 1 10 . 1 1 132 132 VAL H H 132 6.716 6.716 7.405 -0.689 25155 8341 1 10 . 1 1 133 133 ILE N N 133 120.670 120.670 113.064 7.606 25155 8342 1 10 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.567 -0.175 25155 8343 1 10 . 1 1 133 133 ILE C C 133 175.485 175.485 174.807 0.678 25155 8344 1 10 . 1 1 133 133 ILE CA C 133 60.000 60.000 59.248 0.752 25155 8345 1 10 . 1 1 133 133 ILE CB C 133 42.020 42.020 41.351 0.669 25155 8346 1 10 . 1 1 133 133 ILE H H 133 8.740 8.740 8.544 0.196 25155 8347 1 10 . 1 1 134 134 ALA N N 134 122.454 122.454 123.370 -0.916 25155 8348 1 10 . 1 1 134 134 ALA HA H 134 3.953 3.953 3.918 0.035 25155 8349 1 10 . 1 1 134 134 ALA C C 134 178.387 178.387 177.340 1.047 25155 8350 1 10 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.338 -0.288 25155 8351 1 10 . 1 1 134 134 ALA CB C 134 16.982 16.982 17.076 -0.094 25155 8352 1 10 . 1 1 134 134 ALA H H 134 8.490 8.490 8.569 -0.079 25155 8353 1 10 . 1 1 135 135 ASP N N 135 117.310 117.310 116.848 0.462 25155 8354 1 10 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.302 -0.058 25155 8355 1 10 . 1 1 135 135 ASP C C 135 176.390 176.390 176.249 0.141 25155 8356 1 10 . 1 1 135 135 ASP CA C 135 55.120 55.120 54.583 0.537 25155 8357 1 10 . 1 1 135 135 ASP CB C 135 39.865 39.865 39.860 0.005 25155 8358 1 10 . 1 1 136 136 GLY N N 136 104.336 104.336 103.675 0.661 25155 8359 1 10 . 1 1 136 136 GLY C C 136 174.940 174.940 175.678 -0.738 25155 8360 1 10 . 1 1 136 136 GLY CA C 136 45.150 45.150 45.227 -0.077 25155 8361 1 10 . 1 1 136 136 GLY H H 136 7.592 7.592 7.767 -0.175 25155 8362 1 10 . 1 1 137 137 GLN N N 137 118.675 118.675 118.154 0.521 25155 8363 1 10 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.532 -0.470 25155 8364 1 10 . 1 1 137 137 GLN C C 137 176.420 176.420 175.492 0.928 25155 8365 1 10 . 1 1 137 137 GLN CA C 137 57.760 57.760 55.734 2.026 25155 8366 1 10 . 1 1 137 137 GLN CB C 137 30.400 30.400 29.928 0.472 25155 8367 1 10 . 1 1 137 137 GLN H H 137 7.843 7.843 7.899 -0.056 25155 8368 1 10 . 1 1 138 138 LEU N N 138 118.160 118.160 119.935 -1.775 25155 8369 1 10 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.767 0.194 25155 8370 1 10 . 1 1 138 138 LEU C C 138 175.700 175.700 174.188 1.512 25155 8371 1 10 . 1 1 138 138 LEU CA C 138 53.705 53.705 54.830 -1.125 25155 8372 1 10 . 1 1 138 138 LEU CB C 138 46.480 46.480 46.222 0.258 25155 8373 1 10 . 1 1 138 138 LEU H H 138 7.356 7.356 7.357 -0.001 25155 8374 1 10 . 1 1 139 139 PHE N N 139 119.060 119.060 122.464 -3.404 25155 8375 1 10 . 1 1 139 139 PHE HA H 139 5.344 5.344 5.013 0.331 25155 8376 1 10 . 1 1 139 139 PHE C C 139 178.850 178.850 177.555 1.295 25155 8377 1 10 . 1 1 139 139 PHE CA C 139 56.670 56.670 57.761 -1.091 25155 8378 1 10 . 1 1 139 139 PHE CB C 139 43.652 43.652 40.114 3.538 25155 8379 1 10 . 1 1 139 139 PHE H H 139 10.026 10.026 9.354 0.672 25155 8380 1 10 . 1 1 140 140 VAL N N 140 109.905 109.905 117.652 -7.747 25155 8381 1 10 . 1 1 140 140 VAL HA H 140 3.500 3.500 3.858 -0.358 25155 8382 1 10 . 1 1 140 140 VAL C C 140 172.860 172.860 174.742 -1.882 25155 8383 1 10 . 1 1 140 140 VAL CA C 140 61.812 61.812 61.888 -0.076 25155 8384 1 10 . 1 1 140 140 VAL CB C 140 30.250 30.250 30.317 -0.067 25155 8385 1 10 . 1 1 140 140 VAL H H 140 7.550 7.550 8.522 -0.972 25155 8386 1 10 . 1 1 141 141 GLY N N 141 106.600 106.600 107.502 -0.902 25155 8387 1 10 . 1 1 141 141 GLY C C 141 171.350 171.350 172.723 -1.373 25155 8388 1 10 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.665 0.795 25155 8389 1 10 . 1 1 141 141 GLY H H 141 7.052 7.052 7.255 -0.203 25155 8390 1 10 . 1 1 142 142 LEU N N 142 117.820 117.820 119.731 -1.911 25155 8391 1 10 . 1 1 142 142 LEU HA H 142 4.962 4.962 3.960 1.002 25155 8392 1 10 . 1 1 142 142 LEU CA C 142 55.600 55.600 54.117 1.483 25155 8393 1 10 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.507 -4.577 25155 8394 1 10 . 1 1 142 142 LEU H H 142 7.643 7.643 8.132 -0.489 25155 8395 1 10 . 1 1 143 143 ALA HA H 143 4.220 4.220 3.839 0.381 25155 8396 1 10 . 1 1 143 143 ALA C C 143 175.505 175.505 175.278 0.227 25155 8397 1 10 . 1 1 143 143 ALA CA C 143 49.600 49.600 50.033 -0.433 25155 8398 1 10 . 1 1 143 143 ALA CB C 143 23.330 23.330 18.384 4.946 25155 8399 1 10 . 1 1 144 144 LEU N N 144 124.960 124.960 123.929 1.031 25155 8400 1 10 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.394 0.386 25155 8401 1 10 . 1 1 144 144 LEU C C 144 174.700 174.700 175.312 -0.612 25155 8402 1 10 . 1 1 144 144 LEU CA C 144 52.790 52.790 53.546 -0.756 25155 8403 1 10 . 1 1 144 144 LEU CB C 144 45.300 45.300 44.993 0.306 25155 8404 1 10 . 1 1 144 144 LEU H H 144 8.583 8.583 8.135 0.448 25155 8405 1 10 . 1 1 145 145 ASP N N 145 119.100 119.100 122.398 -3.298 25155 8406 1 10 . 1 1 145 145 ASP HA H 145 5.422 5.422 5.018 0.404 25155 8407 1 10 . 1 1 145 145 ASP C C 145 176.180 176.180 174.818 1.362 25155 8408 1 10 . 1 1 145 145 ASP CA C 145 53.600 53.600 53.315 0.285 25155 8409 1 10 . 1 1 145 145 ASP CB C 145 43.180 43.180 43.577 -0.397 25155 8410 1 10 . 1 1 147 147 THR HA H 147 4.093 4.093 4.534 -0.441 25155 8411 1 10 . 1 1 147 147 THR C C 147 175.858 175.858 175.465 0.393 25155 8412 1 10 . 1 1 147 147 THR CA C 147 66.400 66.400 63.539 2.861 25155 8413 1 10 . 1 1 147 147 THR CB C 147 69.400 69.400 70.674 -1.274 25155 8414 1 10 . 1 1 147 147 THR H H 147 8.745 8.745 9.091 -0.346 25155 8415 1 10 . 1 1 148 148 ASN N N 148 115.408 115.408 119.569 -4.161 25155 8416 1 10 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.833 0.177 25155 8417 1 10 . 1 1 148 148 ASN C C 148 175.750 175.750 175.585 0.165 25155 8418 1 10 . 1 1 148 148 ASN CA C 148 53.400 53.400 55.102 -1.702 25155 8419 1 10 . 1 1 148 148 ASN CB C 148 41.900 41.900 39.746 2.154 25155 8420 1 10 . 1 1 148 148 ASN H H 148 8.975 8.975 8.856 0.119 25155 8421 1 10 . 1 1 149 149 GLN N N 149 117.900 117.900 116.949 0.951 25155 8422 1 10 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.565 0.371 25155 8423 1 10 . 1 1 149 149 GLN C C 149 178.280 178.280 175.019 3.261 25155 8424 1 10 . 1 1 149 149 GLN CA C 149 53.730 53.730 54.826 -1.096 25155 8425 1 10 . 1 1 149 149 GLN CB C 149 29.790 29.790 31.834 -2.044 25155 8426 1 10 . 1 1 149 149 GLN H H 149 7.430 7.430 8.670 -1.240 25155 8427 1 10 . 1 1 150 150 TYR N N 150 121.060 121.060 114.981 6.079 25155 8428 1 10 . 1 1 150 150 TYR HA H 150 4.671 4.671 4.706 -0.035 25155 8429 1 10 . 1 1 150 150 TYR C C 150 178.680 178.680 176.268 2.412 25155 8430 1 10 . 1 1 150 150 TYR CA C 150 57.930 57.930 58.916 -0.986 25155 8431 1 10 . 1 1 150 150 TYR CB C 150 38.860 38.860 38.776 0.084 25155 8432 1 10 . 1 1 150 150 TYR H H 150 8.115 8.115 8.106 0.009 25155 8433 1 10 . 1 1 151 151 ASP N N 151 121.175 121.175 122.174 -0.999 25155 8434 1 10 . 1 1 151 151 ASP CA C 151 57.000 57.000 55.864 1.136 25155 8435 1 10 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.358 1.642 25155 8436 1 10 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.481 0.109 25155 8437 1 10 . 1 1 152 152 LEU C C 152 178.300 178.300 177.092 1.208 25155 8438 1 10 . 1 1 152 152 LEU CA C 152 54.788 54.788 56.377 -1.589 25155 8439 1 10 . 1 1 152 152 LEU CB C 152 42.200 42.200 41.428 0.772 25155 8440 1 10 . 1 1 153 153 SER N N 153 116.170 116.170 117.197 -1.027 25155 8441 1 10 . 1 1 153 153 SER HA H 153 3.911 3.911 4.087 -0.176 25155 8442 1 10 . 1 1 153 153 SER CA C 153 63.400 63.400 62.331 1.069 25155 8443 1 10 . 1 1 153 153 SER CB C 153 63.200 63.200 62.475 0.725 25155 8444 1 10 . 1 1 153 153 SER H H 153 7.378 7.378 8.191 -0.813 25155 8445 1 10 . 1 1 154 154 ASP N N 154 121.640 121.640 121.617 0.023 25155 8446 1 10 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.286 -0.046 25155 8447 1 10 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.597 1.703 25155 8448 1 10 . 1 1 154 154 ASP CB C 154 40.000 40.000 40.974 -0.974 25155 8449 1 10 . 1 1 155 155 GLU HA H 155 4.170 4.170 3.988 0.182 25155 8450 1 10 . 1 1 155 155 GLU C C 155 179.420 179.420 178.890 0.530 25155 8451 1 10 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.142 0.058 25155 8452 1 10 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.566 -0.086 25155 8453 1 10 . 1 1 156 156 ARG N N 156 121.230 121.230 118.200 3.030 25155 8454 1 10 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.203 0.073 25155 8455 1 10 . 1 1 156 156 ARG C C 156 177.350 177.350 179.274 -1.924 25155 8456 1 10 . 1 1 156 156 ARG CA C 156 59.950 59.950 58.797 1.153 25155 8457 1 10 . 1 1 156 156 ARG CB C 156 31.100 31.100 29.683 1.417 25155 8458 1 10 . 1 1 157 157 ILE N N 157 118.190 118.190 119.343 -1.153 25155 8459 1 10 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.759 -0.329 25155 8460 1 10 . 1 1 157 157 ILE C C 157 178.480 178.480 177.965 0.515 25155 8461 1 10 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.036 1.524 25155 8462 1 10 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.957 0.523 25155 8463 1 10 . 1 1 157 157 ILE H H 157 8.705 8.705 7.321 1.384 25155 8464 1 10 . 1 1 158 158 GLN N N 158 119.975 119.975 120.586 -0.611 25155 8465 1 10 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.890 0.066 25155 8466 1 10 . 1 1 158 158 GLN C C 158 178.730 178.730 178.280 0.450 25155 8467 1 10 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.357 1.343 25155 8468 1 10 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.309 0.173 25155 8469 1 10 . 1 1 158 158 GLN H H 158 8.262 8.262 8.579 -0.317 25155 8470 1 10 . 1 1 159 159 SER N N 159 115.466 115.466 114.967 0.499 25155 8471 1 10 . 1 1 159 159 SER HA H 159 4.446 4.446 4.301 0.145 25155 8472 1 10 . 1 1 159 159 SER C C 159 177.320 177.320 176.754 0.566 25155 8473 1 10 . 1 1 159 159 SER CA C 159 63.500 63.500 61.054 2.446 25155 8474 1 10 . 1 1 159 159 SER CB C 159 63.818 63.818 63.161 0.657 25155 8475 1 10 . 1 1 159 159 SER H H 159 8.440 8.440 7.936 0.504 25155 8476 1 10 . 1 1 160 160 TRP N N 160 126.784 126.784 124.872 1.912 25155 8477 1 10 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.442 0.012 25155 8478 1 10 . 1 1 160 160 TRP C C 160 177.934 177.934 177.778 0.156 25155 8479 1 10 . 1 1 160 160 TRP CA C 160 62.745 62.745 62.141 0.604 25155 8480 1 10 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.346 0.004 25155 8481 1 10 . 1 1 160 160 TRP H H 160 9.243 9.243 7.796 1.447 25155 8482 1 10 . 1 1 161 161 CYS N N 161 116.395 116.395 118.233 -1.838 25155 8483 1 10 . 1 1 161 161 CYS HA H 161 3.886 3.886 3.872 0.014 25155 8484 1 10 . 1 1 161 161 CYS C C 161 176.245 176.245 177.131 -0.886 25155 8485 1 10 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.607 0.693 25155 8486 1 10 . 1 1 161 161 CYS CB C 161 27.723 27.723 27.299 0.424 25155 8487 1 10 . 1 1 161 161 CYS H H 161 8.845 8.845 9.016 -0.171 25155 8488 1 10 . 1 1 162 162 GLU N N 162 118.030 118.030 119.415 -1.385 25155 8489 1 10 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.874 0.046 25155 8490 1 10 . 1 1 162 162 GLU C C 162 178.700 178.700 178.741 -0.041 25155 8491 1 10 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.534 0.266 25155 8492 1 10 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.251 0.249 25155 8493 1 10 . 1 1 163 163 GLN N N 163 120.650 120.650 119.757 0.893 25155 8494 1 10 . 1 1 163 163 GLN HA H 163 4.173 4.173 4.053 0.120 25155 8495 1 10 . 1 1 163 163 GLN C C 163 179.700 179.700 178.523 1.177 25155 8496 1 10 . 1 1 163 163 GLN CA C 163 59.688 59.688 59.001 0.687 25155 8497 1 10 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.775 0.125 25155 8498 1 10 . 1 1 163 163 GLN H H 163 8.148 8.148 7.788 0.360 25155 8499 1 10 . 1 1 164 164 ILE N N 164 114.836 114.836 116.643 -1.807 25155 8500 1 10 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.644 0.416 25155 8501 1 10 . 1 1 164 164 ILE C C 164 178.676 178.676 177.768 0.908 25155 8502 1 10 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.420 1.740 25155 8503 1 10 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.365 0.265 25155 8504 1 10 . 1 1 164 164 ILE H H 164 8.958 8.958 8.256 0.702 25155 8505 1 10 . 1 1 165 165 LEU N N 165 123.700 123.700 119.903 3.797 25155 8506 1 10 . 1 1 165 165 LEU HA H 165 4.100 4.100 4.063 0.037 25155 8507 1 10 . 1 1 165 165 LEU C C 165 180.548 180.548 178.240 2.308 25155 8508 1 10 . 1 1 165 165 LEU CA C 165 58.150 58.150 58.302 -0.152 25155 8509 1 10 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.341 -0.211 25155 8510 1 10 . 1 1 165 165 LEU H H 165 7.830 7.830 7.715 0.115 25155 8511 1 10 . 1 1 166 166 ASN N N 166 120.160 120.160 118.422 1.738 25155 8512 1 10 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.315 0.255 25155 8513 1 10 . 1 1 166 166 ASN C C 166 175.690 175.690 177.274 -1.584 25155 8514 1 10 . 1 1 166 166 ASN CA C 166 55.946 55.946 56.686 -0.740 25155 8515 1 10 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.488 -0.008 25155 8516 1 10 . 1 1 166 166 ASN H H 166 7.706 7.706 8.079 -0.373 25155 8517 1 10 . 1 1 167 167 GLU N N 167 121.286 121.286 119.868 1.418 25155 8518 1 10 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.478 -0.374 25155 8519 1 10 . 1 1 167 167 GLU C C 167 180.520 180.520 177.823 2.697 25155 8520 1 10 . 1 1 167 167 GLU CA C 167 59.920 59.920 58.240 1.680 25155 8521 1 10 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.841 1.084 25155 8522 1 10 . 1 1 168 168 MET N N 168 118.622 118.622 116.481 2.141 25155 8523 1 10 . 1 1 168 168 MET HA H 168 3.996 3.996 4.892 -0.896 25155 8524 1 10 . 1 1 168 168 MET C C 168 176.856 176.856 178.476 -1.620 25155 8525 1 10 . 1 1 168 168 MET CA C 168 59.500 59.500 58.471 1.029 25155 8526 1 10 . 1 1 168 168 MET CB C 168 33.700 33.700 33.334 0.366 25155 8527 1 10 . 1 1 168 168 MET H H 168 8.723 8.723 8.228 0.495 25155 8528 1 10 . 1 1 169 169 ALA N N 169 121.760 121.760 123.149 -1.389 25155 8529 1 10 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.258 -0.102 25155 8530 1 10 . 1 1 169 169 ALA C C 169 179.790 179.790 179.061 0.729 25155 8531 1 10 . 1 1 169 169 ALA CA C 169 54.800 54.800 55.003 -0.203 25155 8532 1 10 . 1 1 169 169 ALA CB C 169 18.220 18.220 18.262 -0.042 25155 8533 1 10 . 1 1 169 169 ALA H H 169 7.494 7.494 8.307 -0.813 25155 8534 1 10 . 1 1 170 170 GLU N N 170 116.970 116.970 117.962 -0.992 25155 8535 1 10 . 1 1 170 170 GLU HA H 170 4.091 4.091 3.935 0.156 25155 8536 1 10 . 1 1 170 170 GLU C C 170 177.745 177.745 177.965 -0.220 25155 8537 1 10 . 1 1 170 170 GLU CA C 170 58.000 58.000 58.712 -0.712 25155 8538 1 10 . 1 1 170 170 GLU CB C 170 29.730 29.730 29.065 0.665 25155 8539 1 10 . 1 1 171 171 HIS N N 171 118.150 118.150 115.737 2.413 25155 8540 1 10 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.407 0.063 25155 8541 1 10 . 1 1 171 171 HIS C C 171 175.848 175.848 175.734 0.114 25155 8542 1 10 . 1 1 171 171 HIS CA C 171 57.600 57.600 57.800 -0.200 25155 8543 1 10 . 1 1 171 171 HIS CB C 171 30.800 30.800 30.551 0.249 25155 8544 1 10 . 1 1 171 171 HIS H H 171 7.717 7.717 7.599 0.118 25155 8545 1 10 . 1 1 172 172 TYR N N 172 119.483 119.483 117.322 2.161 25155 8546 1 10 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.591 -0.000 25155 8547 1 10 . 1 1 172 172 TYR C C 172 174.590 174.590 176.225 -1.635 25155 8548 1 10 . 1 1 172 172 TYR CA C 172 57.813 57.813 57.973 -0.160 25155 8549 1 10 . 1 1 172 172 TYR CB C 172 38.900 38.900 39.466 -0.566 25155 8550 1 10 . 1 1 172 172 TYR H H 172 7.778 7.778 7.932 -0.154 25155 8551 1 11 . 1 1 2 2 ASN N N 2 122.966 122.966 119.541 3.425 25155 8552 1 11 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.194 -0.019 25155 8553 1 11 . 1 1 2 2 ASN C C 2 175.200 175.200 173.928 1.272 25155 8554 1 11 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.758 0.162 25155 8555 1 11 . 1 1 2 2 ASN CB C 2 40.000 40.000 41.247 -1.247 25155 8556 1 11 . 1 1 2 2 ASN H H 2 9.392 9.392 8.302 1.090 25155 8557 1 11 . 1 1 3 3 MET N N 3 120.660 120.660 120.901 -0.241 25155 8558 1 11 . 1 1 3 3 MET HA H 3 5.565 5.565 5.110 0.455 25155 8559 1 11 . 1 1 3 3 MET C C 3 174.200 174.200 175.498 -1.298 25155 8560 1 11 . 1 1 3 3 MET CA C 3 54.550 54.550 54.217 0.333 25155 8561 1 11 . 1 1 3 3 MET CB C 3 34.100 34.100 34.994 -0.894 25155 8562 1 11 . 1 1 3 3 MET H H 3 8.745 8.745 8.710 0.035 25155 8563 1 11 . 1 1 4 4 GLY N N 4 115.792 115.792 110.053 5.739 25155 8564 1 11 . 1 1 4 4 GLY C C 4 170.444 170.444 172.105 -1.661 25155 8565 1 11 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.534 -0.647 25155 8566 1 11 . 1 1 4 4 GLY H H 4 8.989 8.989 8.807 0.182 25155 8567 1 11 . 1 1 5 5 LEU N N 5 131.175 131.175 125.936 5.239 25155 8568 1 11 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.254 1.068 25155 8569 1 11 . 1 1 5 5 LEU C C 5 175.700 175.700 174.773 0.927 25155 8570 1 11 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.674 -0.354 25155 8571 1 11 . 1 1 5 5 LEU CB C 5 44.700 44.700 43.530 1.170 25155 8572 1 11 . 1 1 5 5 LEU H H 5 8.917 8.917 8.213 0.704 25155 8573 1 11 . 1 1 6 6 PHE N N 6 125.990 125.990 125.382 0.608 25155 8574 1 11 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.562 0.176 25155 8575 1 11 . 1 1 6 6 PHE C C 6 174.358 174.358 173.497 0.861 25155 8576 1 11 . 1 1 6 6 PHE CA C 6 55.480 55.480 54.987 0.493 25155 8577 1 11 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.723 -0.673 25155 8578 1 11 . 1 1 6 6 PHE H H 6 9.225 9.225 9.352 -0.127 25155 8579 1 11 . 1 1 7 7 TYR N N 7 118.040 118.040 117.528 0.512 25155 8580 1 11 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.644 0.285 25155 8581 1 11 . 1 1 7 7 TYR C C 7 171.690 171.690 174.155 -2.465 25155 8582 1 11 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.173 -0.713 25155 8583 1 11 . 1 1 7 7 TYR CB C 7 40.800 40.800 40.687 0.113 25155 8584 1 11 . 1 1 7 7 TYR H H 7 8.235 8.235 8.005 0.230 25155 8585 1 11 . 1 1 8 8 GLY N N 8 106.640 106.640 107.274 -0.634 25155 8586 1 11 . 1 1 8 8 GLY C C 8 171.682 171.682 172.774 -1.092 25155 8587 1 11 . 1 1 8 8 GLY CA C 8 44.050 44.050 43.551 0.499 25155 8588 1 11 . 1 1 8 8 GLY H H 8 6.996 6.996 8.880 -1.884 25155 8589 1 11 . 1 1 9 9 SER N N 9 118.164 118.164 121.288 -3.124 25155 8590 1 11 . 1 1 9 9 SER C C 9 174.560 174.560 173.556 1.004 25155 8591 1 11 . 1 1 9 9 SER CA C 9 57.140 57.140 57.799 -0.659 25155 8592 1 11 . 1 1 9 9 SER H H 9 9.680 9.680 9.181 0.499 25155 8593 1 11 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.898 -0.268 25155 8594 1 11 . 1 1 17 17 ALA C C 17 177.740 177.740 179.124 -1.384 25155 8595 1 11 . 1 1 17 17 ALA CA C 17 54.900 54.900 54.950 -0.050 25155 8596 1 11 . 1 1 17 17 ALA CB C 17 17.790 17.790 17.707 0.083 25155 8597 1 11 . 1 1 17 17 ALA H H 17 8.055 8.055 7.608 0.447 25155 8598 1 11 . 1 1 18 18 ALA N N 18 120.026 120.026 121.021 -0.995 25155 8599 1 11 . 1 1 18 18 ALA HA H 18 3.713 3.713 3.850 -0.137 25155 8600 1 11 . 1 1 18 18 ALA C C 18 179.040 179.040 179.612 -0.572 25155 8601 1 11 . 1 1 18 18 ALA CA C 18 54.860 54.860 54.925 -0.065 25155 8602 1 11 . 1 1 18 18 ALA CB C 18 18.200 18.200 17.768 0.432 25155 8603 1 11 . 1 1 18 18 ALA H H 18 7.015 7.015 7.263 -0.248 25155 8604 1 11 . 1 1 19 19 GLU N N 19 116.656 116.656 117.962 -1.306 25155 8605 1 11 . 1 1 19 19 GLU HA H 19 3.580 3.580 3.930 -0.350 25155 8606 1 11 . 1 1 19 19 GLU C C 19 178.487 178.487 179.559 -1.072 25155 8607 1 11 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.822 -0.152 25155 8608 1 11 . 1 1 19 19 GLU CB C 19 29.400 29.400 29.309 0.091 25155 8609 1 11 . 1 1 20 20 LYS N N 20 120.100 120.100 119.914 0.186 25155 8610 1 11 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.105 0.241 25155 8611 1 11 . 1 1 20 20 LYS C C 20 175.330 175.330 179.074 -3.744 25155 8612 1 11 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.108 -2.008 25155 8613 1 11 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.554 0.446 25155 8614 1 11 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.707 -0.242 25155 8615 1 11 . 1 1 21 21 ILE C C 21 177.680 177.680 177.936 -0.256 25155 8616 1 11 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.575 0.065 25155 8617 1 11 . 1 1 21 21 ILE CB C 21 38.030 38.030 37.998 0.032 25155 8618 1 11 . 1 1 21 21 ILE H H 21 8.220 8.220 8.498 -0.278 25155 8619 1 11 . 1 1 22 22 ARG N N 22 119.433 119.433 118.492 0.941 25155 8620 1 11 . 1 1 22 22 ARG HA H 22 3.550 3.550 4.039 -0.489 25155 8621 1 11 . 1 1 22 22 ARG C C 22 177.268 177.268 178.237 -0.969 25155 8622 1 11 . 1 1 22 22 ARG CA C 22 59.760 59.760 58.705 1.055 25155 8623 1 11 . 1 1 22 22 ARG CB C 22 28.900 28.900 29.002 -0.102 25155 8624 1 11 . 1 1 23 23 ASP N N 23 118.945 118.945 120.059 -1.114 25155 8625 1 11 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.418 -0.076 25155 8626 1 11 . 1 1 23 23 ASP C C 23 178.470 178.470 178.589 -0.119 25155 8627 1 11 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.205 0.245 25155 8628 1 11 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.881 -0.511 25155 8629 1 11 . 1 1 24 24 ILE N N 24 121.200 121.200 119.245 1.955 25155 8630 1 11 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.774 -0.040 25155 8631 1 11 . 1 1 24 24 ILE C C 24 178.297 178.297 177.960 0.337 25155 8632 1 11 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.708 -0.208 25155 8633 1 11 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.477 0.263 25155 8634 1 11 . 1 1 24 24 ILE H H 24 8.160 8.160 7.878 0.282 25155 8635 1 11 . 1 1 25 25 ILE N N 25 121.166 121.166 117.450 3.716 25155 8636 1 11 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.859 -0.216 25155 8637 1 11 . 1 1 25 25 ILE C C 25 176.825 176.825 176.700 0.125 25155 8638 1 11 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.202 2.688 25155 8639 1 11 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.829 -1.079 25155 8640 1 11 . 1 1 25 25 ILE H H 25 8.480 8.480 8.071 0.409 25155 8641 1 11 . 1 1 26 26 GLY N N 26 109.050 109.050 105.018 4.032 25155 8642 1 11 . 1 1 26 26 GLY C C 26 173.800 173.800 172.618 1.182 25155 8643 1 11 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.496 -0.096 25155 8644 1 11 . 1 1 26 26 GLY H H 26 7.945 7.945 7.773 0.172 25155 8645 1 11 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.433 -0.070 25155 8646 1 11 . 1 1 27 27 PRO C C 27 177.157 177.157 176.716 0.441 25155 8647 1 11 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.899 0.631 25155 8648 1 11 . 1 1 27 27 PRO CB C 27 32.000 32.000 32.125 -0.125 25155 8649 1 11 . 1 1 28 28 GLU N N 28 116.510 116.510 116.722 -0.212 25155 8650 1 11 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.237 0.023 25155 8651 1 11 . 1 1 28 28 GLU C C 28 177.000 177.000 176.539 0.461 25155 8652 1 11 . 1 1 28 28 GLU CA C 28 57.680 57.680 57.816 -0.136 25155 8653 1 11 . 1 1 28 28 GLU CB C 28 28.620 28.620 28.979 -0.359 25155 8654 1 11 . 1 1 29 29 LEU N N 29 120.334 120.334 113.300 7.034 25155 8655 1 11 . 1 1 29 29 LEU HA H 29 4.650 4.650 5.017 -0.367 25155 8656 1 11 . 1 1 29 29 LEU C C 29 175.676 175.676 174.971 0.705 25155 8657 1 11 . 1 1 29 29 LEU CA C 29 55.924 55.924 54.813 1.111 25155 8658 1 11 . 1 1 29 29 LEU CB C 29 44.880 44.880 44.369 0.511 25155 8659 1 11 . 1 1 29 29 LEU H H 29 7.924 7.924 7.510 0.414 25155 8660 1 11 . 1 1 30 30 VAL N N 30 118.900 118.900 120.247 -1.347 25155 8661 1 11 . 1 1 30 30 VAL HA H 30 4.639 4.639 5.059 -0.420 25155 8662 1 11 . 1 1 30 30 VAL C C 30 174.368 174.368 175.815 -1.447 25155 8663 1 11 . 1 1 30 30 VAL CA C 30 61.110 61.110 60.034 1.076 25155 8664 1 11 . 1 1 30 30 VAL CB C 30 34.500 34.500 35.078 -0.578 25155 8665 1 11 . 1 1 30 30 VAL H H 30 7.486 7.486 7.404 0.082 25155 8666 1 11 . 1 1 31 31 THR N N 31 124.000 124.000 120.451 3.549 25155 8667 1 11 . 1 1 31 31 THR HA H 31 4.331 4.331 4.641 -0.310 25155 8668 1 11 . 1 1 31 31 THR C C 31 172.670 172.670 173.502 -0.832 25155 8669 1 11 . 1 1 31 31 THR CA C 31 61.784 61.784 60.906 0.878 25155 8670 1 11 . 1 1 31 31 THR CB C 31 70.483 70.483 71.541 -1.058 25155 8671 1 11 . 1 1 31 31 THR H H 31 7.947 7.947 8.911 -0.964 25155 8672 1 11 . 1 1 32 32 LEU N N 32 127.408 127.408 126.895 0.513 25155 8673 1 11 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.479 0.158 25155 8674 1 11 . 1 1 32 32 LEU C C 32 176.425 176.425 176.995 -0.570 25155 8675 1 11 . 1 1 32 32 LEU CA C 32 54.760 54.760 55.639 -0.879 25155 8676 1 11 . 1 1 32 32 LEU CB C 32 43.809 43.809 42.931 0.878 25155 8677 1 11 . 1 1 32 32 LEU H H 32 8.614 8.614 8.752 -0.138 25155 8678 1 11 . 1 1 33 33 HIS N N 33 120.230 120.230 123.617 -3.387 25155 8679 1 11 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.813 -0.393 25155 8680 1 11 . 1 1 33 33 HIS C C 33 171.914 171.914 173.561 -1.647 25155 8681 1 11 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.324 0.976 25155 8682 1 11 . 1 1 33 33 HIS CB C 33 32.050 32.050 31.164 0.886 25155 8683 1 11 . 1 1 33 33 HIS H H 33 9.130 9.130 9.025 0.105 25155 8684 1 11 . 1 1 34 34 ASN N N 34 123.987 123.987 120.365 3.622 25155 8685 1 11 . 1 1 34 34 ASN HA H 34 3.600 3.600 3.721 -0.121 25155 8686 1 11 . 1 1 34 34 ASN C C 34 177.930 177.930 175.569 2.361 25155 8687 1 11 . 1 1 34 34 ASN CA C 34 51.730 51.730 52.974 -1.244 25155 8688 1 11 . 1 1 34 34 ASN CB C 34 38.747 38.747 38.164 0.583 25155 8689 1 11 . 1 1 34 34 ASN H H 34 8.759 8.759 8.495 0.264 25155 8690 1 11 . 1 1 35 35 LEU N N 35 128.751 128.751 125.344 3.407 25155 8691 1 11 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.102 0.188 25155 8692 1 11 . 1 1 35 35 LEU C C 35 177.363 177.363 178.069 -0.706 25155 8693 1 11 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.458 0.092 25155 8694 1 11 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.797 0.965 25155 8695 1 11 . 1 1 35 35 LEU H H 35 8.758 8.758 8.184 0.574 25155 8696 1 11 . 1 1 36 36 LYS N N 36 120.870 120.870 118.413 2.457 25155 8697 1 11 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.111 -0.178 25155 8698 1 11 . 1 1 36 36 LYS C C 36 176.540 176.540 176.893 -0.353 25155 8699 1 11 . 1 1 36 36 LYS CA C 36 59.260 59.260 58.049 1.211 25155 8700 1 11 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.385 0.415 25155 8701 1 11 . 1 1 37 37 ASP N N 37 115.288 115.288 117.026 -1.738 25155 8702 1 11 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.680 0.067 25155 8703 1 11 . 1 1 37 37 ASP C C 37 175.500 175.500 176.268 -0.768 25155 8704 1 11 . 1 1 37 37 ASP CA C 37 54.805 54.805 55.089 -0.284 25155 8705 1 11 . 1 1 37 37 ASP CB C 37 44.650 44.650 42.792 1.857 25155 8706 1 11 . 1 1 38 38 ASP N N 38 121.550 121.550 118.537 3.013 25155 8707 1 11 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.948 -0.083 25155 8708 1 11 . 1 1 38 38 ASP C C 38 174.895 174.895 174.824 0.071 25155 8709 1 11 . 1 1 38 38 ASP CA C 38 52.840 52.840 53.016 -0.176 25155 8710 1 11 . 1 1 38 38 ASP CB C 38 42.240 42.240 44.270 -2.030 25155 8711 1 11 . 1 1 39 39 SER N N 39 115.170 115.170 116.710 -1.540 25155 8712 1 11 . 1 1 39 39 SER HA H 39 4.600 4.600 4.768 -0.168 25155 8713 1 11 . 1 1 39 39 SER C C 39 174.930 174.930 174.216 0.714 25155 8714 1 11 . 1 1 39 39 SER CA C 39 54.786 54.786 56.952 -2.166 25155 8715 1 11 . 1 1 39 39 SER CB C 39 64.840 64.840 63.369 1.471 25155 8716 1 11 . 1 1 39 39 SER H H 39 8.330 8.330 8.654 -0.324 25155 8717 1 11 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.471 -0.471 25155 8718 1 11 . 1 1 40 40 PRO C C 40 176.620 176.620 177.938 -1.318 25155 8719 1 11 . 1 1 40 40 PRO CA C 40 63.870 63.870 64.929 -1.059 25155 8720 1 11 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.786 -0.426 25155 8721 1 11 . 1 1 41 41 LYS N N 41 120.913 120.913 117.846 3.067 25155 8722 1 11 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.193 -0.297 25155 8723 1 11 . 1 1 41 41 LYS C C 41 179.580 179.580 178.500 1.080 25155 8724 1 11 . 1 1 41 41 LYS CA C 41 58.000 58.000 57.798 0.202 25155 8725 1 11 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.178 0.922 25155 8726 1 11 . 1 1 42 42 LEU N N 42 118.206 118.206 120.642 -2.436 25155 8727 1 11 . 1 1 42 42 LEU HA H 42 4.025 4.025 3.960 0.065 25155 8728 1 11 . 1 1 42 42 LEU C C 42 178.630 178.630 178.495 0.135 25155 8729 1 11 . 1 1 42 42 LEU CA C 42 57.030 57.030 57.033 -0.004 25155 8730 1 11 . 1 1 42 42 LEU CB C 42 41.820 41.820 40.721 1.099 25155 8731 1 11 . 1 1 42 42 LEU H H 42 7.598 7.598 7.559 0.039 25155 8732 1 11 . 1 1 43 43 MET N N 43 118.913 118.913 116.209 2.704 25155 8733 1 11 . 1 1 43 43 MET HA H 43 3.760 3.760 4.130 -0.370 25155 8734 1 11 . 1 1 43 43 MET C C 43 177.710 177.710 177.083 0.627 25155 8735 1 11 . 1 1 43 43 MET CA C 43 59.864 59.864 58.218 1.646 25155 8736 1 11 . 1 1 43 43 MET CB C 43 32.680 32.680 32.116 0.564 25155 8737 1 11 . 1 1 43 43 MET H H 43 8.180 8.180 8.024 0.156 25155 8738 1 11 . 1 1 44 44 GLU N N 44 110.906 110.906 116.838 -5.932 25155 8739 1 11 . 1 1 44 44 GLU HA H 44 3.732 3.732 4.033 -0.301 25155 8740 1 11 . 1 1 44 44 GLU C C 44 178.120 178.120 179.461 -1.341 25155 8741 1 11 . 1 1 44 44 GLU CA C 44 59.450 59.450 58.592 0.858 25155 8742 1 11 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.575 0.225 25155 8743 1 11 . 1 1 45 45 GLN N N 45 115.770 115.770 118.143 -2.373 25155 8744 1 11 . 1 1 45 45 GLN HA H 45 4.190 4.190 3.925 0.265 25155 8745 1 11 . 1 1 45 45 GLN C C 45 175.480 175.480 176.246 -0.766 25155 8746 1 11 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.419 -1.319 25155 8747 1 11 . 1 1 45 45 GLN CB C 45 28.490 28.490 28.646 -0.156 25155 8748 1 11 . 1 1 45 45 GLN H H 45 7.517 7.517 7.347 0.170 25155 8749 1 11 . 1 1 46 46 TYR N N 46 117.840 117.840 117.736 0.104 25155 8750 1 11 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.478 0.182 25155 8751 1 11 . 1 1 46 46 TYR C C 46 175.480 175.480 176.692 -1.212 25155 8752 1 11 . 1 1 46 46 TYR CA C 46 58.827 58.827 57.857 0.970 25155 8753 1 11 . 1 1 46 46 TYR CB C 46 41.720 41.720 38.595 3.125 25155 8754 1 11 . 1 1 46 46 TYR H H 46 6.955 6.955 7.235 -0.280 25155 8755 1 11 . 1 1 47 47 ASP N N 47 121.540 121.540 123.312 -1.772 25155 8756 1 11 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.677 0.019 25155 8757 1 11 . 1 1 47 47 ASP C C 47 175.677 175.677 175.480 0.197 25155 8758 1 11 . 1 1 47 47 ASP CA C 47 56.812 56.812 56.368 0.444 25155 8759 1 11 . 1 1 47 47 ASP CB C 47 42.978 42.978 41.717 1.261 25155 8760 1 11 . 1 1 48 48 VAL N N 48 118.666 118.666 116.945 1.721 25155 8761 1 11 . 1 1 48 48 VAL HA H 48 5.057 5.057 5.040 0.017 25155 8762 1 11 . 1 1 48 48 VAL C C 48 174.180 174.180 174.292 -0.112 25155 8763 1 11 . 1 1 48 48 VAL CA C 48 60.000 60.000 60.532 -0.532 25155 8764 1 11 . 1 1 48 48 VAL CB C 48 36.200 36.200 34.045 2.155 25155 8765 1 11 . 1 1 48 48 VAL H H 48 7.631 7.631 7.460 0.171 25155 8766 1 11 . 1 1 49 49 LEU N N 49 128.300 128.300 127.498 0.802 25155 8767 1 11 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.414 0.186 25155 8768 1 11 . 1 1 49 49 LEU C C 49 174.810 174.810 174.757 0.053 25155 8769 1 11 . 1 1 49 49 LEU CA C 49 52.230 52.230 53.472 -1.242 25155 8770 1 11 . 1 1 49 49 LEU CB C 49 45.400 45.400 47.140 -1.740 25155 8771 1 11 . 1 1 49 49 LEU H H 49 9.469 9.469 9.118 0.351 25155 8772 1 11 . 1 1 50 50 ILE N N 50 124.400 124.400 123.169 1.231 25155 8773 1 11 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.774 0.876 25155 8774 1 11 . 1 1 50 50 ILE C C 50 175.286 175.286 173.936 1.350 25155 8775 1 11 . 1 1 50 50 ILE CA C 50 59.900 59.900 60.516 -0.616 25155 8776 1 11 . 1 1 50 50 ILE CB C 50 40.200 40.200 42.035 -1.835 25155 8777 1 11 . 1 1 50 50 ILE H H 50 9.213 9.213 8.929 0.284 25155 8778 1 11 . 1 1 51 51 LEU N N 51 127.410 127.410 127.298 0.112 25155 8779 1 11 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.609 1.461 25155 8780 1 11 . 1 1 51 51 LEU C C 51 174.540 174.540 175.327 -0.787 25155 8781 1 11 . 1 1 51 51 LEU CA C 51 52.950 52.950 53.120 -0.170 25155 8782 1 11 . 1 1 51 51 LEU CB C 51 43.190 43.190 44.337 -1.147 25155 8783 1 11 . 1 1 51 51 LEU H H 51 9.256 9.256 8.801 0.455 25155 8784 1 11 . 1 1 52 52 GLY N N 52 108.290 108.290 110.766 -2.476 25155 8785 1 11 . 1 1 52 52 GLY C C 52 174.330 174.330 171.475 2.855 25155 8786 1 11 . 1 1 52 52 GLY CA C 52 44.040 44.040 43.243 0.797 25155 8787 1 11 . 1 1 52 52 GLY H H 52 8.949 8.949 8.362 0.587 25155 8788 1 11 . 1 1 53 53 ILE N N 53 124.912 124.912 122.199 2.713 25155 8789 1 11 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.369 -0.194 25155 8790 1 11 . 1 1 53 53 ILE C C 53 174.470 174.470 172.535 1.935 25155 8791 1 11 . 1 1 53 53 ILE CA C 53 55.850 55.850 57.912 -2.062 25155 8792 1 11 . 1 1 53 53 ILE CB C 53 42.800 42.800 42.093 0.707 25155 8793 1 11 . 1 1 53 53 ILE H H 53 8.612 8.612 7.387 1.225 25155 8794 1 11 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.557 0.255 25155 8795 1 11 . 1 1 54 54 PRO C C 54 174.565 174.565 175.379 -0.814 25155 8796 1 11 . 1 1 54 54 PRO CA C 54 61.850 61.850 61.789 0.061 25155 8797 1 11 . 1 1 54 54 PRO CB C 54 32.400 32.400 31.790 0.610 25155 8798 1 11 . 1 1 55 55 THR N N 55 116.040 116.040 114.695 1.345 25155 8799 1 11 . 1 1 55 55 THR HA H 55 4.522 4.522 4.285 0.237 25155 8800 1 11 . 1 1 55 55 THR C C 55 173.990 173.990 172.490 1.500 25155 8801 1 11 . 1 1 55 55 THR CA C 55 62.845 62.845 61.187 1.658 25155 8802 1 11 . 1 1 55 55 THR CB C 55 70.795 70.795 71.680 -0.885 25155 8803 1 11 . 1 1 55 55 THR H H 55 7.663 7.663 7.824 -0.161 25155 8804 1 11 . 1 1 56 56 TRP N N 56 130.540 130.540 122.676 7.864 25155 8805 1 11 . 1 1 56 56 TRP CA C 56 54.800 54.800 56.041 -1.242 25155 8806 1 11 . 1 1 56 56 TRP H H 56 9.075 9.075 8.025 1.050 25155 8807 1 11 . 1 1 58 58 PHE HA H 58 4.540 4.540 4.490 0.050 25155 8808 1 11 . 1 1 58 58 PHE C C 58 177.070 177.070 174.929 2.141 25155 8809 1 11 . 1 1 58 58 PHE CA C 58 55.460 55.460 56.513 -1.053 25155 8810 1 11 . 1 1 58 58 PHE CB C 58 41.200 41.200 40.815 0.385 25155 8811 1 11 . 1 1 59 59 GLY N N 59 109.796 109.796 108.836 0.960 25155 8812 1 11 . 1 1 59 59 GLY CA C 59 45.763 45.763 45.500 0.263 25155 8813 1 11 . 1 1 59 59 GLY H H 59 8.392 8.392 8.583 -0.191 25155 8814 1 11 . 1 1 60 60 GLU C C 60 175.660 175.660 176.383 -0.723 25155 8815 1 11 . 1 1 61 61 ILE N N 61 122.380 122.380 119.869 2.511 25155 8816 1 11 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.275 1.165 25155 8817 1 11 . 1 1 61 61 ILE CA C 61 62.100 62.100 62.176 -0.076 25155 8818 1 11 . 1 1 61 61 ILE CB C 61 38.750 38.750 37.430 1.320 25155 8819 1 11 . 1 1 61 61 ILE H H 61 8.436 8.436 8.328 0.108 25155 8820 1 11 . 1 1 62 62 GLN CB C 62 30.570 30.570 30.521 0.049 25155 8821 1 11 . 1 1 63 63 GLU HA H 63 4.030 4.030 3.997 0.033 25155 8822 1 11 . 1 1 63 63 GLU C C 63 177.134 177.134 177.824 -0.690 25155 8823 1 11 . 1 1 63 63 GLU CA C 63 60.520 60.520 60.021 0.499 25155 8824 1 11 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.934 -0.284 25155 8825 1 11 . 1 1 64 64 ASP N N 64 119.630 119.630 117.491 2.139 25155 8826 1 11 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.463 0.129 25155 8827 1 11 . 1 1 64 64 ASP C C 64 178.680 178.680 176.550 2.130 25155 8828 1 11 . 1 1 64 64 ASP CA C 64 57.823 57.823 56.084 1.738 25155 8829 1 11 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.287 0.813 25155 8830 1 11 . 1 1 65 65 TRP N N 65 120.535 120.535 121.597 -1.062 25155 8831 1 11 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.664 -0.339 25155 8832 1 11 . 1 1 65 65 TRP C C 65 178.684 178.684 177.501 1.183 25155 8833 1 11 . 1 1 65 65 TRP CA C 65 60.500 60.500 59.305 1.195 25155 8834 1 11 . 1 1 65 65 TRP CB C 65 30.100 30.100 31.982 -1.882 25155 8835 1 11 . 1 1 65 65 TRP H H 65 7.416 7.416 7.608 -0.192 25155 8836 1 11 . 1 1 66 66 GLU N N 66 120.760 120.760 120.930 -0.170 25155 8837 1 11 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.216 -0.396 25155 8838 1 11 . 1 1 66 66 GLU C C 66 178.860 178.860 178.907 -0.047 25155 8839 1 11 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.828 0.272 25155 8840 1 11 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.635 -0.625 25155 8841 1 11 . 1 1 67 67 ALA N N 67 118.972 118.972 121.808 -2.836 25155 8842 1 11 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.216 0.031 25155 8843 1 11 . 1 1 67 67 ALA C C 67 179.610 179.610 178.997 0.613 25155 8844 1 11 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.939 -0.339 25155 8845 1 11 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.880 -0.092 25155 8846 1 11 . 1 1 67 67 ALA H H 67 7.690 7.690 8.419 -0.729 25155 8847 1 11 . 1 1 68 68 VAL N N 68 107.530 107.530 111.044 -3.514 25155 8848 1 11 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.329 0.381 25155 8849 1 11 . 1 1 68 68 VAL C C 68 176.800 176.800 177.263 -0.463 25155 8850 1 11 . 1 1 68 68 VAL CA C 68 60.060 60.060 62.563 -2.503 25155 8851 1 11 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.290 0.310 25155 8852 1 11 . 1 1 68 68 VAL H H 68 7.240 7.240 7.477 -0.237 25155 8853 1 11 . 1 1 69 69 TRP N N 69 126.960 126.960 124.986 1.974 25155 8854 1 11 . 1 1 69 69 TRP HA H 69 4.182 4.182 3.962 0.220 25155 8855 1 11 . 1 1 69 69 TRP C C 69 178.640 178.640 176.763 1.877 25155 8856 1 11 . 1 1 69 69 TRP CA C 69 61.300 61.300 62.658 -1.358 25155 8857 1 11 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.455 2.115 25155 8858 1 11 . 1 1 69 69 TRP H H 69 7.810 7.810 8.091 -0.281 25155 8859 1 11 . 1 1 70 70 ASP N N 70 114.644 114.644 116.213 -1.569 25155 8860 1 11 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.218 0.301 25155 8861 1 11 . 1 1 70 70 ASP C C 70 178.685 178.685 178.184 0.501 25155 8862 1 11 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.368 -0.368 25155 8863 1 11 . 1 1 70 70 ASP CB C 70 39.810 39.810 41.013 -1.202 25155 8864 1 11 . 1 1 71 71 GLN N N 71 120.100 120.100 116.950 3.150 25155 8865 1 11 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.247 -0.057 25155 8866 1 11 . 1 1 71 71 GLN C C 71 178.870 178.870 178.159 0.711 25155 8867 1 11 . 1 1 71 71 GLN CA C 71 57.617 57.617 57.054 0.563 25155 8868 1 11 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.557 -0.737 25155 8869 1 11 . 1 1 71 71 GLN H H 71 7.980 7.980 7.956 0.024 25155 8870 1 11 . 1 1 72 72 LEU N N 72 117.535 117.535 119.983 -2.448 25155 8871 1 11 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.940 -0.143 25155 8872 1 11 . 1 1 72 72 LEU C C 72 178.308 178.308 177.922 0.386 25155 8873 1 11 . 1 1 72 72 LEU CA C 72 57.340 57.340 57.008 0.332 25155 8874 1 11 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.504 0.196 25155 8875 1 11 . 1 1 72 72 LEU H H 72 7.435 7.435 7.660 -0.225 25155 8876 1 11 . 1 1 73 73 ASP N N 73 115.534 115.534 117.450 -1.916 25155 8877 1 11 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.387 -0.237 25155 8878 1 11 . 1 1 73 73 ASP C C 73 177.553 177.553 176.727 0.826 25155 8879 1 11 . 1 1 73 73 ASP CA C 73 57.350 57.350 56.090 1.260 25155 8880 1 11 . 1 1 73 73 ASP CB C 73 40.040 40.040 41.649 -1.609 25155 8881 1 11 . 1 1 74 74 ASP N N 74 117.300 117.300 120.206 -2.906 25155 8882 1 11 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.472 0.234 25155 8883 1 11 . 1 1 74 74 ASP C C 74 176.424 176.424 177.270 -0.846 25155 8884 1 11 . 1 1 74 74 ASP CA C 74 54.170 54.170 55.584 -1.415 25155 8885 1 11 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.317 0.503 25155 8886 1 11 . 1 1 75 75 LEU N N 75 118.500 118.500 120.198 -1.698 25155 8887 1 11 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.166 0.129 25155 8888 1 11 . 1 1 75 75 LEU C C 75 176.800 176.800 176.642 0.158 25155 8889 1 11 . 1 1 75 75 LEU CA C 75 54.400 54.400 55.146 -0.746 25155 8890 1 11 . 1 1 75 75 LEU CB C 75 43.280 43.280 41.861 1.419 25155 8891 1 11 . 1 1 75 75 LEU H H 75 6.966 6.966 7.321 -0.355 25155 8892 1 11 . 1 1 76 76 ASN N N 76 123.040 123.040 120.498 2.542 25155 8893 1 11 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.632 0.230 25155 8894 1 11 . 1 1 76 76 ASN C C 76 174.927 174.927 174.724 0.203 25155 8895 1 11 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.566 -1.685 25155 8896 1 11 . 1 1 76 76 ASN CB C 76 37.510 37.510 38.557 -1.047 25155 8897 1 11 . 1 1 76 76 ASN H H 76 9.882 9.882 9.004 0.878 25155 8898 1 11 . 1 1 77 77 LEU N N 77 123.614 123.614 123.550 0.064 25155 8899 1 11 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.549 -0.179 25155 8900 1 11 . 1 1 77 77 LEU C C 77 175.110 175.110 176.630 -1.520 25155 8901 1 11 . 1 1 77 77 LEU CA C 77 52.200 52.200 54.130 -1.931 25155 8902 1 11 . 1 1 77 77 LEU CB C 77 42.786 42.786 42.842 -0.056 25155 8903 1 11 . 1 1 77 77 LEU H H 77 8.700 8.700 8.047 0.653 25155 8904 1 11 . 1 1 78 78 GLU N N 78 120.822 120.822 121.523 -0.701 25155 8905 1 11 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.230 -0.330 25155 8906 1 11 . 1 1 78 78 GLU C C 78 178.670 178.670 178.037 0.633 25155 8907 1 11 . 1 1 78 78 GLU CA C 78 58.700 58.700 58.007 0.693 25155 8908 1 11 . 1 1 78 78 GLU CB C 78 29.467 29.467 29.451 0.016 25155 8909 1 11 . 1 1 79 79 GLY N N 79 113.160 113.160 113.834 -0.674 25155 8910 1 11 . 1 1 79 79 GLY C C 79 174.523 174.523 173.685 0.838 25155 8911 1 11 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.446 -0.026 25155 8912 1 11 . 1 1 79 79 GLY H H 79 8.450 8.450 8.882 -0.432 25155 8913 1 11 . 1 1 80 80 LYS N N 80 120.283 120.283 120.227 0.056 25155 8914 1 11 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.408 -0.050 25155 8915 1 11 . 1 1 80 80 LYS C C 80 175.304 175.304 176.168 -0.864 25155 8916 1 11 . 1 1 80 80 LYS CA C 80 56.890 56.890 56.170 0.720 25155 8917 1 11 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.736 -0.616 25155 8918 1 11 . 1 1 81 81 ILE N N 81 122.288 122.288 122.472 -0.184 25155 8919 1 11 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.426 0.380 25155 8920 1 11 . 1 1 81 81 ILE C C 81 174.750 174.750 175.296 -0.546 25155 8921 1 11 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.444 -1.625 25155 8922 1 11 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.175 0.675 25155 8923 1 11 . 1 1 81 81 ILE H H 81 7.405 7.405 8.550 -1.145 25155 8924 1 11 . 1 1 82 82 VAL N N 82 127.793 127.793 126.236 1.557 25155 8925 1 11 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.109 0.171 25155 8926 1 11 . 1 1 82 82 VAL C C 82 172.680 172.680 174.445 -1.765 25155 8927 1 11 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.285 -0.185 25155 8928 1 11 . 1 1 82 82 VAL CB C 82 35.280 35.280 35.078 0.202 25155 8929 1 11 . 1 1 82 82 VAL H H 82 8.800 8.800 9.038 -0.238 25155 8930 1 11 . 1 1 83 83 ALA N N 83 130.911 130.911 130.176 0.735 25155 8931 1 11 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.502 -0.113 25155 8932 1 11 . 1 1 83 83 ALA C C 83 175.870 175.870 176.110 -0.240 25155 8933 1 11 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.591 0.409 25155 8934 1 11 . 1 1 83 83 ALA CB C 83 23.722 23.722 22.267 1.454 25155 8935 1 11 . 1 1 83 83 ALA H H 83 9.252 9.252 9.088 0.164 25155 8936 1 11 . 1 1 84 84 LEU N N 84 124.269 124.269 121.999 2.270 25155 8937 1 11 . 1 1 84 84 LEU HA H 84 5.508 5.508 5.496 0.012 25155 8938 1 11 . 1 1 84 84 LEU C C 84 175.490 175.490 175.512 -0.022 25155 8939 1 11 . 1 1 84 84 LEU CA C 84 53.670 53.670 53.971 -0.301 25155 8940 1 11 . 1 1 84 84 LEU CB C 84 45.000 45.000 46.102 -1.102 25155 8941 1 11 . 1 1 84 84 LEU H H 84 10.378 10.378 8.995 1.383 25155 8942 1 11 . 1 1 85 85 TYR N N 85 115.826 115.826 119.305 -3.479 25155 8943 1 11 . 1 1 85 85 TYR HA H 85 4.950 4.950 5.287 -0.337 25155 8944 1 11 . 1 1 85 85 TYR C C 85 172.661 172.661 173.606 -0.945 25155 8945 1 11 . 1 1 85 85 TYR CA C 85 55.853 55.853 55.492 0.361 25155 8946 1 11 . 1 1 85 85 TYR CB C 85 43.200 43.200 41.274 1.926 25155 8947 1 11 . 1 1 85 85 TYR H H 85 9.200 9.200 8.747 0.453 25155 8948 1 11 . 1 1 86 86 GLY N N 86 106.802 106.802 105.152 1.650 25155 8949 1 11 . 1 1 86 86 GLY C C 86 170.348 170.348 171.311 -0.963 25155 8950 1 11 . 1 1 86 86 GLY CA C 86 44.687 44.687 44.967 -0.280 25155 8951 1 11 . 1 1 86 86 GLY H H 86 8.752 8.752 8.366 0.386 25155 8952 1 11 . 1 1 87 87 LEU N N 87 120.860 120.860 116.728 4.132 25155 8953 1 11 . 1 1 87 87 LEU HA H 87 5.476 5.476 5.265 0.211 25155 8954 1 11 . 1 1 87 87 LEU C C 87 177.720 177.720 175.622 2.098 25155 8955 1 11 . 1 1 87 87 LEU CA C 87 52.630 52.630 52.170 0.459 25155 8956 1 11 . 1 1 87 87 LEU CB C 87 45.900 45.900 44.086 1.815 25155 8957 1 11 . 1 1 87 87 LEU H H 87 6.320 6.320 7.507 -1.187 25155 8958 1 11 . 1 1 88 88 GLY N N 88 109.910 109.910 106.730 3.180 25155 8959 1 11 . 1 1 88 88 GLY C C 88 171.386 171.386 171.473 -0.087 25155 8960 1 11 . 1 1 88 88 GLY CA C 88 45.710 45.710 44.797 0.913 25155 8961 1 11 . 1 1 88 88 GLY H H 88 8.320 8.320 7.993 0.327 25155 8962 1 11 . 1 1 89 89 ASP N N 89 121.580 121.580 118.252 3.328 25155 8963 1 11 . 1 1 89 89 ASP HA H 89 5.190 5.190 5.071 0.119 25155 8964 1 11 . 1 1 89 89 ASP C C 89 176.608 176.608 176.564 0.044 25155 8965 1 11 . 1 1 89 89 ASP CA C 89 52.200 52.200 52.908 -0.708 25155 8966 1 11 . 1 1 89 89 ASP CB C 89 41.900 41.900 44.007 -2.107 25155 8967 1 11 . 1 1 90 90 GLN N N 90 123.900 123.900 123.932 -0.032 25155 8968 1 11 . 1 1 90 90 GLN HA H 90 3.645 3.645 4.184 -0.539 25155 8969 1 11 . 1 1 90 90 GLN C C 90 173.523 173.523 176.129 -2.606 25155 8970 1 11 . 1 1 90 90 GLN CA C 90 58.706 58.706 57.731 0.975 25155 8971 1 11 . 1 1 90 90 GLN CB C 90 28.800 28.800 28.409 0.391 25155 8972 1 11 . 1 1 90 90 GLN H H 90 8.726 8.726 8.743 -0.017 25155 8973 1 11 . 1 1 91 91 LEU N N 91 117.080 117.080 120.237 -3.157 25155 8974 1 11 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.161 0.309 25155 8975 1 11 . 1 1 91 91 LEU C C 91 179.840 179.840 179.198 0.642 25155 8976 1 11 . 1 1 91 91 LEU CA C 91 55.800 55.800 55.850 -0.050 25155 8977 1 11 . 1 1 91 91 LEU CB C 91 41.640 41.640 42.025 -0.385 25155 8978 1 11 . 1 1 91 91 LEU H H 91 7.092 7.092 8.614 -1.522 25155 8979 1 11 . 1 1 92 92 GLY N N 92 110.460 110.460 106.487 3.973 25155 8980 1 11 . 1 1 92 92 GLY C C 92 174.824 174.824 174.934 -0.110 25155 8981 1 11 . 1 1 92 92 GLY CA C 92 46.390 46.390 47.260 -0.870 25155 8982 1 11 . 1 1 92 92 GLY H H 92 9.243 9.243 8.827 0.416 25155 8983 1 11 . 1 1 93 93 TYR N N 93 118.140 118.140 118.978 -0.838 25155 8984 1 11 . 1 1 93 93 TYR HA H 93 5.173 5.173 4.621 0.552 25155 8985 1 11 . 1 1 93 93 TYR C C 93 177.805 177.805 176.564 1.241 25155 8986 1 11 . 1 1 93 93 TYR CA C 93 57.430 57.430 58.754 -1.324 25155 8987 1 11 . 1 1 93 93 TYR CB C 93 39.300 39.300 40.514 -1.214 25155 8988 1 11 . 1 1 93 93 TYR H H 93 7.252 7.252 7.843 -0.591 25155 8989 1 11 . 1 1 94 94 GLY N N 94 112.455 112.455 108.034 4.421 25155 8990 1 11 . 1 1 94 94 GLY C C 94 177.740 177.740 175.558 2.182 25155 8991 1 11 . 1 1 94 94 GLY CA C 94 49.880 49.880 45.733 4.147 25155 8992 1 11 . 1 1 94 94 GLY H H 94 8.154 8.154 8.848 -0.694 25155 8993 1 11 . 1 1 95 95 GLU N N 95 123.040 123.040 121.182 1.858 25155 8994 1 11 . 1 1 95 95 GLU HA H 95 4.000 4.000 4.178 -0.178 25155 8995 1 11 . 1 1 95 95 GLU C C 95 175.145 175.145 177.535 -2.390 25155 8996 1 11 . 1 1 95 95 GLU CA C 95 57.950 57.950 58.172 -0.222 25155 8997 1 11 . 1 1 95 95 GLU CB C 95 27.400 27.400 29.912 -2.512 25155 8998 1 11 . 1 1 96 96 TRP N N 96 118.000 118.000 118.566 -0.566 25155 8999 1 11 . 1 1 96 96 TRP HA H 96 5.213 5.213 4.943 0.270 25155 9000 1 11 . 1 1 96 96 TRP C C 96 176.616 176.616 175.494 1.122 25155 9001 1 11 . 1 1 96 96 TRP CA C 96 57.120 57.120 55.949 1.171 25155 9002 1 11 . 1 1 96 96 TRP CB C 96 29.970 29.970 28.785 1.185 25155 9003 1 11 . 1 1 96 96 TRP H H 96 7.785 7.785 8.256 -0.471 25155 9004 1 11 . 1 1 97 97 PHE N N 97 123.268 123.268 122.738 0.530 25155 9005 1 11 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.259 0.401 25155 9006 1 11 . 1 1 97 97 PHE CA C 97 58.742 58.742 59.940 -1.198 25155 9007 1 11 . 1 1 97 97 PHE CB C 97 40.835 40.835 39.631 1.204 25155 9008 1 11 . 1 1 97 97 PHE H H 97 7.054 7.054 7.789 -0.735 25155 9009 1 11 . 1 1 98 98 LEU HA H 98 3.440 3.440 3.454 -0.014 25155 9010 1 11 . 1 1 98 98 LEU C C 98 176.613 176.613 176.977 -0.364 25155 9011 1 11 . 1 1 98 98 LEU CA C 98 56.000 56.000 55.194 0.806 25155 9012 1 11 . 1 1 98 98 LEU CB C 98 38.600 38.600 39.109 -0.509 25155 9013 1 11 . 1 1 98 98 LEU H H 98 8.584 8.584 8.101 0.483 25155 9014 1 11 . 1 1 99 99 ASP N N 99 123.268 123.268 120.151 3.117 25155 9015 1 11 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.257 -0.292 25155 9016 1 11 . 1 1 99 99 ASP C C 99 178.876 178.876 177.002 1.874 25155 9017 1 11 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.552 1.708 25155 9018 1 11 . 1 1 99 99 ASP CB C 99 40.350 40.350 41.096 -0.746 25155 9019 1 11 . 1 1 100 100 ALA N N 100 119.124 119.124 121.215 -2.091 25155 9020 1 11 . 1 1 100 100 ALA HA H 100 3.822 3.822 4.132 -0.310 25155 9021 1 11 . 1 1 100 100 ALA C C 100 178.490 178.490 179.132 -0.642 25155 9022 1 11 . 1 1 100 100 ALA CA C 100 55.100 55.100 54.633 0.467 25155 9023 1 11 . 1 1 100 100 ALA CB C 100 19.700 19.700 18.165 1.535 25155 9024 1 11 . 1 1 100 100 ALA H H 100 8.400 8.400 7.792 0.608 25155 9025 1 11 . 1 1 101 101 LEU N N 101 118.687 118.687 120.453 -1.766 25155 9026 1 11 . 1 1 101 101 LEU HA H 101 3.674 3.674 3.953 -0.279 25155 9027 1 11 . 1 1 101 101 LEU C C 101 179.050 179.050 178.742 0.308 25155 9028 1 11 . 1 1 101 101 LEU CA C 101 57.800 57.800 57.152 0.648 25155 9029 1 11 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.553 1.097 25155 9030 1 11 . 1 1 101 101 LEU H H 101 6.518 6.518 7.436 -0.918 25155 9031 1 11 . 1 1 102 102 GLY N N 102 104.410 104.410 106.441 -2.031 25155 9032 1 11 . 1 1 102 102 GLY C C 102 176.056 176.056 175.960 0.096 25155 9033 1 11 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.204 0.546 25155 9034 1 11 . 1 1 102 102 GLY H H 102 7.712 7.712 8.107 -0.395 25155 9035 1 11 . 1 1 103 103 MET N N 103 120.550 120.550 121.883 -1.333 25155 9036 1 11 . 1 1 103 103 MET HA H 103 4.256 4.256 4.370 -0.114 25155 9037 1 11 . 1 1 103 103 MET C C 103 179.650 179.650 178.544 1.106 25155 9038 1 11 . 1 1 103 103 MET CA C 103 59.450 59.450 59.622 -0.172 25155 9039 1 11 . 1 1 103 103 MET CB C 103 32.300 32.300 32.804 -0.504 25155 9040 1 11 . 1 1 103 103 MET H H 103 8.485 8.485 8.245 0.240 25155 9041 1 11 . 1 1 104 104 LEU N N 104 123.480 123.480 120.155 3.325 25155 9042 1 11 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.364 -0.303 25155 9043 1 11 . 1 1 104 104 LEU C C 104 177.750 177.750 179.047 -1.297 25155 9044 1 11 . 1 1 104 104 LEU CA C 104 58.100 58.100 57.799 0.301 25155 9045 1 11 . 1 1 104 104 LEU CB C 104 41.450 41.450 41.233 0.217 25155 9046 1 11 . 1 1 104 104 LEU H H 104 8.392 8.392 7.980 0.412 25155 9047 1 11 . 1 1 105 105 HIS N N 105 119.570 119.570 119.849 -0.279 25155 9048 1 11 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.239 -0.387 25155 9049 1 11 . 1 1 105 105 HIS C C 105 177.550 177.550 177.035 0.515 25155 9050 1 11 . 1 1 105 105 HIS CA C 105 61.000 61.000 60.741 0.259 25155 9051 1 11 . 1 1 105 105 HIS CB C 105 28.820 28.820 29.998 -1.178 25155 9052 1 11 . 1 1 105 105 HIS H H 105 8.247 8.247 8.389 -0.142 25155 9053 1 11 . 1 1 106 106 ASP N N 106 119.780 119.780 119.280 0.500 25155 9054 1 11 . 1 1 106 106 ASP HA H 106 4.333 4.333 4.393 -0.060 25155 9055 1 11 . 1 1 106 106 ASP C C 106 179.410 179.410 178.373 1.037 25155 9056 1 11 . 1 1 106 106 ASP CA C 106 57.800 57.800 57.227 0.573 25155 9057 1 11 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.208 -0.608 25155 9058 1 11 . 1 1 107 107 LYS N N 107 121.660 121.660 118.253 3.407 25155 9059 1 11 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.093 0.007 25155 9060 1 11 . 1 1 107 107 LYS C C 107 178.316 178.316 178.016 0.300 25155 9061 1 11 . 1 1 107 107 LYS CA C 107 58.750 58.750 58.760 -0.010 25155 9062 1 11 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.547 -0.697 25155 9063 1 11 . 1 1 108 108 LEU N N 108 116.050 116.050 117.176 -1.126 25155 9064 1 11 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.445 -0.435 25155 9065 1 11 . 1 1 108 108 LEU C C 108 179.050 179.050 178.712 0.338 25155 9066 1 11 . 1 1 108 108 LEU CA C 108 56.240 56.240 55.823 0.417 25155 9067 1 11 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.669 -0.869 25155 9068 1 11 . 1 1 108 108 LEU H H 108 8.072 8.072 7.681 0.391 25155 9069 1 11 . 1 1 109 109 SER N N 109 116.280 116.280 116.566 -0.286 25155 9070 1 11 . 1 1 109 109 SER HA H 109 4.300 4.300 4.365 -0.065 25155 9071 1 11 . 1 1 109 109 SER C C 109 175.848 175.848 176.251 -0.403 25155 9072 1 11 . 1 1 109 109 SER CA C 109 62.410 62.410 61.759 0.651 25155 9073 1 11 . 1 1 109 109 SER CB C 109 62.850 62.850 63.183 -0.333 25155 9074 1 11 . 1 1 109 109 SER H H 109 8.366 8.366 8.010 0.356 25155 9075 1 11 . 1 1 110 110 THR N N 110 110.416 110.416 111.492 -1.076 25155 9076 1 11 . 1 1 110 110 THR HA H 110 4.614 4.614 4.327 0.287 25155 9077 1 11 . 1 1 110 110 THR C C 110 175.675 175.675 175.113 0.562 25155 9078 1 11 . 1 1 110 110 THR CA C 110 62.030 62.030 63.893 -1.863 25155 9079 1 11 . 1 1 110 110 THR CB C 110 68.810 68.810 68.666 0.144 25155 9080 1 11 . 1 1 110 110 THR H H 110 7.185 7.185 8.094 -0.909 25155 9081 1 11 . 1 1 111 111 LYS N N 111 120.090 120.090 120.502 -0.412 25155 9082 1 11 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.418 0.095 25155 9083 1 11 . 1 1 111 111 LYS C C 111 176.814 176.814 176.602 0.212 25155 9084 1 11 . 1 1 111 111 LYS CA C 111 55.730 55.730 55.791 -0.061 25155 9085 1 11 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.449 -1.519 25155 9086 1 11 . 1 1 112 112 GLY N N 112 107.540 107.540 108.010 -0.470 25155 9087 1 11 . 1 1 112 112 GLY C C 112 176.223 176.223 174.322 1.901 25155 9088 1 11 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.470 1.456 25155 9089 1 11 . 1 1 112 112 GLY H H 112 8.315 8.315 7.621 0.694 25155 9090 1 11 . 1 1 113 113 VAL N N 113 113.536 113.536 116.095 -2.559 25155 9091 1 11 . 1 1 113 113 VAL HA H 113 4.494 4.494 4.203 0.291 25155 9092 1 11 . 1 1 113 113 VAL C C 113 174.560 174.560 174.945 -0.385 25155 9093 1 11 . 1 1 113 113 VAL CA C 113 59.550 59.550 61.235 -1.685 25155 9094 1 11 . 1 1 113 113 VAL CB C 113 32.800 32.800 32.224 0.576 25155 9095 1 11 . 1 1 113 113 VAL H H 113 6.835 6.835 7.012 -0.177 25155 9096 1 11 . 1 1 114 114 LYS N N 114 122.920 122.920 121.557 1.363 25155 9097 1 11 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.374 0.120 25155 9098 1 11 . 1 1 114 114 LYS C C 114 174.925 174.925 174.829 0.096 25155 9099 1 11 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.198 0.082 25155 9100 1 11 . 1 1 114 114 LYS CB C 114 33.630 33.630 33.952 -0.322 25155 9101 1 11 . 1 1 115 115 PHE N N 115 123.140 123.140 123.717 -0.577 25155 9102 1 11 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.497 0.203 25155 9103 1 11 . 1 1 115 115 PHE C C 115 177.580 177.580 176.299 1.281 25155 9104 1 11 . 1 1 115 115 PHE CA C 115 58.677 58.677 56.980 1.697 25155 9105 1 11 . 1 1 115 115 PHE CB C 115 41.120 41.120 40.337 0.782 25155 9106 1 11 . 1 1 115 115 PHE H H 115 8.506 8.506 8.521 -0.015 25155 9107 1 11 . 1 1 116 116 VAL N N 116 115.737 115.737 117.378 -1.641 25155 9108 1 11 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.735 -0.257 25155 9109 1 11 . 1 1 116 116 VAL C C 116 175.300 175.300 175.239 0.061 25155 9110 1 11 . 1 1 116 116 VAL CA C 116 58.877 58.877 59.576 -0.699 25155 9111 1 11 . 1 1 116 116 VAL CB C 116 34.120 34.120 34.634 -0.514 25155 9112 1 11 . 1 1 116 116 VAL H H 116 8.860 8.860 8.699 0.161 25155 9113 1 11 . 1 1 117 117 GLY N N 117 108.137 108.137 110.534 -2.397 25155 9114 1 11 . 1 1 117 117 GLY C C 117 176.110 176.110 174.261 1.849 25155 9115 1 11 . 1 1 117 117 GLY CA C 117 47.500 47.500 45.084 2.417 25155 9116 1 11 . 1 1 117 117 GLY H H 117 9.838 9.838 9.331 0.507 25155 9117 1 11 . 1 1 118 118 TYR N N 118 120.380 120.380 120.293 0.087 25155 9118 1 11 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.379 0.591 25155 9119 1 11 . 1 1 118 118 TYR C C 118 177.630 177.630 174.891 2.739 25155 9120 1 11 . 1 1 118 118 TYR CA C 118 55.800 55.800 59.433 -3.633 25155 9121 1 11 . 1 1 118 118 TYR CB C 118 35.970 35.970 37.709 -1.740 25155 9122 1 11 . 1 1 118 118 TYR H H 118 8.652 8.652 8.175 0.477 25155 9123 1 11 . 1 1 119 119 TRP N N 119 126.040 126.040 118.394 7.646 25155 9124 1 11 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.085 0.936 25155 9125 1 11 . 1 1 119 119 TRP C C 119 173.000 173.000 173.928 -0.928 25155 9126 1 11 . 1 1 119 119 TRP CA C 119 53.820 53.820 55.965 -2.144 25155 9127 1 11 . 1 1 119 119 TRP CB C 119 36.050 36.050 33.425 2.626 25155 9128 1 11 . 1 1 119 119 TRP H H 119 8.070 8.070 8.285 -0.215 25155 9129 1 11 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.590 0.194 25155 9130 1 11 . 1 1 120 120 PRO C C 120 176.870 176.870 176.457 0.413 25155 9131 1 11 . 1 1 120 120 PRO CA C 120 63.780 63.780 62.852 0.928 25155 9132 1 11 . 1 1 120 120 PRO CB C 120 31.990 31.990 32.237 -0.247 25155 9133 1 11 . 1 1 121 121 THR N N 121 109.310 109.310 113.382 -4.072 25155 9134 1 11 . 1 1 121 121 THR HA H 121 4.073 4.073 4.051 0.022 25155 9135 1 11 . 1 1 121 121 THR C C 121 176.324 176.324 175.738 0.586 25155 9136 1 11 . 1 1 121 121 THR CA C 121 61.250 61.250 63.859 -2.609 25155 9137 1 11 . 1 1 121 121 THR CB C 121 69.730 69.730 68.812 0.918 25155 9138 1 11 . 1 1 121 121 THR H H 121 7.370 7.370 8.182 -0.812 25155 9139 1 11 . 1 1 122 122 GLU N N 122 123.937 123.937 121.613 2.324 25155 9140 1 11 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.077 0.147 25155 9141 1 11 . 1 1 122 122 GLU C C 122 177.737 177.737 177.786 -0.049 25155 9142 1 11 . 1 1 122 122 GLU CA C 122 58.200 58.200 57.637 0.563 25155 9143 1 11 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.496 0.304 25155 9144 1 11 . 1 1 123 123 GLY N N 123 114.563 114.563 111.678 2.885 25155 9145 1 11 . 1 1 123 123 GLY C C 123 173.783 173.783 173.534 0.249 25155 9146 1 11 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.443 -0.063 25155 9147 1 11 . 1 1 123 123 GLY H H 123 9.144 9.144 8.948 0.196 25155 9148 1 11 . 1 1 124 124 TYR N N 124 118.800 118.800 121.184 -2.384 25155 9149 1 11 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.751 0.467 25155 9150 1 11 . 1 1 124 124 TYR C C 124 175.673 175.673 175.735 -0.062 25155 9151 1 11 . 1 1 124 124 TYR CA C 124 56.950 56.950 57.032 -0.083 25155 9152 1 11 . 1 1 124 124 TYR CB C 124 41.100 41.100 40.298 0.802 25155 9153 1 11 . 1 1 124 124 TYR H H 124 7.895 7.895 7.972 -0.077 25155 9154 1 11 . 1 1 125 125 GLU N N 125 124.790 124.790 121.269 3.521 25155 9155 1 11 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.118 0.567 25155 9156 1 11 . 1 1 125 125 GLU C C 125 172.877 172.877 176.144 -3.267 25155 9157 1 11 . 1 1 125 125 GLU CA C 125 55.700 55.700 56.877 -1.177 25155 9158 1 11 . 1 1 125 125 GLU CB C 125 31.340 31.340 29.825 1.515 25155 9159 1 11 . 1 1 126 126 PHE N N 126 118.670 118.670 115.461 3.209 25155 9160 1 11 . 1 1 126 126 PHE HA H 126 4.841 4.841 3.948 0.893 25155 9161 1 11 . 1 1 126 126 PHE C C 126 173.800 173.800 174.862 -1.062 25155 9162 1 11 . 1 1 126 126 PHE CA C 126 56.950 56.950 58.753 -1.803 25155 9163 1 11 . 1 1 126 126 PHE CB C 126 40.300 40.300 38.209 2.091 25155 9164 1 11 . 1 1 126 126 PHE H H 126 7.645 7.645 7.954 -0.309 25155 9165 1 11 . 1 1 127 127 THR N N 127 107.038 107.038 114.211 -7.173 25155 9166 1 11 . 1 1 127 127 THR HA H 127 4.370 4.370 3.946 0.424 25155 9167 1 11 . 1 1 127 127 THR C C 127 175.100 175.100 174.370 0.730 25155 9168 1 11 . 1 1 127 127 THR CA C 127 61.080 61.080 61.210 -0.130 25155 9169 1 11 . 1 1 127 127 THR CB C 127 70.500 70.500 69.175 1.325 25155 9170 1 11 . 1 1 127 127 THR H H 127 7.306 7.306 8.766 -1.460 25155 9171 1 11 . 1 1 128 128 SER N N 128 118.150 118.150 120.521 -2.371 25155 9172 1 11 . 1 1 128 128 SER HA H 128 4.650 4.650 4.534 0.116 25155 9173 1 11 . 1 1 128 128 SER C C 128 175.760 175.760 174.098 1.662 25155 9174 1 11 . 1 1 128 128 SER CA C 128 55.813 55.813 58.979 -3.166 25155 9175 1 11 . 1 1 128 128 SER CB C 128 65.300 65.300 63.539 1.761 25155 9176 1 11 . 1 1 128 128 SER H H 128 7.354 7.354 8.353 -0.999 25155 9177 1 11 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.575 0.189 25155 9178 1 11 . 1 1 129 129 PRO C C 129 178.860 178.860 178.521 0.339 25155 9179 1 11 . 1 1 129 129 PRO CA C 129 62.728 62.728 64.160 -1.432 25155 9180 1 11 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.660 -0.260 25155 9181 1 11 . 1 1 130 130 LYS N N 130 122.158 122.158 119.094 3.064 25155 9182 1 11 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.097 0.113 25155 9183 1 11 . 1 1 130 130 LYS C C 130 176.890 176.890 175.577 1.313 25155 9184 1 11 . 1 1 130 130 LYS CA C 130 61.375 61.375 60.564 0.811 25155 9185 1 11 . 1 1 130 130 LYS CB C 130 30.350 30.350 31.066 -0.716 25155 9186 1 11 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.409 0.124 25155 9187 1 11 . 1 1 131 131 PRO C C 131 173.810 173.810 175.579 -1.769 25155 9188 1 11 . 1 1 131 131 PRO CA C 131 64.510 64.510 63.058 1.452 25155 9189 1 11 . 1 1 131 131 PRO CB C 131 31.745 31.745 31.373 0.372 25155 9190 1 11 . 1 1 132 132 VAL N N 132 114.480 114.480 114.584 -0.104 25155 9191 1 11 . 1 1 132 132 VAL HA H 132 5.158 5.158 4.853 0.305 25155 9192 1 11 . 1 1 132 132 VAL C C 132 175.137 175.137 175.276 -0.139 25155 9193 1 11 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.350 0.450 25155 9194 1 11 . 1 1 132 132 VAL CB C 132 34.780 34.780 35.304 -0.525 25155 9195 1 11 . 1 1 132 132 VAL H H 132 6.716 6.716 7.523 -0.807 25155 9196 1 11 . 1 1 133 133 ILE N N 133 120.670 120.670 117.138 3.532 25155 9197 1 11 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.375 0.018 25155 9198 1 11 . 1 1 133 133 ILE C C 133 175.485 175.485 176.069 -0.584 25155 9199 1 11 . 1 1 133 133 ILE CA C 133 60.000 60.000 59.686 0.314 25155 9200 1 11 . 1 1 133 133 ILE CB C 133 42.020 42.020 39.433 2.587 25155 9201 1 11 . 1 1 133 133 ILE H H 133 8.740 8.740 8.389 0.351 25155 9202 1 11 . 1 1 134 134 ALA N N 134 122.454 122.454 123.756 -1.302 25155 9203 1 11 . 1 1 134 134 ALA HA H 134 3.953 3.953 3.870 0.083 25155 9204 1 11 . 1 1 134 134 ALA C C 134 178.387 178.387 178.067 0.320 25155 9205 1 11 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.492 -0.442 25155 9206 1 11 . 1 1 134 134 ALA CB C 134 16.982 16.982 16.997 -0.015 25155 9207 1 11 . 1 1 134 134 ALA H H 134 8.490 8.490 8.703 -0.213 25155 9208 1 11 . 1 1 135 135 ASP N N 135 117.310 117.310 116.026 1.284 25155 9209 1 11 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.233 0.011 25155 9210 1 11 . 1 1 135 135 ASP C C 135 176.390 176.390 175.530 0.860 25155 9211 1 11 . 1 1 135 135 ASP CA C 135 55.120 55.120 56.102 -0.982 25155 9212 1 11 . 1 1 135 135 ASP CB C 135 39.865 39.865 40.663 -0.798 25155 9213 1 11 . 1 1 136 136 GLY N N 136 104.336 104.336 104.135 0.201 25155 9214 1 11 . 1 1 136 136 GLY C C 136 174.940 174.940 175.310 -0.370 25155 9215 1 11 . 1 1 136 136 GLY CA C 136 45.150 45.150 45.422 -0.272 25155 9216 1 11 . 1 1 136 136 GLY H H 136 7.592 7.592 7.724 -0.132 25155 9217 1 11 . 1 1 137 137 GLN N N 137 118.675 118.675 120.298 -1.623 25155 9218 1 11 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.342 -0.280 25155 9219 1 11 . 1 1 137 137 GLN C C 137 176.420 176.420 175.235 1.185 25155 9220 1 11 . 1 1 137 137 GLN CA C 137 57.760 57.760 58.085 -0.325 25155 9221 1 11 . 1 1 137 137 GLN CB C 137 30.400 30.400 29.956 0.444 25155 9222 1 11 . 1 1 137 137 GLN H H 137 7.843 7.843 8.218 -0.375 25155 9223 1 11 . 1 1 138 138 LEU N N 138 118.160 118.160 116.873 1.287 25155 9224 1 11 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.712 0.249 25155 9225 1 11 . 1 1 138 138 LEU C C 138 175.700 175.700 174.848 0.852 25155 9226 1 11 . 1 1 138 138 LEU CA C 138 53.705 53.705 53.183 0.522 25155 9227 1 11 . 1 1 138 138 LEU CB C 138 46.480 46.480 45.735 0.745 25155 9228 1 11 . 1 1 138 138 LEU H H 138 7.356 7.356 7.123 0.233 25155 9229 1 11 . 1 1 139 139 PHE N N 139 119.060 119.060 120.575 -1.515 25155 9230 1 11 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.577 0.767 25155 9231 1 11 . 1 1 139 139 PHE C C 139 178.850 178.850 177.532 1.318 25155 9232 1 11 . 1 1 139 139 PHE CA C 139 56.670 56.670 58.800 -2.130 25155 9233 1 11 . 1 1 139 139 PHE CB C 139 43.652 43.652 39.270 4.382 25155 9234 1 11 . 1 1 139 139 PHE H H 139 10.026 10.026 9.132 0.894 25155 9235 1 11 . 1 1 140 140 VAL N N 140 109.905 109.905 117.194 -7.289 25155 9236 1 11 . 1 1 140 140 VAL HA H 140 3.500 3.500 3.344 0.156 25155 9237 1 11 . 1 1 140 140 VAL C C 140 172.860 172.860 175.247 -2.387 25155 9238 1 11 . 1 1 140 140 VAL CA C 140 61.812 61.812 62.405 -0.593 25155 9239 1 11 . 1 1 140 140 VAL CB C 140 30.250 30.250 31.072 -0.822 25155 9240 1 11 . 1 1 140 140 VAL H H 140 7.550 7.550 8.459 -0.909 25155 9241 1 11 . 1 1 141 141 GLY N N 141 106.600 106.600 107.078 -0.478 25155 9242 1 11 . 1 1 141 141 GLY C C 141 171.350 171.350 172.747 -1.397 25155 9243 1 11 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.887 0.573 25155 9244 1 11 . 1 1 141 141 GLY H H 141 7.052 7.052 7.307 -0.255 25155 9245 1 11 . 1 1 142 142 LEU N N 142 117.820 117.820 120.407 -2.587 25155 9246 1 11 . 1 1 142 142 LEU HA H 142 4.962 4.962 4.119 0.843 25155 9247 1 11 . 1 1 142 142 LEU CA C 142 55.600 55.600 54.421 1.179 25155 9248 1 11 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.532 -4.602 25155 9249 1 11 . 1 1 142 142 LEU H H 142 7.643 7.643 8.270 -0.627 25155 9250 1 11 . 1 1 143 143 ALA HA H 143 4.220 4.220 3.936 0.284 25155 9251 1 11 . 1 1 143 143 ALA C C 143 175.505 175.505 175.450 0.055 25155 9252 1 11 . 1 1 143 143 ALA CA C 143 49.600 49.600 49.809 -0.209 25155 9253 1 11 . 1 1 143 143 ALA CB C 143 23.330 23.330 18.210 5.120 25155 9254 1 11 . 1 1 144 144 LEU N N 144 124.960 124.960 124.041 0.919 25155 9255 1 11 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.497 0.283 25155 9256 1 11 . 1 1 144 144 LEU C C 144 174.700 174.700 175.254 -0.554 25155 9257 1 11 . 1 1 144 144 LEU CA C 144 52.790 52.790 53.650 -0.860 25155 9258 1 11 . 1 1 144 144 LEU CB C 144 45.300 45.300 43.937 1.363 25155 9259 1 11 . 1 1 144 144 LEU H H 144 8.583 8.583 8.189 0.394 25155 9260 1 11 . 1 1 145 145 ASP N N 145 119.100 119.100 119.160 -0.060 25155 9261 1 11 . 1 1 145 145 ASP HA H 145 5.422 5.422 4.823 0.599 25155 9262 1 11 . 1 1 145 145 ASP C C 145 176.180 176.180 174.950 1.230 25155 9263 1 11 . 1 1 145 145 ASP CA C 145 53.600 53.600 53.303 0.297 25155 9264 1 11 . 1 1 145 145 ASP CB C 145 43.180 43.180 44.026 -0.846 25155 9265 1 11 . 1 1 147 147 THR HA H 147 4.093 4.093 4.205 -0.112 25155 9266 1 11 . 1 1 147 147 THR C C 147 175.858 175.858 176.006 -0.148 25155 9267 1 11 . 1 1 147 147 THR CA C 147 66.400 66.400 65.695 0.705 25155 9268 1 11 . 1 1 147 147 THR CB C 147 69.400 69.400 69.310 0.090 25155 9269 1 11 . 1 1 147 147 THR H H 147 8.745 8.745 8.686 0.059 25155 9270 1 11 . 1 1 148 148 ASN N N 148 115.408 115.408 118.321 -2.913 25155 9271 1 11 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.696 0.314 25155 9272 1 11 . 1 1 148 148 ASN C C 148 175.750 175.750 174.842 0.908 25155 9273 1 11 . 1 1 148 148 ASN CA C 148 53.400 53.400 54.727 -1.327 25155 9274 1 11 . 1 1 148 148 ASN CB C 148 41.900 41.900 39.542 2.358 25155 9275 1 11 . 1 1 148 148 ASN H H 148 8.975 8.975 8.852 0.123 25155 9276 1 11 . 1 1 149 149 GLN N N 149 117.900 117.900 114.605 3.295 25155 9277 1 11 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.586 0.350 25155 9278 1 11 . 1 1 149 149 GLN C C 149 178.280 178.280 173.835 4.445 25155 9279 1 11 . 1 1 149 149 GLN CA C 149 53.730 53.730 55.356 -1.626 25155 9280 1 11 . 1 1 149 149 GLN CB C 149 29.790 29.790 31.182 -1.392 25155 9281 1 11 . 1 1 149 149 GLN H H 149 7.430 7.430 7.674 -0.244 25155 9282 1 11 . 1 1 150 150 TYR N N 150 121.060 121.060 122.757 -1.697 25155 9283 1 11 . 1 1 150 150 TYR HA H 150 4.671 4.671 4.921 -0.250 25155 9284 1 11 . 1 1 150 150 TYR C C 150 178.680 178.680 175.953 2.727 25155 9285 1 11 . 1 1 150 150 TYR CA C 150 57.930 57.930 58.495 -0.565 25155 9286 1 11 . 1 1 150 150 TYR CB C 150 38.860 38.860 40.080 -1.220 25155 9287 1 11 . 1 1 150 150 TYR H H 150 8.115 8.115 8.915 -0.800 25155 9288 1 11 . 1 1 151 151 ASP N N 151 121.175 121.175 120.197 0.978 25155 9289 1 11 . 1 1 151 151 ASP CA C 151 57.000 57.000 56.683 0.317 25155 9290 1 11 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.602 1.398 25155 9291 1 11 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.310 0.280 25155 9292 1 11 . 1 1 152 152 LEU C C 152 178.300 178.300 177.855 0.445 25155 9293 1 11 . 1 1 152 152 LEU CA C 152 54.788 54.788 55.449 -0.661 25155 9294 1 11 . 1 1 152 152 LEU CB C 152 42.200 42.200 40.912 1.288 25155 9295 1 11 . 1 1 153 153 SER N N 153 116.170 116.170 115.896 0.274 25155 9296 1 11 . 1 1 153 153 SER HA H 153 3.911 3.911 4.023 -0.112 25155 9297 1 11 . 1 1 153 153 SER CA C 153 63.400 63.400 62.455 0.945 25155 9298 1 11 . 1 1 153 153 SER CB C 153 63.200 63.200 62.941 0.259 25155 9299 1 11 . 1 1 153 153 SER H H 153 7.378 7.378 7.524 -0.146 25155 9300 1 11 . 1 1 154 154 ASP N N 154 121.640 121.640 120.948 0.692 25155 9301 1 11 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.321 -0.081 25155 9302 1 11 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.286 2.014 25155 9303 1 11 . 1 1 154 154 ASP CB C 154 40.000 40.000 40.884 -0.884 25155 9304 1 11 . 1 1 155 155 GLU HA H 155 4.170 4.170 3.946 0.224 25155 9305 1 11 . 1 1 155 155 GLU C C 155 179.420 179.420 178.962 0.458 25155 9306 1 11 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.307 -0.107 25155 9307 1 11 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.652 -0.172 25155 9308 1 11 . 1 1 156 156 ARG N N 156 121.230 121.230 118.308 2.922 25155 9309 1 11 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.251 0.025 25155 9310 1 11 . 1 1 156 156 ARG C C 156 177.350 177.350 179.467 -2.117 25155 9311 1 11 . 1 1 156 156 ARG CA C 156 59.950 59.950 59.256 0.694 25155 9312 1 11 . 1 1 156 156 ARG CB C 156 31.100 31.100 30.209 0.891 25155 9313 1 11 . 1 1 157 157 ILE N N 157 118.190 118.190 119.903 -1.713 25155 9314 1 11 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.698 -0.268 25155 9315 1 11 . 1 1 157 157 ILE C C 157 178.480 178.480 178.205 0.275 25155 9316 1 11 . 1 1 157 157 ILE CA C 157 66.560 66.560 64.994 1.566 25155 9317 1 11 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.949 0.531 25155 9318 1 11 . 1 1 157 157 ILE H H 157 8.705 8.705 7.658 1.047 25155 9319 1 11 . 1 1 158 158 GLN N N 158 119.975 119.975 121.007 -1.032 25155 9320 1 11 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.876 0.080 25155 9321 1 11 . 1 1 158 158 GLN C C 158 178.730 178.730 178.197 0.533 25155 9322 1 11 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.225 1.475 25155 9323 1 11 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.308 0.174 25155 9324 1 11 . 1 1 158 158 GLN H H 158 8.262 8.262 8.544 -0.282 25155 9325 1 11 . 1 1 159 159 SER N N 159 115.466 115.466 115.002 0.464 25155 9326 1 11 . 1 1 159 159 SER HA H 159 4.446 4.446 4.286 0.160 25155 9327 1 11 . 1 1 159 159 SER C C 159 177.320 177.320 176.662 0.658 25155 9328 1 11 . 1 1 159 159 SER CA C 159 63.500 63.500 60.986 2.514 25155 9329 1 11 . 1 1 159 159 SER CB C 159 63.818 63.818 63.162 0.656 25155 9330 1 11 . 1 1 159 159 SER H H 159 8.440 8.440 8.241 0.199 25155 9331 1 11 . 1 1 160 160 TRP N N 160 126.784 126.784 125.032 1.752 25155 9332 1 11 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.472 -0.018 25155 9333 1 11 . 1 1 160 160 TRP C C 160 177.934 177.934 177.397 0.537 25155 9334 1 11 . 1 1 160 160 TRP CA C 160 62.745 62.745 61.903 0.842 25155 9335 1 11 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.379 -0.029 25155 9336 1 11 . 1 1 160 160 TRP H H 160 9.243 9.243 7.680 1.563 25155 9337 1 11 . 1 1 161 161 CYS N N 161 116.395 116.395 118.688 -2.293 25155 9338 1 11 . 1 1 161 161 CYS HA H 161 3.886 3.886 3.808 0.078 25155 9339 1 11 . 1 1 161 161 CYS C C 161 176.245 176.245 177.017 -0.772 25155 9340 1 11 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.598 0.702 25155 9341 1 11 . 1 1 161 161 CYS CB C 161 27.723 27.723 26.971 0.752 25155 9342 1 11 . 1 1 161 161 CYS H H 161 8.845 8.845 9.064 -0.219 25155 9343 1 11 . 1 1 162 162 GLU N N 162 118.030 118.030 119.608 -1.578 25155 9344 1 11 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.865 0.055 25155 9345 1 11 . 1 1 162 162 GLU C C 162 178.700 178.700 178.696 0.004 25155 9346 1 11 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.476 0.324 25155 9347 1 11 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.234 0.266 25155 9348 1 11 . 1 1 163 163 GLN N N 163 120.650 120.650 119.588 1.062 25155 9349 1 11 . 1 1 163 163 GLN HA H 163 4.173 4.173 4.009 0.164 25155 9350 1 11 . 1 1 163 163 GLN C C 163 179.700 179.700 178.425 1.275 25155 9351 1 11 . 1 1 163 163 GLN CA C 163 59.688 59.688 58.934 0.753 25155 9352 1 11 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.713 0.187 25155 9353 1 11 . 1 1 163 163 GLN H H 163 8.148 8.148 7.823 0.325 25155 9354 1 11 . 1 1 164 164 ILE N N 164 114.836 114.836 117.029 -2.193 25155 9355 1 11 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.577 0.483 25155 9356 1 11 . 1 1 164 164 ILE C C 164 178.676 178.676 177.669 1.007 25155 9357 1 11 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.380 1.780 25155 9358 1 11 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.298 0.332 25155 9359 1 11 . 1 1 164 164 ILE H H 164 8.958 8.958 8.229 0.729 25155 9360 1 11 . 1 1 165 165 LEU N N 165 123.700 123.700 119.835 3.865 25155 9361 1 11 . 1 1 165 165 LEU HA H 165 4.100 4.100 4.051 0.049 25155 9362 1 11 . 1 1 165 165 LEU C C 165 180.548 180.548 178.426 2.122 25155 9363 1 11 . 1 1 165 165 LEU CA C 165 58.150 58.150 58.232 -0.082 25155 9364 1 11 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.462 -0.332 25155 9365 1 11 . 1 1 165 165 LEU H H 165 7.830 7.830 7.763 0.067 25155 9366 1 11 . 1 1 166 166 ASN N N 166 120.160 120.160 118.464 1.696 25155 9367 1 11 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.364 0.206 25155 9368 1 11 . 1 1 166 166 ASN C C 166 175.690 175.690 177.398 -1.708 25155 9369 1 11 . 1 1 166 166 ASN CA C 166 55.946 55.946 56.923 -0.977 25155 9370 1 11 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.346 0.134 25155 9371 1 11 . 1 1 166 166 ASN H H 166 7.706 7.706 7.787 -0.081 25155 9372 1 11 . 1 1 167 167 GLU N N 167 121.286 121.286 121.218 0.068 25155 9373 1 11 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.041 0.063 25155 9374 1 11 . 1 1 167 167 GLU C C 167 180.520 180.520 179.274 1.246 25155 9375 1 11 . 1 1 167 167 GLU CA C 167 59.920 59.920 59.207 0.713 25155 9376 1 11 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.729 1.196 25155 9377 1 11 . 1 1 168 168 MET N N 168 118.622 118.622 115.990 2.632 25155 9378 1 11 . 1 1 168 168 MET HA H 168 3.996 3.996 4.184 -0.188 25155 9379 1 11 . 1 1 168 168 MET C C 168 176.856 176.856 177.709 -0.853 25155 9380 1 11 . 1 1 168 168 MET CA C 168 59.500 59.500 58.748 0.752 25155 9381 1 11 . 1 1 168 168 MET CB C 168 33.700 33.700 32.647 1.053 25155 9382 1 11 . 1 1 168 168 MET H H 168 8.723 8.723 8.378 0.345 25155 9383 1 11 . 1 1 169 169 ALA N N 169 121.760 121.760 122.644 -0.884 25155 9384 1 11 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.366 -0.210 25155 9385 1 11 . 1 1 169 169 ALA C C 169 179.790 179.790 180.300 -0.510 25155 9386 1 11 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.404 0.396 25155 9387 1 11 . 1 1 169 169 ALA CB C 169 18.220 18.220 18.494 -0.274 25155 9388 1 11 . 1 1 169 169 ALA H H 169 7.494 7.494 7.418 0.076 25155 9389 1 11 . 1 1 170 170 GLU N N 170 116.970 116.970 119.199 -2.229 25155 9390 1 11 . 1 1 170 170 GLU HA H 170 4.091 4.091 4.005 0.086 25155 9391 1 11 . 1 1 170 170 GLU C C 170 177.745 177.745 179.034 -1.289 25155 9392 1 11 . 1 1 170 170 GLU CA C 170 58.000 58.000 59.125 -1.125 25155 9393 1 11 . 1 1 170 170 GLU CB C 170 29.730 29.730 29.404 0.326 25155 9394 1 11 . 1 1 171 171 HIS N N 171 118.150 118.150 119.310 -1.160 25155 9395 1 11 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.295 0.175 25155 9396 1 11 . 1 1 171 171 HIS C C 171 175.848 175.848 176.178 -0.330 25155 9397 1 11 . 1 1 171 171 HIS CA C 171 57.600 57.600 58.554 -0.954 25155 9398 1 11 . 1 1 171 171 HIS CB C 171 30.800 30.800 29.671 1.129 25155 9399 1 11 . 1 1 171 171 HIS H H 171 7.717 7.717 7.767 -0.050 25155 9400 1 11 . 1 1 172 172 TYR N N 172 119.483 119.483 118.073 1.410 25155 9401 1 11 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.415 0.176 25155 9402 1 11 . 1 1 172 172 TYR C C 172 174.590 174.590 176.005 -1.415 25155 9403 1 11 . 1 1 172 172 TYR CA C 172 57.813 57.813 58.175 -0.362 25155 9404 1 11 . 1 1 172 172 TYR CB C 172 38.900 38.900 38.354 0.546 25155 9405 1 11 . 1 1 172 172 TYR H H 172 7.778 7.778 7.686 0.092 25155 9406 1 12 . 1 1 2 2 ASN N N 2 122.966 122.966 118.952 4.014 25155 9407 1 12 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.139 0.036 25155 9408 1 12 . 1 1 2 2 ASN C C 2 175.200 175.200 174.360 0.840 25155 9409 1 12 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.631 0.289 25155 9410 1 12 . 1 1 2 2 ASN CB C 2 40.000 40.000 41.215 -1.215 25155 9411 1 12 . 1 1 2 2 ASN H H 2 9.392 9.392 8.411 0.981 25155 9412 1 12 . 1 1 3 3 MET N N 3 120.660 120.660 120.848 -0.188 25155 9413 1 12 . 1 1 3 3 MET HA H 3 5.565 5.565 5.113 0.452 25155 9414 1 12 . 1 1 3 3 MET C C 3 174.200 174.200 175.384 -1.184 25155 9415 1 12 . 1 1 3 3 MET CA C 3 54.550 54.550 54.212 0.338 25155 9416 1 12 . 1 1 3 3 MET CB C 3 34.100 34.100 35.487 -1.387 25155 9417 1 12 . 1 1 3 3 MET H H 3 8.745 8.745 8.767 -0.022 25155 9418 1 12 . 1 1 4 4 GLY N N 4 115.792 115.792 109.828 5.964 25155 9419 1 12 . 1 1 4 4 GLY C C 4 170.444 170.444 172.047 -1.603 25155 9420 1 12 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.267 -0.380 25155 9421 1 12 . 1 1 4 4 GLY H H 4 8.989 8.989 9.023 -0.034 25155 9422 1 12 . 1 1 5 5 LEU N N 5 131.175 131.175 124.668 6.507 25155 9423 1 12 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.344 0.978 25155 9424 1 12 . 1 1 5 5 LEU C C 5 175.700 175.700 174.717 0.983 25155 9425 1 12 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.820 -0.500 25155 9426 1 12 . 1 1 5 5 LEU CB C 5 44.700 44.700 43.831 0.869 25155 9427 1 12 . 1 1 5 5 LEU H H 5 8.917 8.917 8.096 0.821 25155 9428 1 12 . 1 1 6 6 PHE N N 6 125.990 125.990 125.130 0.860 25155 9429 1 12 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.678 0.060 25155 9430 1 12 . 1 1 6 6 PHE C C 6 174.358 174.358 173.396 0.962 25155 9431 1 12 . 1 1 6 6 PHE CA C 6 55.480 55.480 54.956 0.524 25155 9432 1 12 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.968 -0.918 25155 9433 1 12 . 1 1 6 6 PHE H H 6 9.225 9.225 9.368 -0.143 25155 9434 1 12 . 1 1 7 7 TYR N N 7 118.040 118.040 116.653 1.387 25155 9435 1 12 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.709 0.220 25155 9436 1 12 . 1 1 7 7 TYR C C 7 171.690 171.690 173.873 -2.183 25155 9437 1 12 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.426 -0.966 25155 9438 1 12 . 1 1 7 7 TYR CB C 7 40.800 40.800 40.998 -0.198 25155 9439 1 12 . 1 1 7 7 TYR H H 7 8.235 8.235 7.906 0.329 25155 9440 1 12 . 1 1 8 8 GLY N N 8 106.640 106.640 107.500 -0.860 25155 9441 1 12 . 1 1 8 8 GLY C C 8 171.682 171.682 172.595 -0.913 25155 9442 1 12 . 1 1 8 8 GLY CA C 8 44.050 44.050 45.650 -1.600 25155 9443 1 12 . 1 1 8 8 GLY H H 8 6.996 6.996 8.796 -1.800 25155 9444 1 12 . 1 1 9 9 SER N N 9 118.164 118.164 118.549 -0.385 25155 9445 1 12 . 1 1 9 9 SER C C 9 174.560 174.560 174.116 0.444 25155 9446 1 12 . 1 1 9 9 SER CA C 9 57.140 57.140 57.218 -0.078 25155 9447 1 12 . 1 1 9 9 SER H H 9 9.680 9.680 8.338 1.342 25155 9448 1 12 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.866 -0.236 25155 9449 1 12 . 1 1 17 17 ALA C C 17 177.740 177.740 179.225 -1.485 25155 9450 1 12 . 1 1 17 17 ALA CA C 17 54.900 54.900 54.895 0.005 25155 9451 1 12 . 1 1 17 17 ALA CB C 17 17.790 17.790 17.689 0.101 25155 9452 1 12 . 1 1 17 17 ALA H H 17 8.055 8.055 7.432 0.623 25155 9453 1 12 . 1 1 18 18 ALA N N 18 120.026 120.026 121.202 -1.176 25155 9454 1 12 . 1 1 18 18 ALA HA H 18 3.713 3.713 3.921 -0.208 25155 9455 1 12 . 1 1 18 18 ALA C C 18 179.040 179.040 179.357 -0.317 25155 9456 1 12 . 1 1 18 18 ALA CA C 18 54.860 54.860 55.077 -0.217 25155 9457 1 12 . 1 1 18 18 ALA CB C 18 18.200 18.200 18.308 -0.108 25155 9458 1 12 . 1 1 18 18 ALA H H 18 7.015 7.015 8.172 -1.157 25155 9459 1 12 . 1 1 19 19 GLU N N 19 116.656 116.656 118.192 -1.536 25155 9460 1 12 . 1 1 19 19 GLU HA H 19 3.580 3.580 4.036 -0.456 25155 9461 1 12 . 1 1 19 19 GLU C C 19 178.487 178.487 179.169 -0.682 25155 9462 1 12 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.214 0.456 25155 9463 1 12 . 1 1 19 19 GLU CB C 19 29.400 29.400 28.972 0.428 25155 9464 1 12 . 1 1 20 20 LYS N N 20 120.100 120.100 120.650 -0.550 25155 9465 1 12 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.020 0.326 25155 9466 1 12 . 1 1 20 20 LYS C C 20 175.330 175.330 178.973 -3.643 25155 9467 1 12 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.296 -2.196 25155 9468 1 12 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.324 0.676 25155 9469 1 12 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.705 -0.240 25155 9470 1 12 . 1 1 21 21 ILE C C 21 177.680 177.680 177.987 -0.307 25155 9471 1 12 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.467 0.173 25155 9472 1 12 . 1 1 21 21 ILE CB C 21 38.030 38.030 38.000 0.030 25155 9473 1 12 . 1 1 21 21 ILE H H 21 8.220 8.220 8.493 -0.273 25155 9474 1 12 . 1 1 22 22 ARG N N 22 119.433 119.433 118.624 0.809 25155 9475 1 12 . 1 1 22 22 ARG HA H 22 3.550 3.550 4.002 -0.452 25155 9476 1 12 . 1 1 22 22 ARG C C 22 177.268 177.268 178.227 -0.959 25155 9477 1 12 . 1 1 22 22 ARG CA C 22 59.760 59.760 58.757 1.003 25155 9478 1 12 . 1 1 22 22 ARG CB C 22 28.900 28.900 28.959 -0.059 25155 9479 1 12 . 1 1 23 23 ASP N N 23 118.945 118.945 119.882 -0.937 25155 9480 1 12 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.410 -0.068 25155 9481 1 12 . 1 1 23 23 ASP C C 23 178.470 178.470 178.555 -0.085 25155 9482 1 12 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.163 0.287 25155 9483 1 12 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.868 -0.498 25155 9484 1 12 . 1 1 24 24 ILE N N 24 121.200 121.200 119.476 1.724 25155 9485 1 12 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.796 -0.062 25155 9486 1 12 . 1 1 24 24 ILE C C 24 178.297 178.297 177.951 0.346 25155 9487 1 12 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.346 0.154 25155 9488 1 12 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.396 0.344 25155 9489 1 12 . 1 1 24 24 ILE H H 24 8.160 8.160 7.873 0.286 25155 9490 1 12 . 1 1 25 25 ILE N N 25 121.166 121.166 117.788 3.378 25155 9491 1 12 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.798 -0.155 25155 9492 1 12 . 1 1 25 25 ILE C C 25 176.825 176.825 176.756 0.069 25155 9493 1 12 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.358 2.532 25155 9494 1 12 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.699 -0.949 25155 9495 1 12 . 1 1 25 25 ILE H H 25 8.480 8.480 8.082 0.398 25155 9496 1 12 . 1 1 26 26 GLY N N 26 109.050 109.050 104.627 4.423 25155 9497 1 12 . 1 1 26 26 GLY C C 26 173.800 173.800 172.615 1.185 25155 9498 1 12 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.495 -0.095 25155 9499 1 12 . 1 1 26 26 GLY H H 26 7.945 7.945 7.693 0.252 25155 9500 1 12 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.400 -0.037 25155 9501 1 12 . 1 1 27 27 PRO C C 27 177.157 177.157 176.927 0.230 25155 9502 1 12 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.928 0.602 25155 9503 1 12 . 1 1 27 27 PRO CB C 27 32.000 32.000 32.117 -0.117 25155 9504 1 12 . 1 1 28 28 GLU N N 28 116.510 116.510 116.666 -0.156 25155 9505 1 12 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.212 0.048 25155 9506 1 12 . 1 1 28 28 GLU C C 28 177.000 177.000 177.018 -0.018 25155 9507 1 12 . 1 1 28 28 GLU CA C 28 57.680 57.680 57.712 -0.032 25155 9508 1 12 . 1 1 28 28 GLU CB C 28 28.620 28.620 29.164 -0.544 25155 9509 1 12 . 1 1 29 29 LEU N N 29 120.334 120.334 113.273 7.061 25155 9510 1 12 . 1 1 29 29 LEU HA H 29 4.650 4.650 4.953 -0.303 25155 9511 1 12 . 1 1 29 29 LEU C C 29 175.676 175.676 174.939 0.737 25155 9512 1 12 . 1 1 29 29 LEU CA C 29 55.924 55.924 54.812 1.112 25155 9513 1 12 . 1 1 29 29 LEU CB C 29 44.880 44.880 44.400 0.480 25155 9514 1 12 . 1 1 29 29 LEU H H 29 7.924 7.924 7.534 0.390 25155 9515 1 12 . 1 1 30 30 VAL N N 30 118.900 118.900 119.878 -0.978 25155 9516 1 12 . 1 1 30 30 VAL HA H 30 4.639 4.639 4.930 -0.291 25155 9517 1 12 . 1 1 30 30 VAL C C 30 174.368 174.368 175.435 -1.067 25155 9518 1 12 . 1 1 30 30 VAL CA C 30 61.110 61.110 60.384 0.726 25155 9519 1 12 . 1 1 30 30 VAL CB C 30 34.500 34.500 35.173 -0.673 25155 9520 1 12 . 1 1 30 30 VAL H H 30 7.486 7.486 7.351 0.135 25155 9521 1 12 . 1 1 31 31 THR N N 31 124.000 124.000 120.623 3.377 25155 9522 1 12 . 1 1 31 31 THR HA H 31 4.331 4.331 4.667 -0.336 25155 9523 1 12 . 1 1 31 31 THR C C 31 172.670 172.670 173.257 -0.587 25155 9524 1 12 . 1 1 31 31 THR CA C 31 61.784 61.784 60.883 0.901 25155 9525 1 12 . 1 1 31 31 THR CB C 31 70.483 70.483 71.236 -0.753 25155 9526 1 12 . 1 1 31 31 THR H H 31 7.947 7.947 8.827 -0.880 25155 9527 1 12 . 1 1 32 32 LEU N N 32 127.408 127.408 126.655 0.753 25155 9528 1 12 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.385 0.252 25155 9529 1 12 . 1 1 32 32 LEU C C 32 176.425 176.425 176.419 0.006 25155 9530 1 12 . 1 1 32 32 LEU CA C 32 54.760 54.760 55.163 -0.403 25155 9531 1 12 . 1 1 32 32 LEU CB C 32 43.809 43.809 42.821 0.988 25155 9532 1 12 . 1 1 32 32 LEU H H 32 8.614 8.614 8.705 -0.091 25155 9533 1 12 . 1 1 33 33 HIS N N 33 120.230 120.230 123.493 -3.263 25155 9534 1 12 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.709 -0.289 25155 9535 1 12 . 1 1 33 33 HIS C C 33 171.914 171.914 174.152 -2.238 25155 9536 1 12 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.311 0.989 25155 9537 1 12 . 1 1 33 33 HIS CB C 33 32.050 32.050 31.132 0.918 25155 9538 1 12 . 1 1 33 33 HIS H H 33 9.130 9.130 8.991 0.139 25155 9539 1 12 . 1 1 34 34 ASN N N 34 123.987 123.987 121.071 2.916 25155 9540 1 12 . 1 1 34 34 ASN HA H 34 3.600 3.600 3.709 -0.109 25155 9541 1 12 . 1 1 34 34 ASN C C 34 177.930 177.930 175.562 2.368 25155 9542 1 12 . 1 1 34 34 ASN CA C 34 51.730 51.730 53.098 -1.368 25155 9543 1 12 . 1 1 34 34 ASN CB C 34 38.747 38.747 38.350 0.397 25155 9544 1 12 . 1 1 34 34 ASN H H 34 8.759 8.759 8.543 0.216 25155 9545 1 12 . 1 1 35 35 LEU N N 35 128.751 128.751 125.409 3.342 25155 9546 1 12 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.174 0.116 25155 9547 1 12 . 1 1 35 35 LEU C C 35 177.363 177.363 178.233 -0.870 25155 9548 1 12 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.527 0.023 25155 9549 1 12 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.733 1.029 25155 9550 1 12 . 1 1 35 35 LEU H H 35 8.758 8.758 8.576 0.182 25155 9551 1 12 . 1 1 36 36 LYS N N 36 120.870 120.870 118.546 2.324 25155 9552 1 12 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.096 -0.163 25155 9553 1 12 . 1 1 36 36 LYS C C 36 176.540 176.540 177.068 -0.528 25155 9554 1 12 . 1 1 36 36 LYS CA C 36 59.260 59.260 57.977 1.283 25155 9555 1 12 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.491 0.309 25155 9556 1 12 . 1 1 37 37 ASP N N 37 115.288 115.288 116.498 -1.210 25155 9557 1 12 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.700 0.047 25155 9558 1 12 . 1 1 37 37 ASP C C 37 175.500 175.500 176.287 -0.787 25155 9559 1 12 . 1 1 37 37 ASP CA C 37 54.805 54.805 55.004 -0.199 25155 9560 1 12 . 1 1 37 37 ASP CB C 37 44.650 44.650 42.935 1.715 25155 9561 1 12 . 1 1 38 38 ASP N N 38 121.550 121.550 118.771 2.779 25155 9562 1 12 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.970 -0.105 25155 9563 1 12 . 1 1 38 38 ASP C C 38 174.895 174.895 174.973 -0.078 25155 9564 1 12 . 1 1 38 38 ASP CA C 38 52.840 52.840 52.974 -0.134 25155 9565 1 12 . 1 1 38 38 ASP CB C 38 42.240 42.240 44.289 -2.049 25155 9566 1 12 . 1 1 39 39 SER N N 39 115.170 115.170 116.825 -1.655 25155 9567 1 12 . 1 1 39 39 SER HA H 39 4.600 4.600 4.770 -0.170 25155 9568 1 12 . 1 1 39 39 SER C C 39 174.930 174.930 174.214 0.716 25155 9569 1 12 . 1 1 39 39 SER CA C 39 54.786 54.786 56.884 -2.098 25155 9570 1 12 . 1 1 39 39 SER CB C 39 64.840 64.840 63.371 1.469 25155 9571 1 12 . 1 1 39 39 SER H H 39 8.330 8.330 8.662 -0.332 25155 9572 1 12 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.472 -0.472 25155 9573 1 12 . 1 1 40 40 PRO C C 40 176.620 176.620 177.931 -1.311 25155 9574 1 12 . 1 1 40 40 PRO CA C 40 63.870 63.870 64.898 -1.028 25155 9575 1 12 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.775 -0.415 25155 9576 1 12 . 1 1 41 41 LYS N N 41 120.913 120.913 117.930 2.983 25155 9577 1 12 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.166 -0.270 25155 9578 1 12 . 1 1 41 41 LYS C C 41 179.580 179.580 178.445 1.135 25155 9579 1 12 . 1 1 41 41 LYS CA C 41 58.000 58.000 57.781 0.219 25155 9580 1 12 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.177 0.923 25155 9581 1 12 . 1 1 42 42 LEU N N 42 118.206 118.206 120.705 -2.499 25155 9582 1 12 . 1 1 42 42 LEU HA H 42 4.025 4.025 3.843 0.182 25155 9583 1 12 . 1 1 42 42 LEU C C 42 178.630 178.630 178.320 0.310 25155 9584 1 12 . 1 1 42 42 LEU CA C 42 57.030 57.030 57.094 -0.064 25155 9585 1 12 . 1 1 42 42 LEU CB C 42 41.820 41.820 40.665 1.155 25155 9586 1 12 . 1 1 42 42 LEU H H 42 7.598 7.598 7.507 0.091 25155 9587 1 12 . 1 1 43 43 MET N N 43 118.913 118.913 115.877 3.036 25155 9588 1 12 . 1 1 43 43 MET HA H 43 3.760 3.760 4.121 -0.361 25155 9589 1 12 . 1 1 43 43 MET C C 43 177.710 177.710 176.925 0.785 25155 9590 1 12 . 1 1 43 43 MET CA C 43 59.864 59.864 58.072 1.792 25155 9591 1 12 . 1 1 43 43 MET CB C 43 32.680 32.680 32.116 0.564 25155 9592 1 12 . 1 1 43 43 MET H H 43 8.180 8.180 7.962 0.218 25155 9593 1 12 . 1 1 44 44 GLU N N 44 110.906 110.906 116.331 -5.425 25155 9594 1 12 . 1 1 44 44 GLU HA H 44 3.732 3.732 4.022 -0.290 25155 9595 1 12 . 1 1 44 44 GLU C C 44 178.120 178.120 179.330 -1.210 25155 9596 1 12 . 1 1 44 44 GLU CA C 44 59.450 59.450 58.494 0.956 25155 9597 1 12 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.691 0.109 25155 9598 1 12 . 1 1 45 45 GLN N N 45 115.770 115.770 118.378 -2.608 25155 9599 1 12 . 1 1 45 45 GLN HA H 45 4.190 4.190 3.952 0.238 25155 9600 1 12 . 1 1 45 45 GLN C C 45 175.480 175.480 176.988 -1.508 25155 9601 1 12 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.646 -1.546 25155 9602 1 12 . 1 1 45 45 GLN CB C 45 28.490 28.490 28.844 -0.354 25155 9603 1 12 . 1 1 45 45 GLN H H 45 7.517 7.517 7.226 0.291 25155 9604 1 12 . 1 1 46 46 TYR N N 46 117.840 117.840 118.292 -0.452 25155 9605 1 12 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.394 0.266 25155 9606 1 12 . 1 1 46 46 TYR C C 46 175.480 175.480 176.369 -0.889 25155 9607 1 12 . 1 1 46 46 TYR CA C 46 58.827 58.827 58.197 0.630 25155 9608 1 12 . 1 1 46 46 TYR CB C 46 41.720 41.720 38.145 3.575 25155 9609 1 12 . 1 1 46 46 TYR H H 46 6.955 6.955 7.094 -0.139 25155 9610 1 12 . 1 1 47 47 ASP N N 47 121.540 121.540 123.033 -1.493 25155 9611 1 12 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.651 0.045 25155 9612 1 12 . 1 1 47 47 ASP C C 47 175.677 175.677 175.751 -0.074 25155 9613 1 12 . 1 1 47 47 ASP CA C 47 56.812 56.812 56.627 0.185 25155 9614 1 12 . 1 1 47 47 ASP CB C 47 42.978 42.978 41.758 1.220 25155 9615 1 12 . 1 1 48 48 VAL N N 48 118.666 118.666 116.921 1.745 25155 9616 1 12 . 1 1 48 48 VAL HA H 48 5.057 5.057 4.988 0.069 25155 9617 1 12 . 1 1 48 48 VAL C C 48 174.180 174.180 174.230 -0.050 25155 9618 1 12 . 1 1 48 48 VAL CA C 48 60.000 60.000 60.993 -0.993 25155 9619 1 12 . 1 1 48 48 VAL CB C 48 36.200 36.200 34.317 1.883 25155 9620 1 12 . 1 1 48 48 VAL H H 48 7.631 7.631 7.676 -0.045 25155 9621 1 12 . 1 1 49 49 LEU N N 49 128.300 128.300 127.736 0.564 25155 9622 1 12 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.144 0.456 25155 9623 1 12 . 1 1 49 49 LEU C C 49 174.810 174.810 174.991 -0.181 25155 9624 1 12 . 1 1 49 49 LEU CA C 49 52.230 52.230 54.097 -1.867 25155 9625 1 12 . 1 1 49 49 LEU CB C 49 45.400 45.400 45.694 -0.294 25155 9626 1 12 . 1 1 49 49 LEU H H 49 9.469 9.469 8.944 0.525 25155 9627 1 12 . 1 1 50 50 ILE N N 50 124.400 124.400 127.798 -3.398 25155 9628 1 12 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.532 1.118 25155 9629 1 12 . 1 1 50 50 ILE C C 50 175.286 175.286 174.385 0.901 25155 9630 1 12 . 1 1 50 50 ILE CA C 50 59.900 59.900 61.476 -1.576 25155 9631 1 12 . 1 1 50 50 ILE CB C 50 40.200 40.200 39.647 0.553 25155 9632 1 12 . 1 1 50 50 ILE H H 50 9.213 9.213 9.325 -0.112 25155 9633 1 12 . 1 1 51 51 LEU N N 51 127.410 127.410 128.102 -0.692 25155 9634 1 12 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.539 1.531 25155 9635 1 12 . 1 1 51 51 LEU C C 51 174.540 174.540 175.544 -1.004 25155 9636 1 12 . 1 1 51 51 LEU CA C 51 52.950 52.950 53.295 -0.345 25155 9637 1 12 . 1 1 51 51 LEU CB C 51 43.190 43.190 44.015 -0.825 25155 9638 1 12 . 1 1 51 51 LEU H H 51 9.256 9.256 8.697 0.559 25155 9639 1 12 . 1 1 52 52 GLY N N 52 108.290 108.290 110.555 -2.265 25155 9640 1 12 . 1 1 52 52 GLY C C 52 174.330 174.330 171.303 3.027 25155 9641 1 12 . 1 1 52 52 GLY CA C 52 44.040 44.040 43.377 0.663 25155 9642 1 12 . 1 1 52 52 GLY H H 52 8.949 8.949 8.441 0.508 25155 9643 1 12 . 1 1 53 53 ILE N N 53 124.912 124.912 120.830 4.082 25155 9644 1 12 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.496 -0.321 25155 9645 1 12 . 1 1 53 53 ILE C C 53 174.470 174.470 173.055 1.415 25155 9646 1 12 . 1 1 53 53 ILE CA C 53 55.850 55.850 57.689 -1.839 25155 9647 1 12 . 1 1 53 53 ILE CB C 53 42.800 42.800 42.091 0.709 25155 9648 1 12 . 1 1 53 53 ILE H H 53 8.612 8.612 7.249 1.363 25155 9649 1 12 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.955 -0.143 25155 9650 1 12 . 1 1 54 54 PRO C C 54 174.565 174.565 176.217 -1.652 25155 9651 1 12 . 1 1 54 54 PRO CA C 54 61.850 61.850 61.862 -0.012 25155 9652 1 12 . 1 1 54 54 PRO CB C 54 32.400 32.400 32.286 0.114 25155 9653 1 12 . 1 1 55 55 THR N N 55 116.040 116.040 119.593 -3.553 25155 9654 1 12 . 1 1 55 55 THR HA H 55 4.522 4.522 4.480 0.042 25155 9655 1 12 . 1 1 55 55 THR C C 55 173.990 173.990 174.745 -0.755 25155 9656 1 12 . 1 1 55 55 THR CA C 55 62.845 62.845 62.589 0.256 25155 9657 1 12 . 1 1 55 55 THR CB C 55 70.795 70.795 69.925 0.870 25155 9658 1 12 . 1 1 55 55 THR H H 55 7.663 7.663 8.618 -0.955 25155 9659 1 12 . 1 1 56 56 TRP N N 56 130.540 130.540 125.882 4.658 25155 9660 1 12 . 1 1 56 56 TRP CA C 56 54.800 54.800 55.794 -0.994 25155 9661 1 12 . 1 1 56 56 TRP H H 56 9.075 9.075 8.190 0.885 25155 9662 1 12 . 1 1 58 58 PHE HA H 58 4.540 4.540 4.683 -0.143 25155 9663 1 12 . 1 1 58 58 PHE C C 58 177.070 177.070 174.482 2.588 25155 9664 1 12 . 1 1 58 58 PHE CA C 58 55.460 55.460 57.860 -2.400 25155 9665 1 12 . 1 1 58 58 PHE CB C 58 41.200 41.200 41.337 -0.136 25155 9666 1 12 . 1 1 59 59 GLY N N 59 109.796 109.796 113.344 -3.548 25155 9667 1 12 . 1 1 59 59 GLY CA C 59 45.763 45.763 44.340 1.423 25155 9668 1 12 . 1 1 59 59 GLY H H 59 8.392 8.392 7.891 0.501 25155 9669 1 12 . 1 1 60 60 GLU C C 60 175.660 175.660 174.753 0.907 25155 9670 1 12 . 1 1 61 61 ILE N N 61 122.380 122.380 118.800 3.580 25155 9671 1 12 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.332 1.108 25155 9672 1 12 . 1 1 61 61 ILE CA C 61 62.100 62.100 62.186 -0.086 25155 9673 1 12 . 1 1 61 61 ILE CB C 61 38.750 38.750 37.382 1.368 25155 9674 1 12 . 1 1 61 61 ILE H H 61 8.436 8.436 7.994 0.442 25155 9675 1 12 . 1 1 62 62 GLN CB C 62 30.570 30.570 31.489 -0.919 25155 9676 1 12 . 1 1 63 63 GLU HA H 63 4.030 4.030 3.997 0.033 25155 9677 1 12 . 1 1 63 63 GLU C C 63 177.134 177.134 177.984 -0.850 25155 9678 1 12 . 1 1 63 63 GLU CA C 63 60.520 60.520 60.192 0.328 25155 9679 1 12 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.616 0.033 25155 9680 1 12 . 1 1 64 64 ASP N N 64 119.630 119.630 117.731 1.899 25155 9681 1 12 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.498 0.094 25155 9682 1 12 . 1 1 64 64 ASP C C 64 178.680 178.680 176.880 1.800 25155 9683 1 12 . 1 1 64 64 ASP CA C 64 57.823 57.823 56.456 1.367 25155 9684 1 12 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.490 0.610 25155 9685 1 12 . 1 1 65 65 TRP N N 65 120.535 120.535 122.087 -1.552 25155 9686 1 12 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.597 -0.272 25155 9687 1 12 . 1 1 65 65 TRP C C 65 178.684 178.684 177.454 1.230 25155 9688 1 12 . 1 1 65 65 TRP CA C 65 60.500 60.500 60.997 -0.497 25155 9689 1 12 . 1 1 65 65 TRP CB C 65 30.100 30.100 30.971 -0.871 25155 9690 1 12 . 1 1 65 65 TRP H H 65 7.416 7.416 7.964 -0.548 25155 9691 1 12 . 1 1 66 66 GLU N N 66 120.760 120.760 120.906 -0.146 25155 9692 1 12 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.205 -0.385 25155 9693 1 12 . 1 1 66 66 GLU C C 66 178.860 178.860 178.896 -0.036 25155 9694 1 12 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.812 0.287 25155 9695 1 12 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.560 -0.550 25155 9696 1 12 . 1 1 67 67 ALA N N 67 118.972 118.972 121.541 -2.569 25155 9697 1 12 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.214 0.033 25155 9698 1 12 . 1 1 67 67 ALA C C 67 179.610 179.610 178.997 0.613 25155 9699 1 12 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.814 -0.214 25155 9700 1 12 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.863 -0.075 25155 9701 1 12 . 1 1 67 67 ALA H H 67 7.690 7.690 8.400 -0.710 25155 9702 1 12 . 1 1 68 68 VAL N N 68 107.530 107.530 110.407 -2.877 25155 9703 1 12 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.520 0.190 25155 9704 1 12 . 1 1 68 68 VAL C C 68 176.800 176.800 177.570 -0.770 25155 9705 1 12 . 1 1 68 68 VAL CA C 68 60.060 60.060 62.167 -2.107 25155 9706 1 12 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.536 0.064 25155 9707 1 12 . 1 1 68 68 VAL H H 68 7.240 7.240 7.401 -0.161 25155 9708 1 12 . 1 1 69 69 TRP N N 69 126.960 126.960 124.809 2.151 25155 9709 1 12 . 1 1 69 69 TRP HA H 69 4.182 4.182 3.941 0.241 25155 9710 1 12 . 1 1 69 69 TRP C C 69 178.640 178.640 176.721 1.919 25155 9711 1 12 . 1 1 69 69 TRP CA C 69 61.300 61.300 62.314 -1.014 25155 9712 1 12 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.311 2.259 25155 9713 1 12 . 1 1 69 69 TRP H H 69 7.810 7.810 8.368 -0.558 25155 9714 1 12 . 1 1 70 70 ASP N N 70 114.644 114.644 116.340 -1.696 25155 9715 1 12 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.095 0.424 25155 9716 1 12 . 1 1 70 70 ASP C C 70 178.685 178.685 178.234 0.451 25155 9717 1 12 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.397 -0.397 25155 9718 1 12 . 1 1 70 70 ASP CB C 70 39.810 39.810 40.953 -1.143 25155 9719 1 12 . 1 1 71 71 GLN N N 71 120.100 120.100 117.208 2.892 25155 9720 1 12 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.180 0.010 25155 9721 1 12 . 1 1 71 71 GLN C C 71 178.870 178.870 178.195 0.675 25155 9722 1 12 . 1 1 71 71 GLN CA C 71 57.617 57.617 57.353 0.264 25155 9723 1 12 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.325 -0.505 25155 9724 1 12 . 1 1 71 71 GLN H H 71 7.980 7.980 7.913 0.067 25155 9725 1 12 . 1 1 72 72 LEU N N 72 117.535 117.535 119.010 -1.475 25155 9726 1 12 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.911 -0.114 25155 9727 1 12 . 1 1 72 72 LEU C C 72 178.308 178.308 177.539 0.769 25155 9728 1 12 . 1 1 72 72 LEU CA C 72 57.340 57.340 56.637 0.703 25155 9729 1 12 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.562 0.138 25155 9730 1 12 . 1 1 72 72 LEU H H 72 7.435 7.435 7.422 0.013 25155 9731 1 12 . 1 1 73 73 ASP N N 73 115.534 115.534 117.130 -1.596 25155 9732 1 12 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.371 -0.221 25155 9733 1 12 . 1 1 73 73 ASP C C 73 177.553 177.553 176.983 0.570 25155 9734 1 12 . 1 1 73 73 ASP CA C 73 57.350 57.350 56.090 1.260 25155 9735 1 12 . 1 1 73 73 ASP CB C 73 40.040 40.040 41.491 -1.451 25155 9736 1 12 . 1 1 74 74 ASP N N 74 117.300 117.300 120.221 -2.921 25155 9737 1 12 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.450 0.256 25155 9738 1 12 . 1 1 74 74 ASP C C 74 176.424 176.424 177.254 -0.830 25155 9739 1 12 . 1 1 74 74 ASP CA C 74 54.170 54.170 55.596 -1.426 25155 9740 1 12 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.276 0.544 25155 9741 1 12 . 1 1 75 75 LEU N N 75 118.500 118.500 120.442 -1.942 25155 9742 1 12 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.163 0.132 25155 9743 1 12 . 1 1 75 75 LEU C C 75 176.800 176.800 176.647 0.153 25155 9744 1 12 . 1 1 75 75 LEU CA C 75 54.400 54.400 55.149 -0.749 25155 9745 1 12 . 1 1 75 75 LEU CB C 75 43.280 43.280 41.669 1.611 25155 9746 1 12 . 1 1 75 75 LEU H H 75 6.966 6.966 7.352 -0.386 25155 9747 1 12 . 1 1 76 76 ASN N N 76 123.040 123.040 121.036 2.004 25155 9748 1 12 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.622 0.240 25155 9749 1 12 . 1 1 76 76 ASN C C 76 174.927 174.927 174.270 0.657 25155 9750 1 12 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.785 -1.904 25155 9751 1 12 . 1 1 76 76 ASN CB C 76 37.510 37.510 38.715 -1.206 25155 9752 1 12 . 1 1 76 76 ASN H H 76 9.882 9.882 8.888 0.994 25155 9753 1 12 . 1 1 77 77 LEU N N 77 123.614 123.614 123.936 -0.322 25155 9754 1 12 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.600 -0.230 25155 9755 1 12 . 1 1 77 77 LEU C C 77 175.110 175.110 176.192 -1.082 25155 9756 1 12 . 1 1 77 77 LEU CA C 77 52.200 52.200 54.225 -2.025 25155 9757 1 12 . 1 1 77 77 LEU CB C 77 42.786 42.786 43.248 -0.462 25155 9758 1 12 . 1 1 77 77 LEU H H 77 8.700 8.700 8.333 0.367 25155 9759 1 12 . 1 1 78 78 GLU N N 78 120.822 120.822 121.569 -0.747 25155 9760 1 12 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.316 -0.416 25155 9761 1 12 . 1 1 78 78 GLU C C 78 178.670 178.670 178.035 0.635 25155 9762 1 12 . 1 1 78 78 GLU CA C 78 58.700 58.700 58.021 0.679 25155 9763 1 12 . 1 1 78 78 GLU CB C 78 29.467 29.467 29.468 -0.001 25155 9764 1 12 . 1 1 79 79 GLY N N 79 113.160 113.160 113.745 -0.585 25155 9765 1 12 . 1 1 79 79 GLY C C 79 174.523 174.523 173.745 0.778 25155 9766 1 12 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.443 -0.023 25155 9767 1 12 . 1 1 79 79 GLY H H 79 8.450 8.450 8.897 -0.447 25155 9768 1 12 . 1 1 80 80 LYS N N 80 120.283 120.283 120.285 -0.002 25155 9769 1 12 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.391 -0.033 25155 9770 1 12 . 1 1 80 80 LYS C C 80 175.304 175.304 176.040 -0.736 25155 9771 1 12 . 1 1 80 80 LYS CA C 80 56.890 56.890 56.241 0.649 25155 9772 1 12 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.621 -0.501 25155 9773 1 12 . 1 1 81 81 ILE N N 81 122.288 122.288 122.166 0.122 25155 9774 1 12 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.486 0.320 25155 9775 1 12 . 1 1 81 81 ILE C C 81 174.750 174.750 175.374 -0.624 25155 9776 1 12 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.465 -1.645 25155 9777 1 12 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.431 0.418 25155 9778 1 12 . 1 1 81 81 ILE H H 81 7.405 7.405 8.287 -0.882 25155 9779 1 12 . 1 1 82 82 VAL N N 82 127.793 127.793 126.101 1.692 25155 9780 1 12 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.175 0.105 25155 9781 1 12 . 1 1 82 82 VAL C C 82 172.680 172.680 174.451 -1.771 25155 9782 1 12 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.174 -0.074 25155 9783 1 12 . 1 1 82 82 VAL CB C 82 35.280 35.280 35.441 -0.161 25155 9784 1 12 . 1 1 82 82 VAL H H 82 8.800 8.800 9.115 -0.315 25155 9785 1 12 . 1 1 83 83 ALA N N 83 130.911 130.911 129.887 1.024 25155 9786 1 12 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.747 -0.358 25155 9787 1 12 . 1 1 83 83 ALA C C 83 175.870 175.870 176.325 -0.455 25155 9788 1 12 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.515 0.485 25155 9789 1 12 . 1 1 83 83 ALA CB C 83 23.722 23.722 22.346 1.376 25155 9790 1 12 . 1 1 83 83 ALA H H 83 9.252 9.252 9.045 0.207 25155 9791 1 12 . 1 1 84 84 LEU N N 84 124.269 124.269 121.976 2.293 25155 9792 1 12 . 1 1 84 84 LEU HA H 84 5.508 5.508 5.258 0.250 25155 9793 1 12 . 1 1 84 84 LEU C C 84 175.490 175.490 175.538 -0.048 25155 9794 1 12 . 1 1 84 84 LEU CA C 84 53.670 53.670 54.269 -0.599 25155 9795 1 12 . 1 1 84 84 LEU CB C 84 45.000 45.000 45.756 -0.756 25155 9796 1 12 . 1 1 84 84 LEU H H 84 10.378 10.378 8.640 1.738 25155 9797 1 12 . 1 1 85 85 TYR N N 85 115.826 115.826 119.421 -3.595 25155 9798 1 12 . 1 1 85 85 TYR HA H 85 4.950 4.950 5.252 -0.302 25155 9799 1 12 . 1 1 85 85 TYR C C 85 172.661 172.661 173.628 -0.967 25155 9800 1 12 . 1 1 85 85 TYR CA C 85 55.853 55.853 55.360 0.493 25155 9801 1 12 . 1 1 85 85 TYR CB C 85 43.200 43.200 41.207 1.993 25155 9802 1 12 . 1 1 85 85 TYR H H 85 9.200 9.200 8.648 0.552 25155 9803 1 12 . 1 1 86 86 GLY N N 86 106.802 106.802 105.168 1.634 25155 9804 1 12 . 1 1 86 86 GLY C C 86 170.348 170.348 170.888 -0.540 25155 9805 1 12 . 1 1 86 86 GLY CA C 86 44.687 44.687 44.943 -0.256 25155 9806 1 12 . 1 1 86 86 GLY H H 86 8.752 8.752 8.234 0.518 25155 9807 1 12 . 1 1 87 87 LEU N N 87 120.860 120.860 120.136 0.724 25155 9808 1 12 . 1 1 87 87 LEU HA H 87 5.476 5.476 5.276 0.200 25155 9809 1 12 . 1 1 87 87 LEU C C 87 177.720 177.720 174.797 2.923 25155 9810 1 12 . 1 1 87 87 LEU CA C 87 52.630 52.630 52.086 0.544 25155 9811 1 12 . 1 1 87 87 LEU CB C 87 45.900 45.900 45.700 0.200 25155 9812 1 12 . 1 1 87 87 LEU H H 87 6.320 6.320 7.768 -1.448 25155 9813 1 12 . 1 1 88 88 GLY N N 88 109.910 109.910 110.083 -0.173 25155 9814 1 12 . 1 1 88 88 GLY C C 88 171.386 171.386 171.585 -0.199 25155 9815 1 12 . 1 1 88 88 GLY CA C 88 45.710 45.710 45.666 0.044 25155 9816 1 12 . 1 1 88 88 GLY H H 88 8.320 8.320 7.988 0.332 25155 9817 1 12 . 1 1 89 89 ASP N N 89 121.580 121.580 119.776 1.804 25155 9818 1 12 . 1 1 89 89 ASP HA H 89 5.190 5.190 5.468 -0.278 25155 9819 1 12 . 1 1 89 89 ASP C C 89 176.608 176.608 176.511 0.097 25155 9820 1 12 . 1 1 89 89 ASP CA C 89 52.200 52.200 53.001 -0.801 25155 9821 1 12 . 1 1 89 89 ASP CB C 89 41.900 41.900 42.672 -0.772 25155 9822 1 12 . 1 1 90 90 GLN N N 90 123.900 123.900 125.592 -1.692 25155 9823 1 12 . 1 1 90 90 GLN HA H 90 3.645 3.645 3.978 -0.333 25155 9824 1 12 . 1 1 90 90 GLN C C 90 173.523 173.523 176.714 -3.191 25155 9825 1 12 . 1 1 90 90 GLN CA C 90 58.706 58.706 58.234 0.472 25155 9826 1 12 . 1 1 90 90 GLN CB C 90 28.800 28.800 28.663 0.137 25155 9827 1 12 . 1 1 90 90 GLN H H 90 8.726 8.726 9.229 -0.503 25155 9828 1 12 . 1 1 91 91 LEU N N 91 117.080 117.080 118.232 -1.152 25155 9829 1 12 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.228 0.242 25155 9830 1 12 . 1 1 91 91 LEU C C 91 179.840 179.840 178.866 0.974 25155 9831 1 12 . 1 1 91 91 LEU CA C 91 55.800 55.800 55.520 0.280 25155 9832 1 12 . 1 1 91 91 LEU CB C 91 41.640 41.640 41.881 -0.241 25155 9833 1 12 . 1 1 91 91 LEU H H 91 7.092 7.092 8.689 -1.597 25155 9834 1 12 . 1 1 92 92 GLY N N 92 110.460 110.460 106.696 3.764 25155 9835 1 12 . 1 1 92 92 GLY C C 92 174.824 174.824 174.790 0.034 25155 9836 1 12 . 1 1 92 92 GLY CA C 92 46.390 46.390 47.044 -0.654 25155 9837 1 12 . 1 1 92 92 GLY H H 92 9.243 9.243 7.626 1.617 25155 9838 1 12 . 1 1 93 93 TYR N N 93 118.140 118.140 119.263 -1.123 25155 9839 1 12 . 1 1 93 93 TYR HA H 93 5.173 5.173 4.564 0.610 25155 9840 1 12 . 1 1 93 93 TYR C C 93 177.805 177.805 177.159 0.646 25155 9841 1 12 . 1 1 93 93 TYR CA C 93 57.430 57.430 59.160 -1.730 25155 9842 1 12 . 1 1 93 93 TYR CB C 93 39.300 39.300 41.292 -1.992 25155 9843 1 12 . 1 1 93 93 TYR H H 93 7.252 7.252 7.665 -0.413 25155 9844 1 12 . 1 1 94 94 GLY N N 94 112.455 112.455 108.127 4.328 25155 9845 1 12 . 1 1 94 94 GLY C C 94 177.740 177.740 175.792 1.948 25155 9846 1 12 . 1 1 94 94 GLY CA C 94 49.880 49.880 46.839 3.041 25155 9847 1 12 . 1 1 94 94 GLY H H 94 8.154 8.154 8.843 -0.689 25155 9848 1 12 . 1 1 95 95 GLU N N 95 123.040 123.040 121.325 1.715 25155 9849 1 12 . 1 1 95 95 GLU HA H 95 4.000 4.000 4.208 -0.208 25155 9850 1 12 . 1 1 95 95 GLU C C 95 175.145 175.145 176.575 -1.430 25155 9851 1 12 . 1 1 95 95 GLU CA C 95 57.950 57.950 58.306 -0.355 25155 9852 1 12 . 1 1 95 95 GLU CB C 95 27.400 27.400 29.527 -2.127 25155 9853 1 12 . 1 1 96 96 TRP N N 96 118.000 118.000 116.132 1.868 25155 9854 1 12 . 1 1 96 96 TRP HA H 96 5.213 5.213 5.044 0.169 25155 9855 1 12 . 1 1 96 96 TRP C C 96 176.616 176.616 175.595 1.021 25155 9856 1 12 . 1 1 96 96 TRP CA C 96 57.120 57.120 54.704 2.416 25155 9857 1 12 . 1 1 96 96 TRP CB C 96 29.970 29.970 28.439 1.531 25155 9858 1 12 . 1 1 96 96 TRP H H 96 7.785 7.785 8.075 -0.290 25155 9859 1 12 . 1 1 97 97 PHE N N 97 123.268 123.268 122.970 0.298 25155 9860 1 12 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.451 0.209 25155 9861 1 12 . 1 1 97 97 PHE CA C 97 58.742 58.742 58.879 -0.137 25155 9862 1 12 . 1 1 97 97 PHE CB C 97 40.835 40.835 39.870 0.965 25155 9863 1 12 . 1 1 97 97 PHE H H 97 7.054 7.054 7.986 -0.932 25155 9864 1 12 . 1 1 98 98 LEU HA H 98 3.440 3.440 3.450 -0.010 25155 9865 1 12 . 1 1 98 98 LEU C C 98 176.613 176.613 176.582 0.031 25155 9866 1 12 . 1 1 98 98 LEU CA C 98 56.000 56.000 55.169 0.831 25155 9867 1 12 . 1 1 98 98 LEU CB C 98 38.600 38.600 38.800 -0.200 25155 9868 1 12 . 1 1 98 98 LEU H H 98 8.584 8.584 8.382 0.202 25155 9869 1 12 . 1 1 99 99 ASP N N 99 123.268 123.268 120.255 3.013 25155 9870 1 12 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.289 -0.324 25155 9871 1 12 . 1 1 99 99 ASP C C 99 178.876 178.876 177.038 1.838 25155 9872 1 12 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.477 1.783 25155 9873 1 12 . 1 1 99 99 ASP CB C 99 40.350 40.350 41.101 -0.751 25155 9874 1 12 . 1 1 100 100 ALA N N 100 119.124 119.124 121.214 -2.090 25155 9875 1 12 . 1 1 100 100 ALA HA H 100 3.822 3.822 3.918 -0.096 25155 9876 1 12 . 1 1 100 100 ALA C C 100 178.490 178.490 179.115 -0.625 25155 9877 1 12 . 1 1 100 100 ALA CA C 100 55.100 55.100 54.524 0.576 25155 9878 1 12 . 1 1 100 100 ALA CB C 100 19.700 19.700 18.007 1.693 25155 9879 1 12 . 1 1 100 100 ALA H H 100 8.400 8.400 7.572 0.828 25155 9880 1 12 . 1 1 101 101 LEU N N 101 118.687 118.687 120.062 -1.375 25155 9881 1 12 . 1 1 101 101 LEU HA H 101 3.674 3.674 3.922 -0.248 25155 9882 1 12 . 1 1 101 101 LEU C C 101 179.050 179.050 178.689 0.361 25155 9883 1 12 . 1 1 101 101 LEU CA C 101 57.800 57.800 57.074 0.726 25155 9884 1 12 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.572 1.078 25155 9885 1 12 . 1 1 101 101 LEU H H 101 6.518 6.518 7.433 -0.915 25155 9886 1 12 . 1 1 102 102 GLY N N 102 104.410 104.410 106.280 -1.870 25155 9887 1 12 . 1 1 102 102 GLY C C 102 176.056 176.056 175.790 0.266 25155 9888 1 12 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.149 0.601 25155 9889 1 12 . 1 1 102 102 GLY H H 102 7.712 7.712 7.945 -0.233 25155 9890 1 12 . 1 1 103 103 MET N N 103 120.550 120.550 122.377 -1.827 25155 9891 1 12 . 1 1 103 103 MET HA H 103 4.256 4.256 4.308 -0.052 25155 9892 1 12 . 1 1 103 103 MET C C 103 179.650 179.650 178.174 1.476 25155 9893 1 12 . 1 1 103 103 MET CA C 103 59.450 59.450 58.925 0.525 25155 9894 1 12 . 1 1 103 103 MET CB C 103 32.300 32.300 32.601 -0.301 25155 9895 1 12 . 1 1 103 103 MET H H 103 8.485 8.485 8.046 0.439 25155 9896 1 12 . 1 1 104 104 LEU N N 104 123.480 123.480 119.051 4.429 25155 9897 1 12 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.393 -0.332 25155 9898 1 12 . 1 1 104 104 LEU C C 104 177.750 177.750 178.752 -1.002 25155 9899 1 12 . 1 1 104 104 LEU CA C 104 58.100 58.100 57.739 0.361 25155 9900 1 12 . 1 1 104 104 LEU CB C 104 41.450 41.450 41.090 0.360 25155 9901 1 12 . 1 1 104 104 LEU H H 104 8.392 8.392 7.770 0.622 25155 9902 1 12 . 1 1 105 105 HIS N N 105 119.570 119.570 120.433 -0.863 25155 9903 1 12 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.165 -0.313 25155 9904 1 12 . 1 1 105 105 HIS C C 105 177.550 177.550 177.375 0.175 25155 9905 1 12 . 1 1 105 105 HIS CA C 105 61.000 61.000 60.956 0.044 25155 9906 1 12 . 1 1 105 105 HIS CB C 105 28.820 28.820 30.111 -1.291 25155 9907 1 12 . 1 1 105 105 HIS H H 105 8.247 8.247 8.110 0.137 25155 9908 1 12 . 1 1 106 106 ASP N N 106 119.780 119.780 120.066 -0.286 25155 9909 1 12 . 1 1 106 106 ASP HA H 106 4.333 4.333 4.367 -0.034 25155 9910 1 12 . 1 1 106 106 ASP C C 106 179.410 179.410 178.109 1.301 25155 9911 1 12 . 1 1 106 106 ASP CA C 106 57.800 57.800 57.354 0.446 25155 9912 1 12 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.100 -0.500 25155 9913 1 12 . 1 1 107 107 LYS N N 107 121.660 121.660 119.460 2.200 25155 9914 1 12 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.046 0.054 25155 9915 1 12 . 1 1 107 107 LYS C C 107 178.316 178.316 179.002 -0.686 25155 9916 1 12 . 1 1 107 107 LYS CA C 107 58.750 58.750 59.060 -0.310 25155 9917 1 12 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.575 -0.725 25155 9918 1 12 . 1 1 108 108 LEU N N 108 116.050 116.050 117.686 -1.636 25155 9919 1 12 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.396 -0.386 25155 9920 1 12 . 1 1 108 108 LEU C C 108 179.050 179.050 178.894 0.156 25155 9921 1 12 . 1 1 108 108 LEU CA C 108 56.240 56.240 56.351 -0.111 25155 9922 1 12 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.226 -0.426 25155 9923 1 12 . 1 1 108 108 LEU H H 108 8.072 8.072 8.105 -0.033 25155 9924 1 12 . 1 1 109 109 SER N N 109 116.280 116.280 115.068 1.212 25155 9925 1 12 . 1 1 109 109 SER HA H 109 4.300 4.300 4.337 -0.037 25155 9926 1 12 . 1 1 109 109 SER C C 109 175.848 175.848 175.413 0.435 25155 9927 1 12 . 1 1 109 109 SER CA C 109 62.410 62.410 61.848 0.562 25155 9928 1 12 . 1 1 109 109 SER CB C 109 62.850 62.850 63.038 -0.188 25155 9929 1 12 . 1 1 109 109 SER H H 109 8.366 8.366 8.218 0.148 25155 9930 1 12 . 1 1 110 110 THR N N 110 110.416 110.416 109.555 0.861 25155 9931 1 12 . 1 1 110 110 THR HA H 110 4.614 4.614 4.418 0.196 25155 9932 1 12 . 1 1 110 110 THR C C 110 175.675 175.675 175.617 0.058 25155 9933 1 12 . 1 1 110 110 THR CA C 110 62.030 62.030 62.994 -0.964 25155 9934 1 12 . 1 1 110 110 THR CB C 110 68.810 68.810 68.981 -0.171 25155 9935 1 12 . 1 1 110 110 THR H H 110 7.185 7.185 7.689 -0.504 25155 9936 1 12 . 1 1 111 111 LYS N N 111 120.090 120.090 121.143 -1.053 25155 9937 1 12 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.456 0.057 25155 9938 1 12 . 1 1 111 111 LYS C C 111 176.814 176.814 176.529 0.285 25155 9939 1 12 . 1 1 111 111 LYS CA C 111 55.730 55.730 55.577 0.153 25155 9940 1 12 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.521 -1.591 25155 9941 1 12 . 1 1 112 112 GLY N N 112 107.540 107.540 107.931 -0.391 25155 9942 1 12 . 1 1 112 112 GLY C C 112 176.223 176.223 174.249 1.974 25155 9943 1 12 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.388 1.538 25155 9944 1 12 . 1 1 112 112 GLY H H 112 8.315 8.315 7.645 0.670 25155 9945 1 12 . 1 1 113 113 VAL N N 113 113.536 113.536 114.882 -1.346 25155 9946 1 12 . 1 1 113 113 VAL HA H 113 4.494 4.494 4.310 0.184 25155 9947 1 12 . 1 1 113 113 VAL C C 113 174.560 174.560 174.730 -0.170 25155 9948 1 12 . 1 1 113 113 VAL CA C 113 59.550 59.550 60.896 -1.346 25155 9949 1 12 . 1 1 113 113 VAL CB C 113 32.800 32.800 32.321 0.479 25155 9950 1 12 . 1 1 113 113 VAL H H 113 6.835 6.835 7.007 -0.172 25155 9951 1 12 . 1 1 114 114 LYS N N 114 122.920 122.920 121.679 1.241 25155 9952 1 12 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.418 0.076 25155 9953 1 12 . 1 1 114 114 LYS C C 114 174.925 174.925 174.674 0.251 25155 9954 1 12 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.218 0.062 25155 9955 1 12 . 1 1 114 114 LYS CB C 114 33.630 33.630 34.724 -1.094 25155 9956 1 12 . 1 1 115 115 PHE N N 115 123.140 123.140 123.616 -0.476 25155 9957 1 12 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.537 0.163 25155 9958 1 12 . 1 1 115 115 PHE C C 115 177.580 177.580 176.013 1.567 25155 9959 1 12 . 1 1 115 115 PHE CA C 115 58.677 58.677 56.532 2.145 25155 9960 1 12 . 1 1 115 115 PHE CB C 115 41.120 41.120 40.474 0.646 25155 9961 1 12 . 1 1 115 115 PHE H H 115 8.506 8.506 8.427 0.079 25155 9962 1 12 . 1 1 116 116 VAL N N 116 115.737 115.737 116.672 -0.935 25155 9963 1 12 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.584 -0.106 25155 9964 1 12 . 1 1 116 116 VAL C C 116 175.300 175.300 175.722 -0.422 25155 9965 1 12 . 1 1 116 116 VAL CA C 116 58.877 58.877 60.084 -1.207 25155 9966 1 12 . 1 1 116 116 VAL CB C 116 34.120 34.120 35.022 -0.902 25155 9967 1 12 . 1 1 116 116 VAL H H 116 8.860 8.860 8.995 -0.135 25155 9968 1 12 . 1 1 117 117 GLY N N 117 108.137 108.137 110.621 -2.484 25155 9969 1 12 . 1 1 117 117 GLY C C 117 176.110 176.110 175.038 1.072 25155 9970 1 12 . 1 1 117 117 GLY CA C 117 47.500 47.500 45.750 1.750 25155 9971 1 12 . 1 1 117 117 GLY H H 117 9.838 9.838 9.556 0.282 25155 9972 1 12 . 1 1 118 118 TYR N N 118 120.380 120.380 120.223 0.157 25155 9973 1 12 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.758 0.212 25155 9974 1 12 . 1 1 118 118 TYR C C 118 177.630 177.630 175.761 1.869 25155 9975 1 12 . 1 1 118 118 TYR CA C 118 55.800 55.800 57.787 -1.987 25155 9976 1 12 . 1 1 118 118 TYR CB C 118 35.970 35.970 38.941 -2.971 25155 9977 1 12 . 1 1 118 118 TYR H H 118 8.652 8.652 8.054 0.598 25155 9978 1 12 . 1 1 119 119 TRP N N 119 126.040 126.040 122.858 3.182 25155 9979 1 12 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.167 0.854 25155 9980 1 12 . 1 1 119 119 TRP C C 119 173.000 173.000 173.793 -0.793 25155 9981 1 12 . 1 1 119 119 TRP CA C 119 53.820 53.820 53.889 -0.069 25155 9982 1 12 . 1 1 119 119 TRP CB C 119 36.050 36.050 33.534 2.516 25155 9983 1 12 . 1 1 119 119 TRP H H 119 8.070 8.070 8.716 -0.646 25155 9984 1 12 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.363 0.421 25155 9985 1 12 . 1 1 120 120 PRO C C 120 176.870 176.870 176.697 0.173 25155 9986 1 12 . 1 1 120 120 PRO CA C 120 63.780 63.780 63.300 0.480 25155 9987 1 12 . 1 1 120 120 PRO CB C 120 31.990 31.990 31.826 0.164 25155 9988 1 12 . 1 1 121 121 THR N N 121 109.310 109.310 113.023 -3.713 25155 9989 1 12 . 1 1 121 121 THR HA H 121 4.073 4.073 3.943 0.130 25155 9990 1 12 . 1 1 121 121 THR C C 121 176.324 176.324 175.451 0.873 25155 9991 1 12 . 1 1 121 121 THR CA C 121 61.250 61.250 63.464 -2.214 25155 9992 1 12 . 1 1 121 121 THR CB C 121 69.730 69.730 69.030 0.700 25155 9993 1 12 . 1 1 121 121 THR H H 121 7.370 7.370 8.283 -0.913 25155 9994 1 12 . 1 1 122 122 GLU N N 122 123.937 123.937 121.671 2.266 25155 9995 1 12 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.082 0.142 25155 9996 1 12 . 1 1 122 122 GLU C C 122 177.737 177.737 177.549 0.188 25155 9997 1 12 . 1 1 122 122 GLU CA C 122 58.200 58.200 57.641 0.559 25155 9998 1 12 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.459 0.341 25155 9999 1 12 . 1 1 123 123 GLY N N 123 114.563 114.563 111.819 2.744 25155 10000 1 12 . 1 1 123 123 GLY C C 123 173.783 173.783 174.243 -0.460 25155 10001 1 12 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.219 0.161 25155 10002 1 12 . 1 1 123 123 GLY H H 123 9.144 9.144 8.757 0.387 25155 10003 1 12 . 1 1 124 124 TYR N N 124 118.800 118.800 120.720 -1.920 25155 10004 1 12 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.783 0.435 25155 10005 1 12 . 1 1 124 124 TYR C C 124 175.673 175.673 176.113 -0.440 25155 10006 1 12 . 1 1 124 124 TYR CA C 124 56.950 56.950 58.487 -1.537 25155 10007 1 12 . 1 1 124 124 TYR CB C 124 41.100 41.100 40.346 0.754 25155 10008 1 12 . 1 1 124 124 TYR H H 124 7.895 7.895 8.077 -0.182 25155 10009 1 12 . 1 1 125 125 GLU N N 125 124.790 124.790 124.257 0.533 25155 10010 1 12 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.690 -0.005 25155 10011 1 12 . 1 1 125 125 GLU C C 125 172.877 172.877 175.036 -2.159 25155 10012 1 12 . 1 1 125 125 GLU CA C 125 55.700 55.700 55.629 0.071 25155 10013 1 12 . 1 1 125 125 GLU CB C 125 31.340 31.340 31.231 0.109 25155 10014 1 12 . 1 1 126 126 PHE N N 126 118.670 118.670 119.281 -0.611 25155 10015 1 12 . 1 1 126 126 PHE HA H 126 4.841 4.841 4.929 -0.088 25155 10016 1 12 . 1 1 126 126 PHE C C 126 173.800 173.800 173.843 -0.043 25155 10017 1 12 . 1 1 126 126 PHE CA C 126 56.950 56.950 56.756 0.194 25155 10018 1 12 . 1 1 126 126 PHE CB C 126 40.300 40.300 40.716 -0.416 25155 10019 1 12 . 1 1 126 126 PHE H H 126 7.645 7.645 7.910 -0.265 25155 10020 1 12 . 1 1 127 127 THR N N 127 107.038 107.038 114.313 -7.275 25155 10021 1 12 . 1 1 127 127 THR HA H 127 4.370 4.370 4.207 0.163 25155 10022 1 12 . 1 1 127 127 THR C C 127 175.100 175.100 174.372 0.728 25155 10023 1 12 . 1 1 127 127 THR CA C 127 61.080 61.080 61.438 -0.358 25155 10024 1 12 . 1 1 127 127 THR CB C 127 70.500 70.500 69.090 1.410 25155 10025 1 12 . 1 1 127 127 THR H H 127 7.306 7.306 8.645 -1.339 25155 10026 1 12 . 1 1 128 128 SER N N 128 118.150 118.150 118.967 -0.817 25155 10027 1 12 . 1 1 128 128 SER HA H 128 4.650 4.650 4.841 -0.191 25155 10028 1 12 . 1 1 128 128 SER C C 128 175.760 175.760 174.204 1.556 25155 10029 1 12 . 1 1 128 128 SER CA C 128 55.813 55.813 57.396 -1.583 25155 10030 1 12 . 1 1 128 128 SER CB C 128 65.300 65.300 63.691 1.609 25155 10031 1 12 . 1 1 128 128 SER H H 128 7.354 7.354 8.062 -0.708 25155 10032 1 12 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.520 0.244 25155 10033 1 12 . 1 1 129 129 PRO C C 129 178.860 178.860 178.348 0.512 25155 10034 1 12 . 1 1 129 129 PRO CA C 129 62.728 62.728 64.625 -1.897 25155 10035 1 12 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.400 0.000 25155 10036 1 12 . 1 1 130 130 LYS N N 130 122.158 122.158 119.394 2.764 25155 10037 1 12 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.159 0.051 25155 10038 1 12 . 1 1 130 130 LYS C C 130 176.890 176.890 175.664 1.226 25155 10039 1 12 . 1 1 130 130 LYS CA C 130 61.375 61.375 60.548 0.827 25155 10040 1 12 . 1 1 130 130 LYS CB C 130 30.350 30.350 31.180 -0.830 25155 10041 1 12 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.418 0.115 25155 10042 1 12 . 1 1 131 131 PRO C C 131 173.810 173.810 175.600 -1.790 25155 10043 1 12 . 1 1 131 131 PRO CA C 131 64.510 64.510 63.169 1.341 25155 10044 1 12 . 1 1 131 131 PRO CB C 131 31.745 31.745 31.342 0.403 25155 10045 1 12 . 1 1 132 132 VAL N N 132 114.480 114.480 113.757 0.723 25155 10046 1 12 . 1 1 132 132 VAL HA H 132 5.158 5.158 5.172 -0.014 25155 10047 1 12 . 1 1 132 132 VAL C C 132 175.137 175.137 174.316 0.821 25155 10048 1 12 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.140 0.660 25155 10049 1 12 . 1 1 132 132 VAL CB C 132 34.780 34.780 35.615 -0.835 25155 10050 1 12 . 1 1 132 132 VAL H H 132 6.716 6.716 7.678 -0.962 25155 10051 1 12 . 1 1 133 133 ILE N N 133 120.670 120.670 112.466 8.204 25155 10052 1 12 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.606 -0.214 25155 10053 1 12 . 1 1 133 133 ILE C C 133 175.485 175.485 175.065 0.420 25155 10054 1 12 . 1 1 133 133 ILE CA C 133 60.000 60.000 59.364 0.636 25155 10055 1 12 . 1 1 133 133 ILE CB C 133 42.020 42.020 41.101 0.919 25155 10056 1 12 . 1 1 133 133 ILE H H 133 8.740 8.740 8.326 0.414 25155 10057 1 12 . 1 1 134 134 ALA N N 134 122.454 122.454 124.640 -2.186 25155 10058 1 12 . 1 1 134 134 ALA HA H 134 3.953 3.953 3.958 -0.005 25155 10059 1 12 . 1 1 134 134 ALA C C 134 178.387 178.387 176.765 1.622 25155 10060 1 12 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.433 -0.383 25155 10061 1 12 . 1 1 134 134 ALA CB C 134 16.982 16.982 16.936 0.047 25155 10062 1 12 . 1 1 134 134 ALA H H 134 8.490 8.490 8.595 -0.105 25155 10063 1 12 . 1 1 135 135 ASP N N 135 117.310 117.310 116.402 0.908 25155 10064 1 12 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.343 -0.099 25155 10065 1 12 . 1 1 135 135 ASP C C 135 176.390 176.390 176.890 -0.500 25155 10066 1 12 . 1 1 135 135 ASP CA C 135 55.120 55.120 54.341 0.779 25155 10067 1 12 . 1 1 135 135 ASP CB C 135 39.865 39.865 40.269 -0.404 25155 10068 1 12 . 1 1 136 136 GLY N N 136 104.336 104.336 104.391 -0.055 25155 10069 1 12 . 1 1 136 136 GLY C C 136 174.940 174.940 174.891 0.049 25155 10070 1 12 . 1 1 136 136 GLY CA C 136 45.150 45.150 45.172 -0.022 25155 10071 1 12 . 1 1 136 136 GLY H H 136 7.592 7.592 7.900 -0.308 25155 10072 1 12 . 1 1 137 137 GLN N N 137 118.675 118.675 120.654 -1.979 25155 10073 1 12 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.318 -0.256 25155 10074 1 12 . 1 1 137 137 GLN C C 137 176.420 176.420 174.695 1.725 25155 10075 1 12 . 1 1 137 137 GLN CA C 137 57.760 57.760 57.305 0.455 25155 10076 1 12 . 1 1 137 137 GLN CB C 137 30.400 30.400 30.340 0.060 25155 10077 1 12 . 1 1 137 137 GLN H H 137 7.843 7.843 8.049 -0.206 25155 10078 1 12 . 1 1 138 138 LEU N N 138 118.160 118.160 118.529 -0.369 25155 10079 1 12 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.569 0.392 25155 10080 1 12 . 1 1 138 138 LEU C C 138 175.700 175.700 174.356 1.344 25155 10081 1 12 . 1 1 138 138 LEU CA C 138 53.705 53.705 54.400 -0.695 25155 10082 1 12 . 1 1 138 138 LEU CB C 138 46.480 46.480 45.903 0.577 25155 10083 1 12 . 1 1 138 138 LEU H H 138 7.356 7.356 7.296 0.060 25155 10084 1 12 . 1 1 139 139 PHE N N 139 119.060 119.060 122.008 -2.948 25155 10085 1 12 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.915 0.429 25155 10086 1 12 . 1 1 139 139 PHE C C 139 178.850 178.850 177.342 1.508 25155 10087 1 12 . 1 1 139 139 PHE CA C 139 56.670 56.670 57.248 -0.578 25155 10088 1 12 . 1 1 139 139 PHE CB C 139 43.652 43.652 39.789 3.863 25155 10089 1 12 . 1 1 139 139 PHE H H 139 10.026 10.026 9.208 0.818 25155 10090 1 12 . 1 1 140 140 VAL N N 140 109.905 109.905 118.329 -8.424 25155 10091 1 12 . 1 1 140 140 VAL HA H 140 3.500 3.500 2.787 0.713 25155 10092 1 12 . 1 1 140 140 VAL C C 140 172.860 172.860 174.600 -1.740 25155 10093 1 12 . 1 1 140 140 VAL CA C 140 61.812 61.812 61.964 -0.152 25155 10094 1 12 . 1 1 140 140 VAL CB C 140 30.250 30.250 30.449 -0.199 25155 10095 1 12 . 1 1 140 140 VAL H H 140 7.550 7.550 8.364 -0.814 25155 10096 1 12 . 1 1 141 141 GLY N N 141 106.600 106.600 106.293 0.307 25155 10097 1 12 . 1 1 141 141 GLY C C 141 171.350 171.350 172.764 -1.414 25155 10098 1 12 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.177 1.283 25155 10099 1 12 . 1 1 141 141 GLY H H 141 7.052 7.052 7.151 -0.099 25155 10100 1 12 . 1 1 142 142 LEU N N 142 117.820 117.820 119.927 -2.107 25155 10101 1 12 . 1 1 142 142 LEU HA H 142 4.962 4.962 3.805 1.157 25155 10102 1 12 . 1 1 142 142 LEU CA C 142 55.600 55.600 54.586 1.014 25155 10103 1 12 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.358 -4.428 25155 10104 1 12 . 1 1 142 142 LEU H H 142 7.643 7.643 8.336 -0.693 25155 10105 1 12 . 1 1 143 143 ALA HA H 143 4.220 4.220 3.873 0.347 25155 10106 1 12 . 1 1 143 143 ALA C C 143 175.505 175.505 175.786 -0.281 25155 10107 1 12 . 1 1 143 143 ALA CA C 143 49.600 49.600 50.609 -1.009 25155 10108 1 12 . 1 1 143 143 ALA CB C 143 23.330 23.330 18.759 4.571 25155 10109 1 12 . 1 1 144 144 LEU N N 144 124.960 124.960 121.924 3.036 25155 10110 1 12 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.593 0.187 25155 10111 1 12 . 1 1 144 144 LEU C C 144 174.700 174.700 175.776 -1.076 25155 10112 1 12 . 1 1 144 144 LEU CA C 144 52.790 52.790 53.581 -0.791 25155 10113 1 12 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.029 0.271 25155 10114 1 12 . 1 1 144 144 LEU H H 144 8.583 8.583 7.800 0.783 25155 10115 1 12 . 1 1 145 145 ASP N N 145 119.100 119.100 120.781 -1.681 25155 10116 1 12 . 1 1 145 145 ASP HA H 145 5.422 5.422 5.353 0.069 25155 10117 1 12 . 1 1 145 145 ASP C C 145 176.180 176.180 175.973 0.207 25155 10118 1 12 . 1 1 145 145 ASP CA C 145 53.600 53.600 53.072 0.528 25155 10119 1 12 . 1 1 145 145 ASP CB C 145 43.180 43.180 44.241 -1.061 25155 10120 1 12 . 1 1 147 147 THR HA H 147 4.093 4.093 4.438 -0.345 25155 10121 1 12 . 1 1 147 147 THR C C 147 175.858 175.858 176.145 -0.287 25155 10122 1 12 . 1 1 147 147 THR CA C 147 66.400 66.400 63.725 2.675 25155 10123 1 12 . 1 1 147 147 THR CB C 147 69.400 69.400 70.566 -1.166 25155 10124 1 12 . 1 1 147 147 THR H H 147 8.745 8.745 8.640 0.105 25155 10125 1 12 . 1 1 148 148 ASN N N 148 115.408 115.408 119.048 -3.640 25155 10126 1 12 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.687 0.323 25155 10127 1 12 . 1 1 148 148 ASN C C 148 175.750 175.750 174.761 0.989 25155 10128 1 12 . 1 1 148 148 ASN CA C 148 53.400 53.400 55.075 -1.675 25155 10129 1 12 . 1 1 148 148 ASN CB C 148 41.900 41.900 39.380 2.520 25155 10130 1 12 . 1 1 148 148 ASN H H 148 8.975 8.975 8.898 0.077 25155 10131 1 12 . 1 1 149 149 GLN N N 149 117.900 117.900 116.374 1.526 25155 10132 1 12 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.567 0.369 25155 10133 1 12 . 1 1 149 149 GLN C C 149 178.280 178.280 174.928 3.352 25155 10134 1 12 . 1 1 149 149 GLN CA C 149 53.730 53.730 55.075 -1.345 25155 10135 1 12 . 1 1 149 149 GLN CB C 149 29.790 29.790 32.337 -2.547 25155 10136 1 12 . 1 1 149 149 GLN H H 149 7.430 7.430 7.659 -0.229 25155 10137 1 12 . 1 1 150 150 TYR N N 150 121.060 121.060 121.902 -0.842 25155 10138 1 12 . 1 1 150 150 TYR HA H 150 4.671 4.671 4.596 0.075 25155 10139 1 12 . 1 1 150 150 TYR C C 150 178.680 178.680 176.071 2.609 25155 10140 1 12 . 1 1 150 150 TYR CA C 150 57.930 57.930 59.785 -1.855 25155 10141 1 12 . 1 1 150 150 TYR CB C 150 38.860 38.860 39.950 -1.091 25155 10142 1 12 . 1 1 150 150 TYR H H 150 8.115 8.115 8.638 -0.523 25155 10143 1 12 . 1 1 151 151 ASP N N 151 121.175 121.175 120.552 0.623 25155 10144 1 12 . 1 1 151 151 ASP CA C 151 57.000 57.000 56.609 0.391 25155 10145 1 12 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.737 1.263 25155 10146 1 12 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.175 0.415 25155 10147 1 12 . 1 1 152 152 LEU C C 152 178.300 178.300 177.630 0.670 25155 10148 1 12 . 1 1 152 152 LEU CA C 152 54.788 54.788 56.426 -1.638 25155 10149 1 12 . 1 1 152 152 LEU CB C 152 42.200 42.200 41.844 0.356 25155 10150 1 12 . 1 1 153 153 SER N N 153 116.170 116.170 115.753 0.417 25155 10151 1 12 . 1 1 153 153 SER HA H 153 3.911 3.911 4.036 -0.125 25155 10152 1 12 . 1 1 153 153 SER CA C 153 63.400 63.400 61.707 1.693 25155 10153 1 12 . 1 1 153 153 SER CB C 153 63.200 63.200 62.914 0.286 25155 10154 1 12 . 1 1 153 153 SER H H 153 7.378 7.378 7.860 -0.482 25155 10155 1 12 . 1 1 154 154 ASP N N 154 121.640 121.640 121.438 0.202 25155 10156 1 12 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.289 -0.049 25155 10157 1 12 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.345 1.955 25155 10158 1 12 . 1 1 154 154 ASP CB C 154 40.000 40.000 40.911 -0.911 25155 10159 1 12 . 1 1 155 155 GLU HA H 155 4.170 4.170 3.949 0.221 25155 10160 1 12 . 1 1 155 155 GLU C C 155 179.420 179.420 178.993 0.427 25155 10161 1 12 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.256 -0.056 25155 10162 1 12 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.709 -0.230 25155 10163 1 12 . 1 1 156 156 ARG N N 156 121.230 121.230 119.000 2.230 25155 10164 1 12 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.156 0.120 25155 10165 1 12 . 1 1 156 156 ARG C C 156 177.350 177.350 179.203 -1.853 25155 10166 1 12 . 1 1 156 156 ARG CA C 156 59.950 59.950 58.821 1.129 25155 10167 1 12 . 1 1 156 156 ARG CB C 156 31.100 31.100 29.775 1.325 25155 10168 1 12 . 1 1 157 157 ILE N N 157 118.190 118.190 120.359 -2.169 25155 10169 1 12 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.518 -0.088 25155 10170 1 12 . 1 1 157 157 ILE C C 157 178.480 178.480 178.048 0.432 25155 10171 1 12 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.485 1.075 25155 10172 1 12 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.610 0.870 25155 10173 1 12 . 1 1 157 157 ILE H H 157 8.705 8.705 8.119 0.586 25155 10174 1 12 . 1 1 158 158 GLN N N 158 119.975 119.975 120.595 -0.620 25155 10175 1 12 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.889 0.067 25155 10176 1 12 . 1 1 158 158 GLN C C 158 178.730 178.730 178.347 0.383 25155 10177 1 12 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.585 1.115 25155 10178 1 12 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.395 0.087 25155 10179 1 12 . 1 1 158 158 GLN H H 158 8.262 8.262 8.623 -0.361 25155 10180 1 12 . 1 1 159 159 SER N N 159 115.466 115.466 115.056 0.410 25155 10181 1 12 . 1 1 159 159 SER HA H 159 4.446 4.446 4.282 0.164 25155 10182 1 12 . 1 1 159 159 SER C C 159 177.320 177.320 176.927 0.393 25155 10183 1 12 . 1 1 159 159 SER CA C 159 63.500 63.500 61.081 2.418 25155 10184 1 12 . 1 1 159 159 SER CB C 159 63.818 63.818 63.115 0.703 25155 10185 1 12 . 1 1 159 159 SER H H 159 8.440 8.440 8.064 0.376 25155 10186 1 12 . 1 1 160 160 TRP N N 160 126.784 126.784 125.010 1.774 25155 10187 1 12 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.561 -0.107 25155 10188 1 12 . 1 1 160 160 TRP C C 160 177.934 177.934 177.587 0.347 25155 10189 1 12 . 1 1 160 160 TRP CA C 160 62.745 62.745 62.094 0.651 25155 10190 1 12 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.072 0.278 25155 10191 1 12 . 1 1 160 160 TRP H H 160 9.243 9.243 7.734 1.509 25155 10192 1 12 . 1 1 161 161 CYS N N 161 116.395 116.395 118.446 -2.051 25155 10193 1 12 . 1 1 161 161 CYS HA H 161 3.886 3.886 3.573 0.313 25155 10194 1 12 . 1 1 161 161 CYS C C 161 176.245 176.245 177.036 -0.791 25155 10195 1 12 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.498 0.802 25155 10196 1 12 . 1 1 161 161 CYS CB C 161 27.723 27.723 27.035 0.688 25155 10197 1 12 . 1 1 161 161 CYS H H 161 8.845 8.845 8.816 0.029 25155 10198 1 12 . 1 1 162 162 GLU N N 162 118.030 118.030 119.567 -1.537 25155 10199 1 12 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.849 0.071 25155 10200 1 12 . 1 1 162 162 GLU C C 162 178.700 178.700 178.670 0.030 25155 10201 1 12 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.529 0.271 25155 10202 1 12 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.271 0.229 25155 10203 1 12 . 1 1 163 163 GLN N N 163 120.650 120.650 119.665 0.985 25155 10204 1 12 . 1 1 163 163 GLN HA H 163 4.173 4.173 4.076 0.097 25155 10205 1 12 . 1 1 163 163 GLN C C 163 179.700 179.700 178.581 1.119 25155 10206 1 12 . 1 1 163 163 GLN CA C 163 59.688 59.688 59.036 0.652 25155 10207 1 12 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.860 0.040 25155 10208 1 12 . 1 1 163 163 GLN H H 163 8.148 8.148 7.938 0.210 25155 10209 1 12 . 1 1 164 164 ILE N N 164 114.836 114.836 116.438 -1.602 25155 10210 1 12 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.711 0.349 25155 10211 1 12 . 1 1 164 164 ILE C C 164 178.676 178.676 177.544 1.132 25155 10212 1 12 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.467 1.693 25155 10213 1 12 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.327 0.303 25155 10214 1 12 . 1 1 164 164 ILE H H 164 8.958 8.958 8.348 0.610 25155 10215 1 12 . 1 1 165 165 LEU N N 165 123.700 123.700 120.229 3.471 25155 10216 1 12 . 1 1 165 165 LEU HA H 165 4.100 4.100 4.104 -0.004 25155 10217 1 12 . 1 1 165 165 LEU C C 165 180.548 180.548 178.318 2.230 25155 10218 1 12 . 1 1 165 165 LEU CA C 165 58.150 58.150 57.767 0.383 25155 10219 1 12 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.376 -0.246 25155 10220 1 12 . 1 1 165 165 LEU H H 165 7.830 7.830 7.508 0.322 25155 10221 1 12 . 1 1 166 166 ASN N N 166 120.160 120.160 118.699 1.461 25155 10222 1 12 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.325 0.245 25155 10223 1 12 . 1 1 166 166 ASN C C 166 175.690 175.690 177.015 -1.325 25155 10224 1 12 . 1 1 166 166 ASN CA C 166 55.946 55.946 56.616 -0.670 25155 10225 1 12 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.591 -0.111 25155 10226 1 12 . 1 1 166 166 ASN H H 166 7.706 7.706 8.079 -0.373 25155 10227 1 12 . 1 1 167 167 GLU N N 167 121.286 121.286 120.569 0.717 25155 10228 1 12 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.051 0.053 25155 10229 1 12 . 1 1 167 167 GLU C C 167 180.520 180.520 179.201 1.319 25155 10230 1 12 . 1 1 167 167 GLU CA C 167 59.920 59.920 59.249 0.671 25155 10231 1 12 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.730 1.195 25155 10232 1 12 . 1 1 168 168 MET N N 168 118.622 118.622 115.141 3.481 25155 10233 1 12 . 1 1 168 168 MET HA H 168 3.996 3.996 4.490 -0.494 25155 10234 1 12 . 1 1 168 168 MET C C 168 176.856 176.856 177.315 -0.459 25155 10235 1 12 . 1 1 168 168 MET CA C 168 59.500 59.500 58.255 1.245 25155 10236 1 12 . 1 1 168 168 MET CB C 168 33.700 33.700 32.821 0.879 25155 10237 1 12 . 1 1 168 168 MET H H 168 8.723 8.723 8.284 0.439 25155 10238 1 12 . 1 1 169 169 ALA N N 169 121.760 121.760 122.389 -0.629 25155 10239 1 12 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.241 -0.085 25155 10240 1 12 . 1 1 169 169 ALA C C 169 179.790 179.790 180.480 -0.690 25155 10241 1 12 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.016 0.784 25155 10242 1 12 . 1 1 169 169 ALA CB C 169 18.220 18.220 18.966 -0.746 25155 10243 1 12 . 1 1 169 169 ALA H H 169 7.494 7.494 7.580 -0.086 25155 10244 1 12 . 1 1 170 170 GLU N N 170 116.970 116.970 119.270 -2.300 25155 10245 1 12 . 1 1 170 170 GLU HA H 170 4.091 4.091 4.055 0.036 25155 10246 1 12 . 1 1 170 170 GLU C C 170 177.745 177.745 179.063 -1.318 25155 10247 1 12 . 1 1 170 170 GLU CA C 170 58.000 58.000 59.171 -1.171 25155 10248 1 12 . 1 1 170 170 GLU CB C 170 29.730 29.730 29.174 0.556 25155 10249 1 12 . 1 1 171 171 HIS N N 171 118.150 118.150 118.703 -0.553 25155 10250 1 12 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.424 0.046 25155 10251 1 12 . 1 1 171 171 HIS C C 171 175.848 175.848 176.566 -0.718 25155 10252 1 12 . 1 1 171 171 HIS CA C 171 57.600 57.600 58.069 -0.469 25155 10253 1 12 . 1 1 171 171 HIS CB C 171 30.800 30.800 29.844 0.956 25155 10254 1 12 . 1 1 171 171 HIS H H 171 7.717 7.717 7.823 -0.106 25155 10255 1 12 . 1 1 172 172 TYR N N 172 119.483 119.483 118.903 0.580 25155 10256 1 12 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.253 0.338 25155 10257 1 12 . 1 1 172 172 TYR C C 172 174.590 174.590 175.578 -0.988 25155 10258 1 12 . 1 1 172 172 TYR CA C 172 57.813 57.813 58.832 -1.019 25155 10259 1 12 . 1 1 172 172 TYR CB C 172 38.900 38.900 38.733 0.167 25155 10260 1 12 . 1 1 172 172 TYR H H 172 7.778 7.778 7.746 0.032 25155 10261 1 13 . 1 1 2 2 ASN N N 2 122.966 122.966 121.119 1.847 25155 10262 1 13 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.179 -0.004 25155 10263 1 13 . 1 1 2 2 ASN C C 2 175.200 175.200 172.865 2.335 25155 10264 1 13 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.340 0.580 25155 10265 1 13 . 1 1 2 2 ASN CB C 2 40.000 40.000 41.497 -1.497 25155 10266 1 13 . 1 1 2 2 ASN H H 2 9.392 9.392 8.297 1.095 25155 10267 1 13 . 1 1 3 3 MET N N 3 120.660 120.660 116.971 3.689 25155 10268 1 13 . 1 1 3 3 MET HA H 3 5.565 5.565 5.160 0.405 25155 10269 1 13 . 1 1 3 3 MET C C 3 174.200 174.200 175.654 -1.454 25155 10270 1 13 . 1 1 3 3 MET CA C 3 54.550 54.550 54.439 0.111 25155 10271 1 13 . 1 1 3 3 MET CB C 3 34.100 34.100 35.602 -1.502 25155 10272 1 13 . 1 1 3 3 MET H H 3 8.745 8.745 9.138 -0.393 25155 10273 1 13 . 1 1 4 4 GLY N N 4 115.792 115.792 109.772 6.020 25155 10274 1 13 . 1 1 4 4 GLY C C 4 170.444 170.444 171.857 -1.413 25155 10275 1 13 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.181 -0.294 25155 10276 1 13 . 1 1 4 4 GLY H H 4 8.989 8.989 8.781 0.208 25155 10277 1 13 . 1 1 5 5 LEU N N 5 131.175 131.175 126.290 4.885 25155 10278 1 13 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.218 1.104 25155 10279 1 13 . 1 1 5 5 LEU C C 5 175.700 175.700 174.618 1.082 25155 10280 1 13 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.453 -0.133 25155 10281 1 13 . 1 1 5 5 LEU CB C 5 44.700 44.700 43.587 1.113 25155 10282 1 13 . 1 1 5 5 LEU H H 5 8.917 8.917 8.157 0.760 25155 10283 1 13 . 1 1 6 6 PHE N N 6 125.990 125.990 124.961 1.029 25155 10284 1 13 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.366 0.372 25155 10285 1 13 . 1 1 6 6 PHE C C 6 174.358 174.358 173.158 1.200 25155 10286 1 13 . 1 1 6 6 PHE CA C 6 55.480 55.480 54.718 0.762 25155 10287 1 13 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.392 -0.342 25155 10288 1 13 . 1 1 6 6 PHE H H 6 9.225 9.225 9.073 0.152 25155 10289 1 13 . 1 1 7 7 TYR N N 7 118.040 118.040 117.058 0.982 25155 10290 1 13 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.196 0.733 25155 10291 1 13 . 1 1 7 7 TYR C C 7 171.690 171.690 174.469 -2.779 25155 10292 1 13 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.414 -0.954 25155 10293 1 13 . 1 1 7 7 TYR CB C 7 40.800 40.800 39.826 0.974 25155 10294 1 13 . 1 1 7 7 TYR H H 7 8.235 8.235 7.639 0.596 25155 10295 1 13 . 1 1 8 8 GLY N N 8 106.640 106.640 107.413 -0.773 25155 10296 1 13 . 1 1 8 8 GLY C C 8 171.682 171.682 174.658 -2.976 25155 10297 1 13 . 1 1 8 8 GLY CA C 8 44.050 44.050 44.182 -0.132 25155 10298 1 13 . 1 1 8 8 GLY H H 8 6.996 6.996 8.991 -1.995 25155 10299 1 13 . 1 1 9 9 SER N N 9 118.164 118.164 116.533 1.631 25155 10300 1 13 . 1 1 9 9 SER C C 9 174.560 174.560 176.307 -1.747 25155 10301 1 13 . 1 1 9 9 SER CA C 9 57.140 57.140 59.361 -2.221 25155 10302 1 13 . 1 1 9 9 SER H H 9 9.680 9.680 8.647 1.033 25155 10303 1 13 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.918 -0.288 25155 10304 1 13 . 1 1 17 17 ALA C C 17 177.740 177.740 179.302 -1.562 25155 10305 1 13 . 1 1 17 17 ALA CA C 17 54.900 54.900 55.095 -0.195 25155 10306 1 13 . 1 1 17 17 ALA CB C 17 17.790 17.790 17.817 -0.027 25155 10307 1 13 . 1 1 17 17 ALA H H 17 8.055 8.055 7.565 0.490 25155 10308 1 13 . 1 1 18 18 ALA N N 18 120.026 120.026 121.540 -1.514 25155 10309 1 13 . 1 1 18 18 ALA HA H 18 3.713 3.713 3.989 -0.276 25155 10310 1 13 . 1 1 18 18 ALA C C 18 179.040 179.040 179.444 -0.404 25155 10311 1 13 . 1 1 18 18 ALA CA C 18 54.860 54.860 55.184 -0.324 25155 10312 1 13 . 1 1 18 18 ALA CB C 18 18.200 18.200 18.393 -0.193 25155 10313 1 13 . 1 1 18 18 ALA H H 18 7.015 7.015 8.151 -1.136 25155 10314 1 13 . 1 1 19 19 GLU N N 19 116.656 116.656 117.807 -1.151 25155 10315 1 13 . 1 1 19 19 GLU HA H 19 3.580 3.580 4.025 -0.445 25155 10316 1 13 . 1 1 19 19 GLU C C 19 178.487 178.487 178.957 -0.470 25155 10317 1 13 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.356 0.314 25155 10318 1 13 . 1 1 19 19 GLU CB C 19 29.400 29.400 29.271 0.129 25155 10319 1 13 . 1 1 20 20 LYS N N 20 120.100 120.100 120.230 -0.130 25155 10320 1 13 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.082 0.264 25155 10321 1 13 . 1 1 20 20 LYS C C 20 175.330 175.330 179.238 -3.908 25155 10322 1 13 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.238 -2.138 25155 10323 1 13 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.375 0.625 25155 10324 1 13 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.730 -0.265 25155 10325 1 13 . 1 1 21 21 ILE C C 21 177.680 177.680 177.968 -0.288 25155 10326 1 13 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.607 0.033 25155 10327 1 13 . 1 1 21 21 ILE CB C 21 38.030 38.030 38.042 -0.012 25155 10328 1 13 . 1 1 21 21 ILE H H 21 8.220 8.220 8.593 -0.373 25155 10329 1 13 . 1 1 22 22 ARG N N 22 119.433 119.433 118.730 0.703 25155 10330 1 13 . 1 1 22 22 ARG HA H 22 3.550 3.550 3.994 -0.444 25155 10331 1 13 . 1 1 22 22 ARG C C 22 177.268 177.268 178.294 -1.026 25155 10332 1 13 . 1 1 22 22 ARG CA C 22 59.760 59.760 59.351 0.409 25155 10333 1 13 . 1 1 22 22 ARG CB C 22 28.900 28.900 29.514 -0.614 25155 10334 1 13 . 1 1 23 23 ASP N N 23 118.945 118.945 120.016 -1.071 25155 10335 1 13 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.449 -0.107 25155 10336 1 13 . 1 1 23 23 ASP C C 23 178.470 178.470 178.626 -0.156 25155 10337 1 13 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.154 0.296 25155 10338 1 13 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.908 -0.538 25155 10339 1 13 . 1 1 24 24 ILE N N 24 121.200 121.200 119.546 1.654 25155 10340 1 13 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.850 -0.116 25155 10341 1 13 . 1 1 24 24 ILE C C 24 178.297 178.297 177.869 0.428 25155 10342 1 13 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.216 0.284 25155 10343 1 13 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.494 0.246 25155 10344 1 13 . 1 1 24 24 ILE H H 24 8.160 8.160 7.953 0.207 25155 10345 1 13 . 1 1 25 25 ILE N N 25 121.166 121.166 117.818 3.348 25155 10346 1 13 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.846 -0.203 25155 10347 1 13 . 1 1 25 25 ILE C C 25 176.825 176.825 176.776 0.049 25155 10348 1 13 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.288 2.602 25155 10349 1 13 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.771 -1.021 25155 10350 1 13 . 1 1 25 25 ILE H H 25 8.480 8.480 8.001 0.479 25155 10351 1 13 . 1 1 26 26 GLY N N 26 109.050 109.050 104.960 4.090 25155 10352 1 13 . 1 1 26 26 GLY C C 26 173.800 173.800 172.303 1.497 25155 10353 1 13 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.556 -0.156 25155 10354 1 13 . 1 1 26 26 GLY H H 26 7.945 7.945 7.798 0.147 25155 10355 1 13 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.514 -0.151 25155 10356 1 13 . 1 1 27 27 PRO C C 27 177.157 177.157 176.983 0.174 25155 10357 1 13 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.793 0.737 25155 10358 1 13 . 1 1 27 27 PRO CB C 27 32.000 32.000 32.111 -0.111 25155 10359 1 13 . 1 1 28 28 GLU N N 28 116.510 116.510 117.166 -0.656 25155 10360 1 13 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.212 0.048 25155 10361 1 13 . 1 1 28 28 GLU C C 28 177.000 177.000 177.101 -0.101 25155 10362 1 13 . 1 1 28 28 GLU CA C 28 57.680 57.680 58.065 -0.384 25155 10363 1 13 . 1 1 28 28 GLU CB C 28 28.620 28.620 29.199 -0.579 25155 10364 1 13 . 1 1 29 29 LEU N N 29 120.334 120.334 114.004 6.330 25155 10365 1 13 . 1 1 29 29 LEU HA H 29 4.650 4.650 4.703 -0.053 25155 10366 1 13 . 1 1 29 29 LEU C C 29 175.676 175.676 175.861 -0.185 25155 10367 1 13 . 1 1 29 29 LEU CA C 29 55.924 55.924 55.253 0.671 25155 10368 1 13 . 1 1 29 29 LEU CB C 29 44.880 44.880 44.045 0.835 25155 10369 1 13 . 1 1 29 29 LEU H H 29 7.924 7.924 7.428 0.496 25155 10370 1 13 . 1 1 30 30 VAL N N 30 118.900 118.900 120.666 -1.766 25155 10371 1 13 . 1 1 30 30 VAL HA H 30 4.639 4.639 4.594 0.045 25155 10372 1 13 . 1 1 30 30 VAL C C 30 174.368 174.368 175.982 -1.614 25155 10373 1 13 . 1 1 30 30 VAL CA C 30 61.110 61.110 62.175 -1.065 25155 10374 1 13 . 1 1 30 30 VAL CB C 30 34.500 34.500 33.129 1.371 25155 10375 1 13 . 1 1 30 30 VAL H H 30 7.486 7.486 7.587 -0.101 25155 10376 1 13 . 1 1 31 31 THR N N 31 124.000 124.000 120.294 3.706 25155 10377 1 13 . 1 1 31 31 THR HA H 31 4.331 4.331 4.712 -0.381 25155 10378 1 13 . 1 1 31 31 THR C C 31 172.670 172.670 173.218 -0.548 25155 10379 1 13 . 1 1 31 31 THR CA C 31 61.784 61.784 60.958 0.826 25155 10380 1 13 . 1 1 31 31 THR CB C 31 70.483 70.483 71.378 -0.895 25155 10381 1 13 . 1 1 31 31 THR H H 31 7.947 7.947 8.746 -0.799 25155 10382 1 13 . 1 1 32 32 LEU N N 32 127.408 127.408 126.923 0.485 25155 10383 1 13 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.453 0.184 25155 10384 1 13 . 1 1 32 32 LEU C C 32 176.425 176.425 176.210 0.215 25155 10385 1 13 . 1 1 32 32 LEU CA C 32 54.760 54.760 55.166 -0.406 25155 10386 1 13 . 1 1 32 32 LEU CB C 32 43.809 43.809 43.077 0.732 25155 10387 1 13 . 1 1 32 32 LEU H H 32 8.614 8.614 8.662 -0.048 25155 10388 1 13 . 1 1 33 33 HIS N N 33 120.230 120.230 122.495 -2.265 25155 10389 1 13 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.627 -0.207 25155 10390 1 13 . 1 1 33 33 HIS C C 33 171.914 171.914 173.873 -1.959 25155 10391 1 13 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.286 1.014 25155 10392 1 13 . 1 1 33 33 HIS CB C 33 32.050 32.050 31.243 0.807 25155 10393 1 13 . 1 1 33 33 HIS H H 33 9.130 9.130 8.898 0.232 25155 10394 1 13 . 1 1 34 34 ASN N N 34 123.987 123.987 120.405 3.582 25155 10395 1 13 . 1 1 34 34 ASN HA H 34 3.600 3.600 3.604 -0.004 25155 10396 1 13 . 1 1 34 34 ASN C C 34 177.930 177.930 175.314 2.616 25155 10397 1 13 . 1 1 34 34 ASN CA C 34 51.730 51.730 53.349 -1.619 25155 10398 1 13 . 1 1 34 34 ASN CB C 34 38.747 38.747 38.234 0.513 25155 10399 1 13 . 1 1 34 34 ASN H H 34 8.759 8.759 8.481 0.278 25155 10400 1 13 . 1 1 35 35 LEU N N 35 128.751 128.751 125.029 3.722 25155 10401 1 13 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.032 0.258 25155 10402 1 13 . 1 1 35 35 LEU C C 35 177.363 177.363 178.108 -0.745 25155 10403 1 13 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.381 0.169 25155 10404 1 13 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.672 1.091 25155 10405 1 13 . 1 1 35 35 LEU H H 35 8.758 8.758 8.328 0.430 25155 10406 1 13 . 1 1 36 36 LYS N N 36 120.870 120.870 118.792 2.078 25155 10407 1 13 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.043 -0.110 25155 10408 1 13 . 1 1 36 36 LYS C C 36 176.540 176.540 177.194 -0.654 25155 10409 1 13 . 1 1 36 36 LYS CA C 36 59.260 59.260 58.035 1.225 25155 10410 1 13 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.352 0.448 25155 10411 1 13 . 1 1 37 37 ASP N N 37 115.288 115.288 116.665 -1.377 25155 10412 1 13 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.605 0.142 25155 10413 1 13 . 1 1 37 37 ASP C C 37 175.500 175.500 176.365 -0.865 25155 10414 1 13 . 1 1 37 37 ASP CA C 37 54.805 54.805 55.286 -0.481 25155 10415 1 13 . 1 1 37 37 ASP CB C 37 44.650 44.650 42.406 2.244 25155 10416 1 13 . 1 1 38 38 ASP N N 38 121.550 121.550 118.139 3.411 25155 10417 1 13 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.901 -0.036 25155 10418 1 13 . 1 1 38 38 ASP C C 38 174.895 174.895 174.679 0.216 25155 10419 1 13 . 1 1 38 38 ASP CA C 38 52.840 52.840 53.009 -0.169 25155 10420 1 13 . 1 1 38 38 ASP CB C 38 42.240 42.240 44.252 -2.012 25155 10421 1 13 . 1 1 39 39 SER N N 39 115.170 115.170 116.475 -1.305 25155 10422 1 13 . 1 1 39 39 SER HA H 39 4.600 4.600 4.779 -0.179 25155 10423 1 13 . 1 1 39 39 SER C C 39 174.930 174.930 174.022 0.908 25155 10424 1 13 . 1 1 39 39 SER CA C 39 54.786 54.786 56.662 -1.876 25155 10425 1 13 . 1 1 39 39 SER CB C 39 64.840 64.840 63.415 1.425 25155 10426 1 13 . 1 1 39 39 SER H H 39 8.330 8.330 8.606 -0.276 25155 10427 1 13 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.419 -0.419 25155 10428 1 13 . 1 1 40 40 PRO C C 40 176.620 176.620 178.011 -1.391 25155 10429 1 13 . 1 1 40 40 PRO CA C 40 63.870 63.870 64.806 -0.936 25155 10430 1 13 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.757 -0.397 25155 10431 1 13 . 1 1 41 41 LYS N N 41 120.913 120.913 118.137 2.776 25155 10432 1 13 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.167 -0.271 25155 10433 1 13 . 1 1 41 41 LYS C C 41 179.580 179.580 178.575 1.005 25155 10434 1 13 . 1 1 41 41 LYS CA C 41 58.000 58.000 58.321 -0.321 25155 10435 1 13 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.316 0.784 25155 10436 1 13 . 1 1 42 42 LEU N N 42 118.206 118.206 120.422 -2.216 25155 10437 1 13 . 1 1 42 42 LEU HA H 42 4.025 4.025 4.015 0.010 25155 10438 1 13 . 1 1 42 42 LEU C C 42 178.630 178.630 178.674 -0.044 25155 10439 1 13 . 1 1 42 42 LEU CA C 42 57.030 57.030 57.164 -0.134 25155 10440 1 13 . 1 1 42 42 LEU CB C 42 41.820 41.820 40.860 0.960 25155 10441 1 13 . 1 1 42 42 LEU H H 42 7.598 7.598 7.533 0.065 25155 10442 1 13 . 1 1 43 43 MET N N 43 118.913 118.913 116.736 2.177 25155 10443 1 13 . 1 1 43 43 MET HA H 43 3.760 3.760 4.134 -0.374 25155 10444 1 13 . 1 1 43 43 MET C C 43 177.710 177.710 178.144 -0.434 25155 10445 1 13 . 1 1 43 43 MET CA C 43 59.864 59.864 58.447 1.417 25155 10446 1 13 . 1 1 43 43 MET CB C 43 32.680 32.680 31.831 0.849 25155 10447 1 13 . 1 1 43 43 MET H H 43 8.180 8.180 8.120 0.060 25155 10448 1 13 . 1 1 44 44 GLU N N 44 110.906 110.906 118.641 -7.735 25155 10449 1 13 . 1 1 44 44 GLU HA H 44 3.732 3.732 4.080 -0.348 25155 10450 1 13 . 1 1 44 44 GLU C C 44 178.120 178.120 179.019 -0.899 25155 10451 1 13 . 1 1 44 44 GLU CA C 44 59.450 59.450 59.063 0.387 25155 10452 1 13 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.440 0.360 25155 10453 1 13 . 1 1 45 45 GLN N N 45 115.770 115.770 117.640 -1.870 25155 10454 1 13 . 1 1 45 45 GLN HA H 45 4.190 4.190 3.998 0.192 25155 10455 1 13 . 1 1 45 45 GLN C C 45 175.480 175.480 176.540 -1.060 25155 10456 1 13 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.167 -1.067 25155 10457 1 13 . 1 1 45 45 GLN CB C 45 28.490 28.490 28.880 -0.390 25155 10458 1 13 . 1 1 45 45 GLN H H 45 7.517 7.517 7.526 -0.009 25155 10459 1 13 . 1 1 46 46 TYR N N 46 117.840 117.840 117.626 0.214 25155 10460 1 13 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.451 0.209 25155 10461 1 13 . 1 1 46 46 TYR C C 46 175.480 175.480 176.692 -1.212 25155 10462 1 13 . 1 1 46 46 TYR CA C 46 58.827 58.827 58.476 0.351 25155 10463 1 13 . 1 1 46 46 TYR CB C 46 41.720 41.720 38.306 3.414 25155 10464 1 13 . 1 1 46 46 TYR H H 46 6.955 6.955 7.442 -0.487 25155 10465 1 13 . 1 1 47 47 ASP N N 47 121.540 121.540 121.845 -0.305 25155 10466 1 13 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.663 0.033 25155 10467 1 13 . 1 1 47 47 ASP C C 47 175.677 175.677 176.360 -0.683 25155 10468 1 13 . 1 1 47 47 ASP CA C 47 56.812 56.812 57.427 -0.615 25155 10469 1 13 . 1 1 47 47 ASP CB C 47 42.978 42.978 41.670 1.308 25155 10470 1 13 . 1 1 48 48 VAL N N 48 118.666 118.666 117.327 1.339 25155 10471 1 13 . 1 1 48 48 VAL HA H 48 5.057 5.057 5.017 0.040 25155 10472 1 13 . 1 1 48 48 VAL C C 48 174.180 174.180 174.012 0.168 25155 10473 1 13 . 1 1 48 48 VAL CA C 48 60.000 60.000 60.764 -0.764 25155 10474 1 13 . 1 1 48 48 VAL CB C 48 36.200 36.200 35.587 0.613 25155 10475 1 13 . 1 1 48 48 VAL H H 48 7.631 7.631 8.035 -0.404 25155 10476 1 13 . 1 1 49 49 LEU N N 49 128.300 128.300 125.621 2.679 25155 10477 1 13 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.321 0.279 25155 10478 1 13 . 1 1 49 49 LEU C C 49 174.810 174.810 174.721 0.089 25155 10479 1 13 . 1 1 49 49 LEU CA C 49 52.230 52.230 53.004 -0.774 25155 10480 1 13 . 1 1 49 49 LEU CB C 49 45.400 45.400 47.090 -1.690 25155 10481 1 13 . 1 1 49 49 LEU H H 49 9.469 9.469 8.974 0.495 25155 10482 1 13 . 1 1 50 50 ILE N N 50 124.400 124.400 123.113 1.287 25155 10483 1 13 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.781 0.869 25155 10484 1 13 . 1 1 50 50 ILE C C 50 175.286 175.286 173.909 1.377 25155 10485 1 13 . 1 1 50 50 ILE CA C 50 59.900 59.900 60.368 -0.468 25155 10486 1 13 . 1 1 50 50 ILE CB C 50 40.200 40.200 41.652 -1.452 25155 10487 1 13 . 1 1 50 50 ILE H H 50 9.213 9.213 8.867 0.346 25155 10488 1 13 . 1 1 51 51 LEU N N 51 127.410 127.410 127.771 -0.361 25155 10489 1 13 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.056 2.014 25155 10490 1 13 . 1 1 51 51 LEU C C 51 174.540 174.540 175.434 -0.894 25155 10491 1 13 . 1 1 51 51 LEU CA C 51 52.950 52.950 53.012 -0.062 25155 10492 1 13 . 1 1 51 51 LEU CB C 51 43.190 43.190 43.540 -0.350 25155 10493 1 13 . 1 1 51 51 LEU H H 51 9.256 9.256 8.829 0.427 25155 10494 1 13 . 1 1 52 52 GLY N N 52 108.290 108.290 110.468 -2.178 25155 10495 1 13 . 1 1 52 52 GLY C C 52 174.330 174.330 171.650 2.680 25155 10496 1 13 . 1 1 52 52 GLY CA C 52 44.040 44.040 43.719 0.321 25155 10497 1 13 . 1 1 52 52 GLY H H 52 8.949 8.949 8.030 0.919 25155 10498 1 13 . 1 1 53 53 ILE N N 53 124.912 124.912 121.620 3.292 25155 10499 1 13 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.623 -0.448 25155 10500 1 13 . 1 1 53 53 ILE C C 53 174.470 174.470 172.926 1.544 25155 10501 1 13 . 1 1 53 53 ILE CA C 53 55.850 55.850 58.010 -2.160 25155 10502 1 13 . 1 1 53 53 ILE CB C 53 42.800 42.800 42.265 0.535 25155 10503 1 13 . 1 1 53 53 ILE H H 53 8.612 8.612 7.484 1.128 25155 10504 1 13 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.653 0.159 25155 10505 1 13 . 1 1 54 54 PRO C C 54 174.565 174.565 175.451 -0.886 25155 10506 1 13 . 1 1 54 54 PRO CA C 54 61.850 61.850 61.246 0.604 25155 10507 1 13 . 1 1 54 54 PRO CB C 54 32.400 32.400 31.613 0.787 25155 10508 1 13 . 1 1 55 55 THR N N 55 116.040 116.040 121.006 -4.966 25155 10509 1 13 . 1 1 55 55 THR HA H 55 4.522 4.522 4.393 0.129 25155 10510 1 13 . 1 1 55 55 THR C C 55 173.990 173.990 173.241 0.749 25155 10511 1 13 . 1 1 55 55 THR CA C 55 62.845 62.845 62.309 0.536 25155 10512 1 13 . 1 1 55 55 THR CB C 55 70.795 70.795 70.048 0.747 25155 10513 1 13 . 1 1 55 55 THR H H 55 7.663 7.663 8.381 -0.718 25155 10514 1 13 . 1 1 56 56 TRP N N 56 130.540 130.540 124.278 6.262 25155 10515 1 13 . 1 1 56 56 TRP CA C 56 54.800 54.800 56.512 -1.712 25155 10516 1 13 . 1 1 56 56 TRP H H 56 9.075 9.075 8.328 0.747 25155 10517 1 13 . 1 1 58 58 PHE HA H 58 4.540 4.540 4.030 0.510 25155 10518 1 13 . 1 1 58 58 PHE C C 58 177.070 177.070 175.234 1.836 25155 10519 1 13 . 1 1 58 58 PHE CA C 58 55.460 55.460 59.840 -4.380 25155 10520 1 13 . 1 1 58 58 PHE CB C 58 41.200 41.200 38.159 3.041 25155 10521 1 13 . 1 1 59 59 GLY N N 59 109.796 109.796 106.444 3.352 25155 10522 1 13 . 1 1 59 59 GLY CA C 59 45.763 45.763 45.007 0.756 25155 10523 1 13 . 1 1 59 59 GLY H H 59 8.392 8.392 8.209 0.183 25155 10524 1 13 . 1 1 60 60 GLU C C 60 175.660 175.660 175.384 0.276 25155 10525 1 13 . 1 1 61 61 ILE N N 61 122.380 122.380 122.537 -0.157 25155 10526 1 13 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.735 0.705 25155 10527 1 13 . 1 1 61 61 ILE CA C 61 62.100 62.100 62.116 -0.016 25155 10528 1 13 . 1 1 61 61 ILE CB C 61 38.750 38.750 37.799 0.951 25155 10529 1 13 . 1 1 61 61 ILE H H 61 8.436 8.436 8.200 0.236 25155 10530 1 13 . 1 1 62 62 GLN CB C 62 30.570 30.570 29.679 0.891 25155 10531 1 13 . 1 1 63 63 GLU HA H 63 4.030 4.030 3.940 0.090 25155 10532 1 13 . 1 1 63 63 GLU C C 63 177.134 177.134 178.268 -1.134 25155 10533 1 13 . 1 1 63 63 GLU CA C 63 60.520 60.520 60.052 0.468 25155 10534 1 13 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.613 0.037 25155 10535 1 13 . 1 1 64 64 ASP N N 64 119.630 119.630 118.226 1.404 25155 10536 1 13 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.499 0.093 25155 10537 1 13 . 1 1 64 64 ASP C C 64 178.680 178.680 177.276 1.404 25155 10538 1 13 . 1 1 64 64 ASP CA C 64 57.823 57.823 56.917 0.906 25155 10539 1 13 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.663 0.437 25155 10540 1 13 . 1 1 65 65 TRP N N 65 120.535 120.535 120.915 -0.380 25155 10541 1 13 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.641 -0.316 25155 10542 1 13 . 1 1 65 65 TRP C C 65 178.684 178.684 177.729 0.955 25155 10543 1 13 . 1 1 65 65 TRP CA C 65 60.500 60.500 59.137 1.363 25155 10544 1 13 . 1 1 65 65 TRP CB C 65 30.100 30.100 31.792 -1.692 25155 10545 1 13 . 1 1 65 65 TRP H H 65 7.416 7.416 7.804 -0.388 25155 10546 1 13 . 1 1 66 66 GLU N N 66 120.760 120.760 120.547 0.213 25155 10547 1 13 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.164 -0.344 25155 10548 1 13 . 1 1 66 66 GLU C C 66 178.860 178.860 178.817 0.043 25155 10549 1 13 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.751 0.349 25155 10550 1 13 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.574 -0.564 25155 10551 1 13 . 1 1 67 67 ALA N N 67 118.972 118.972 121.691 -2.719 25155 10552 1 13 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.191 0.056 25155 10553 1 13 . 1 1 67 67 ALA C C 67 179.610 179.610 179.094 0.516 25155 10554 1 13 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.929 -0.329 25155 10555 1 13 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.820 -0.032 25155 10556 1 13 . 1 1 67 67 ALA H H 67 7.690 7.690 8.492 -0.802 25155 10557 1 13 . 1 1 68 68 VAL N N 68 107.530 107.530 111.270 -3.740 25155 10558 1 13 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.249 0.461 25155 10559 1 13 . 1 1 68 68 VAL C C 68 176.800 176.800 177.475 -0.675 25155 10560 1 13 . 1 1 68 68 VAL CA C 68 60.060 60.060 63.691 -3.631 25155 10561 1 13 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.448 0.152 25155 10562 1 13 . 1 1 68 68 VAL H H 68 7.240 7.240 7.623 -0.383 25155 10563 1 13 . 1 1 69 69 TRP N N 69 126.960 126.960 125.045 1.915 25155 10564 1 13 . 1 1 69 69 TRP HA H 69 4.182 4.182 4.407 -0.225 25155 10565 1 13 . 1 1 69 69 TRP C C 69 178.640 178.640 177.065 1.575 25155 10566 1 13 . 1 1 69 69 TRP CA C 69 61.300 61.300 62.629 -1.329 25155 10567 1 13 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.422 2.148 25155 10568 1 13 . 1 1 69 69 TRP H H 69 7.810 7.810 7.486 0.324 25155 10569 1 13 . 1 1 70 70 ASP N N 70 114.644 114.644 117.146 -2.502 25155 10570 1 13 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.570 -0.051 25155 10571 1 13 . 1 1 70 70 ASP C C 70 178.685 178.685 178.121 0.564 25155 10572 1 13 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.558 -0.558 25155 10573 1 13 . 1 1 70 70 ASP CB C 70 39.810 39.810 41.231 -1.421 25155 10574 1 13 . 1 1 71 71 GLN N N 71 120.100 120.100 117.237 2.863 25155 10575 1 13 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.317 -0.127 25155 10576 1 13 . 1 1 71 71 GLN C C 71 178.870 178.870 177.839 1.031 25155 10577 1 13 . 1 1 71 71 GLN CA C 71 57.617 57.617 57.219 0.398 25155 10578 1 13 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.747 -0.927 25155 10579 1 13 . 1 1 71 71 GLN H H 71 7.980 7.980 8.063 -0.083 25155 10580 1 13 . 1 1 72 72 LEU N N 72 117.535 117.535 120.041 -2.506 25155 10581 1 13 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.959 -0.162 25155 10582 1 13 . 1 1 72 72 LEU C C 72 178.308 178.308 178.026 0.282 25155 10583 1 13 . 1 1 72 72 LEU CA C 72 57.340 57.340 57.275 0.065 25155 10584 1 13 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.657 0.043 25155 10585 1 13 . 1 1 72 72 LEU H H 72 7.435 7.435 7.931 -0.496 25155 10586 1 13 . 1 1 73 73 ASP N N 73 115.534 115.534 117.500 -1.966 25155 10587 1 13 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.462 -0.312 25155 10588 1 13 . 1 1 73 73 ASP C C 73 177.553 177.553 176.926 0.627 25155 10589 1 13 . 1 1 73 73 ASP CA C 73 57.350 57.350 56.117 1.233 25155 10590 1 13 . 1 1 73 73 ASP CB C 73 40.040 40.040 41.628 -1.588 25155 10591 1 13 . 1 1 74 74 ASP N N 74 117.300 117.300 120.053 -2.753 25155 10592 1 13 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.591 0.115 25155 10593 1 13 . 1 1 74 74 ASP C C 74 176.424 176.424 177.237 -0.813 25155 10594 1 13 . 1 1 74 74 ASP CA C 74 54.170 54.170 55.233 -1.063 25155 10595 1 13 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.523 0.297 25155 10596 1 13 . 1 1 75 75 LEU N N 75 118.500 118.500 120.535 -2.035 25155 10597 1 13 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.150 0.145 25155 10598 1 13 . 1 1 75 75 LEU C C 75 176.800 176.800 176.266 0.534 25155 10599 1 13 . 1 1 75 75 LEU CA C 75 54.400 54.400 55.312 -0.912 25155 10600 1 13 . 1 1 75 75 LEU CB C 75 43.280 43.280 41.834 1.446 25155 10601 1 13 . 1 1 75 75 LEU H H 75 6.966 6.966 7.499 -0.533 25155 10602 1 13 . 1 1 76 76 ASN N N 76 123.040 123.040 120.173 2.867 25155 10603 1 13 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.738 0.124 25155 10604 1 13 . 1 1 76 76 ASN C C 76 174.927 174.927 174.275 0.652 25155 10605 1 13 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.171 -1.290 25155 10606 1 13 . 1 1 76 76 ASN CB C 76 37.510 37.510 39.279 -1.769 25155 10607 1 13 . 1 1 76 76 ASN H H 76 9.882 9.882 9.094 0.788 25155 10608 1 13 . 1 1 77 77 LEU N N 77 123.614 123.614 123.956 -0.342 25155 10609 1 13 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.620 -0.250 25155 10610 1 13 . 1 1 77 77 LEU C C 77 175.110 175.110 176.241 -1.131 25155 10611 1 13 . 1 1 77 77 LEU CA C 77 52.200 52.200 53.260 -1.060 25155 10612 1 13 . 1 1 77 77 LEU CB C 77 42.786 42.786 42.749 0.037 25155 10613 1 13 . 1 1 77 77 LEU H H 77 8.700 8.700 8.546 0.154 25155 10614 1 13 . 1 1 78 78 GLU N N 78 120.822 120.822 121.281 -0.459 25155 10615 1 13 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.135 -0.235 25155 10616 1 13 . 1 1 78 78 GLU C C 78 178.670 178.670 178.126 0.544 25155 10617 1 13 . 1 1 78 78 GLU CA C 78 58.700 58.700 57.941 0.759 25155 10618 1 13 . 1 1 78 78 GLU CB C 78 29.467 29.467 29.485 -0.018 25155 10619 1 13 . 1 1 79 79 GLY N N 79 113.160 113.160 113.125 0.035 25155 10620 1 13 . 1 1 79 79 GLY C C 79 174.523 174.523 173.797 0.726 25155 10621 1 13 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.538 -0.118 25155 10622 1 13 . 1 1 79 79 GLY H H 79 8.450 8.450 8.662 -0.212 25155 10623 1 13 . 1 1 80 80 LYS N N 80 120.283 120.283 119.781 0.502 25155 10624 1 13 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.510 -0.152 25155 10625 1 13 . 1 1 80 80 LYS C C 80 175.304 175.304 176.212 -0.908 25155 10626 1 13 . 1 1 80 80 LYS CA C 80 56.890 56.890 55.680 1.210 25155 10627 1 13 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.991 -0.871 25155 10628 1 13 . 1 1 81 81 ILE N N 81 122.288 122.288 120.707 1.581 25155 10629 1 13 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.430 0.376 25155 10630 1 13 . 1 1 81 81 ILE C C 81 174.750 174.750 175.397 -0.647 25155 10631 1 13 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.341 -1.521 25155 10632 1 13 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.604 0.246 25155 10633 1 13 . 1 1 81 81 ILE H H 81 7.405 7.405 8.031 -0.626 25155 10634 1 13 . 1 1 82 82 VAL N N 82 127.793 127.793 125.714 2.079 25155 10635 1 13 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.126 0.154 25155 10636 1 13 . 1 1 82 82 VAL C C 82 172.680 172.680 174.573 -1.893 25155 10637 1 13 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.297 -0.197 25155 10638 1 13 . 1 1 82 82 VAL CB C 82 35.280 35.280 35.122 0.158 25155 10639 1 13 . 1 1 82 82 VAL H H 82 8.800 8.800 9.076 -0.276 25155 10640 1 13 . 1 1 83 83 ALA N N 83 130.911 130.911 130.194 0.717 25155 10641 1 13 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.557 -0.168 25155 10642 1 13 . 1 1 83 83 ALA C C 83 175.870 175.870 176.198 -0.328 25155 10643 1 13 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.874 0.126 25155 10644 1 13 . 1 1 83 83 ALA CB C 83 23.722 23.722 21.823 1.899 25155 10645 1 13 . 1 1 83 83 ALA H H 83 9.252 9.252 9.174 0.078 25155 10646 1 13 . 1 1 84 84 LEU N N 84 124.269 124.269 122.604 1.665 25155 10647 1 13 . 1 1 84 84 LEU HA H 84 5.508 5.508 5.179 0.329 25155 10648 1 13 . 1 1 84 84 LEU C C 84 175.490 175.490 175.852 -0.362 25155 10649 1 13 . 1 1 84 84 LEU CA C 84 53.670 53.670 54.149 -0.479 25155 10650 1 13 . 1 1 84 84 LEU CB C 84 45.000 45.000 45.439 -0.439 25155 10651 1 13 . 1 1 84 84 LEU H H 84 10.378 10.378 8.616 1.762 25155 10652 1 13 . 1 1 85 85 TYR N N 85 115.826 115.826 119.014 -3.188 25155 10653 1 13 . 1 1 85 85 TYR HA H 85 4.950 4.950 5.276 -0.326 25155 10654 1 13 . 1 1 85 85 TYR C C 85 172.661 172.661 173.683 -1.022 25155 10655 1 13 . 1 1 85 85 TYR CA C 85 55.853 55.853 55.700 0.153 25155 10656 1 13 . 1 1 85 85 TYR CB C 85 43.200 43.200 41.414 1.786 25155 10657 1 13 . 1 1 85 85 TYR H H 85 9.200 9.200 8.651 0.549 25155 10658 1 13 . 1 1 86 86 GLY N N 86 106.802 106.802 105.455 1.347 25155 10659 1 13 . 1 1 86 86 GLY C C 86 170.348 170.348 170.990 -0.642 25155 10660 1 13 . 1 1 86 86 GLY CA C 86 44.687 44.687 44.615 0.072 25155 10661 1 13 . 1 1 86 86 GLY H H 86 8.752 8.752 8.356 0.396 25155 10662 1 13 . 1 1 87 87 LEU N N 87 120.860 120.860 120.098 0.762 25155 10663 1 13 . 1 1 87 87 LEU HA H 87 5.476 5.476 5.060 0.416 25155 10664 1 13 . 1 1 87 87 LEU C C 87 177.720 177.720 174.628 3.092 25155 10665 1 13 . 1 1 87 87 LEU CA C 87 52.630 52.630 52.408 0.222 25155 10666 1 13 . 1 1 87 87 LEU CB C 87 45.900 45.900 45.360 0.540 25155 10667 1 13 . 1 1 87 87 LEU H H 87 6.320 6.320 7.988 -1.668 25155 10668 1 13 . 1 1 88 88 GLY N N 88 109.910 109.910 110.421 -0.511 25155 10669 1 13 . 1 1 88 88 GLY C C 88 171.386 171.386 171.464 -0.078 25155 10670 1 13 . 1 1 88 88 GLY CA C 88 45.710 45.710 43.325 2.385 25155 10671 1 13 . 1 1 88 88 GLY H H 88 8.320 8.320 8.424 -0.104 25155 10672 1 13 . 1 1 89 89 ASP N N 89 121.580 121.580 117.984 3.596 25155 10673 1 13 . 1 1 89 89 ASP HA H 89 5.190 5.190 5.345 -0.155 25155 10674 1 13 . 1 1 89 89 ASP C C 89 176.608 176.608 175.778 0.830 25155 10675 1 13 . 1 1 89 89 ASP CA C 89 52.200 52.200 53.420 -1.220 25155 10676 1 13 . 1 1 89 89 ASP CB C 89 41.900 41.900 43.587 -1.687 25155 10677 1 13 . 1 1 90 90 GLN N N 90 123.900 123.900 122.424 1.476 25155 10678 1 13 . 1 1 90 90 GLN HA H 90 3.645 3.645 4.539 -0.894 25155 10679 1 13 . 1 1 90 90 GLN C C 90 173.523 173.523 176.976 -3.453 25155 10680 1 13 . 1 1 90 90 GLN CA C 90 58.706 58.706 55.989 2.717 25155 10681 1 13 . 1 1 90 90 GLN CB C 90 28.800 28.800 29.750 -0.950 25155 10682 1 13 . 1 1 90 90 GLN H H 90 8.726 8.726 8.686 0.040 25155 10683 1 13 . 1 1 91 91 LEU N N 91 117.080 117.080 120.794 -3.714 25155 10684 1 13 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.139 0.331 25155 10685 1 13 . 1 1 91 91 LEU C C 91 179.840 179.840 179.172 0.668 25155 10686 1 13 . 1 1 91 91 LEU CA C 91 55.800 55.800 56.922 -1.122 25155 10687 1 13 . 1 1 91 91 LEU CB C 91 41.640 41.640 42.115 -0.476 25155 10688 1 13 . 1 1 91 91 LEU H H 91 7.092 7.092 8.876 -1.784 25155 10689 1 13 . 1 1 92 92 GLY N N 92 110.460 110.460 105.281 5.179 25155 10690 1 13 . 1 1 92 92 GLY C C 92 174.824 174.824 173.594 1.230 25155 10691 1 13 . 1 1 92 92 GLY CA C 92 46.390 46.390 44.141 2.249 25155 10692 1 13 . 1 1 92 92 GLY H H 92 9.243 9.243 8.923 0.320 25155 10693 1 13 . 1 1 93 93 TYR N N 93 118.140 118.140 119.046 -0.906 25155 10694 1 13 . 1 1 93 93 TYR HA H 93 5.173 5.173 3.942 1.231 25155 10695 1 13 . 1 1 93 93 TYR C C 93 177.805 177.805 175.833 1.972 25155 10696 1 13 . 1 1 93 93 TYR CA C 93 57.430 57.430 59.334 -1.904 25155 10697 1 13 . 1 1 93 93 TYR CB C 93 39.300 39.300 37.141 2.159 25155 10698 1 13 . 1 1 93 93 TYR H H 93 7.252 7.252 7.919 -0.667 25155 10699 1 13 . 1 1 94 94 GLY N N 94 112.455 112.455 103.885 8.570 25155 10700 1 13 . 1 1 94 94 GLY C C 94 177.740 177.740 175.303 2.437 25155 10701 1 13 . 1 1 94 94 GLY CA C 94 49.880 49.880 45.660 4.220 25155 10702 1 13 . 1 1 94 94 GLY H H 94 8.154 8.154 8.048 0.106 25155 10703 1 13 . 1 1 95 95 GLU N N 95 123.040 123.040 120.576 2.464 25155 10704 1 13 . 1 1 95 95 GLU HA H 95 4.000 4.000 4.323 -0.323 25155 10705 1 13 . 1 1 95 95 GLU C C 95 175.145 175.145 178.003 -2.858 25155 10706 1 13 . 1 1 95 95 GLU CA C 95 57.950 57.950 58.852 -0.902 25155 10707 1 13 . 1 1 95 95 GLU CB C 95 27.400 27.400 29.870 -2.470 25155 10708 1 13 . 1 1 96 96 TRP N N 96 118.000 118.000 117.844 0.156 25155 10709 1 13 . 1 1 96 96 TRP HA H 96 5.213 5.213 4.871 0.342 25155 10710 1 13 . 1 1 96 96 TRP C C 96 176.616 176.616 175.800 0.816 25155 10711 1 13 . 1 1 96 96 TRP CA C 96 57.120 57.120 55.061 2.059 25155 10712 1 13 . 1 1 96 96 TRP CB C 96 29.970 29.970 29.189 0.780 25155 10713 1 13 . 1 1 96 96 TRP H H 96 7.785 7.785 7.572 0.213 25155 10714 1 13 . 1 1 97 97 PHE N N 97 123.268 123.268 122.177 1.091 25155 10715 1 13 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.193 0.467 25155 10716 1 13 . 1 1 97 97 PHE CA C 97 58.742 58.742 59.880 -1.138 25155 10717 1 13 . 1 1 97 97 PHE CB C 97 40.835 40.835 38.919 1.916 25155 10718 1 13 . 1 1 97 97 PHE H H 97 7.054 7.054 7.719 -0.665 25155 10719 1 13 . 1 1 98 98 LEU HA H 98 3.440 3.440 3.467 -0.027 25155 10720 1 13 . 1 1 98 98 LEU C C 98 176.613 176.613 176.816 -0.203 25155 10721 1 13 . 1 1 98 98 LEU CA C 98 56.000 56.000 55.154 0.846 25155 10722 1 13 . 1 1 98 98 LEU CB C 98 38.600 38.600 39.116 -0.516 25155 10723 1 13 . 1 1 98 98 LEU H H 98 8.584 8.584 8.238 0.346 25155 10724 1 13 . 1 1 99 99 ASP N N 99 123.268 123.268 119.791 3.477 25155 10725 1 13 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.284 -0.319 25155 10726 1 13 . 1 1 99 99 ASP C C 99 178.876 178.876 177.007 1.869 25155 10727 1 13 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.282 1.978 25155 10728 1 13 . 1 1 99 99 ASP CB C 99 40.350 40.350 41.126 -0.776 25155 10729 1 13 . 1 1 100 100 ALA N N 100 119.124 119.124 121.103 -1.979 25155 10730 1 13 . 1 1 100 100 ALA HA H 100 3.822 3.822 4.132 -0.310 25155 10731 1 13 . 1 1 100 100 ALA C C 100 178.490 178.490 179.236 -0.746 25155 10732 1 13 . 1 1 100 100 ALA CA C 100 55.100 55.100 54.529 0.571 25155 10733 1 13 . 1 1 100 100 ALA CB C 100 19.700 19.700 18.295 1.405 25155 10734 1 13 . 1 1 100 100 ALA H H 100 8.400 8.400 7.612 0.788 25155 10735 1 13 . 1 1 101 101 LEU N N 101 118.687 118.687 120.345 -1.658 25155 10736 1 13 . 1 1 101 101 LEU HA H 101 3.674 3.674 3.959 -0.285 25155 10737 1 13 . 1 1 101 101 LEU C C 101 179.050 179.050 178.643 0.407 25155 10738 1 13 . 1 1 101 101 LEU CA C 101 57.800 57.800 57.221 0.579 25155 10739 1 13 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.623 1.027 25155 10740 1 13 . 1 1 101 101 LEU H H 101 6.518 6.518 7.669 -1.151 25155 10741 1 13 . 1 1 102 102 GLY N N 102 104.410 104.410 105.918 -1.508 25155 10742 1 13 . 1 1 102 102 GLY C C 102 176.056 176.056 175.929 0.127 25155 10743 1 13 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.140 0.610 25155 10744 1 13 . 1 1 102 102 GLY H H 102 7.712 7.712 7.812 -0.100 25155 10745 1 13 . 1 1 103 103 MET N N 103 120.550 120.550 121.615 -1.065 25155 10746 1 13 . 1 1 103 103 MET HA H 103 4.256 4.256 4.370 -0.114 25155 10747 1 13 . 1 1 103 103 MET C C 103 179.650 179.650 178.383 1.267 25155 10748 1 13 . 1 1 103 103 MET CA C 103 59.450 59.450 59.484 -0.034 25155 10749 1 13 . 1 1 103 103 MET CB C 103 32.300 32.300 32.742 -0.442 25155 10750 1 13 . 1 1 103 103 MET H H 103 8.485 8.485 7.533 0.952 25155 10751 1 13 . 1 1 104 104 LEU N N 104 123.480 123.480 120.404 3.076 25155 10752 1 13 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.100 -0.039 25155 10753 1 13 . 1 1 104 104 LEU C C 104 177.750 177.750 178.789 -1.039 25155 10754 1 13 . 1 1 104 104 LEU CA C 104 58.100 58.100 57.556 0.544 25155 10755 1 13 . 1 1 104 104 LEU CB C 104 41.450 41.450 40.860 0.590 25155 10756 1 13 . 1 1 104 104 LEU H H 104 8.392 8.392 7.840 0.552 25155 10757 1 13 . 1 1 105 105 HIS N N 105 119.570 119.570 120.219 -0.649 25155 10758 1 13 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.043 -0.191 25155 10759 1 13 . 1 1 105 105 HIS C C 105 177.550 177.550 176.896 0.654 25155 10760 1 13 . 1 1 105 105 HIS CA C 105 61.000 61.000 60.684 0.316 25155 10761 1 13 . 1 1 105 105 HIS CB C 105 28.820 28.820 29.770 -0.950 25155 10762 1 13 . 1 1 105 105 HIS H H 105 8.247 8.247 8.455 -0.208 25155 10763 1 13 . 1 1 106 106 ASP N N 106 119.780 119.780 118.820 0.960 25155 10764 1 13 . 1 1 106 106 ASP HA H 106 4.333 4.333 4.332 0.001 25155 10765 1 13 . 1 1 106 106 ASP C C 106 179.410 179.410 178.344 1.066 25155 10766 1 13 . 1 1 106 106 ASP CA C 106 57.800 57.800 57.116 0.684 25155 10767 1 13 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.249 -0.649 25155 10768 1 13 . 1 1 107 107 LYS N N 107 121.660 121.660 119.719 1.941 25155 10769 1 13 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.065 0.035 25155 10770 1 13 . 1 1 107 107 LYS C C 107 178.316 178.316 179.211 -0.895 25155 10771 1 13 . 1 1 107 107 LYS CA C 107 58.750 58.750 59.124 -0.374 25155 10772 1 13 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.566 -0.716 25155 10773 1 13 . 1 1 108 108 LEU N N 108 116.050 116.050 118.705 -2.655 25155 10774 1 13 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.247 -0.237 25155 10775 1 13 . 1 1 108 108 LEU C C 108 179.050 179.050 178.855 0.195 25155 10776 1 13 . 1 1 108 108 LEU CA C 108 56.240 56.240 56.843 -0.603 25155 10777 1 13 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.239 -0.439 25155 10778 1 13 . 1 1 108 108 LEU H H 108 8.072 8.072 8.140 -0.068 25155 10779 1 13 . 1 1 109 109 SER N N 109 116.280 116.280 114.997 1.283 25155 10780 1 13 . 1 1 109 109 SER HA H 109 4.300 4.300 4.233 0.067 25155 10781 1 13 . 1 1 109 109 SER C C 109 175.848 175.848 175.699 0.149 25155 10782 1 13 . 1 1 109 109 SER CA C 109 62.410 62.410 61.549 0.861 25155 10783 1 13 . 1 1 109 109 SER CB C 109 62.850 62.850 63.215 -0.365 25155 10784 1 13 . 1 1 109 109 SER H H 109 8.366 8.366 8.001 0.365 25155 10785 1 13 . 1 1 110 110 THR N N 110 110.416 110.416 110.936 -0.520 25155 10786 1 13 . 1 1 110 110 THR HA H 110 4.614 4.614 4.366 0.248 25155 10787 1 13 . 1 1 110 110 THR C C 110 175.675 175.675 175.796 -0.121 25155 10788 1 13 . 1 1 110 110 THR CA C 110 62.030 62.030 63.465 -1.435 25155 10789 1 13 . 1 1 110 110 THR CB C 110 68.810 68.810 69.030 -0.220 25155 10790 1 13 . 1 1 110 110 THR H H 110 7.185 7.185 7.672 -0.487 25155 10791 1 13 . 1 1 111 111 LYS N N 111 120.090 120.090 120.796 -0.706 25155 10792 1 13 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.429 0.084 25155 10793 1 13 . 1 1 111 111 LYS C C 111 176.814 176.814 176.607 0.207 25155 10794 1 13 . 1 1 111 111 LYS CA C 111 55.730 55.730 55.641 0.089 25155 10795 1 13 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.385 -1.454 25155 10796 1 13 . 1 1 112 112 GLY N N 112 107.540 107.540 107.811 -0.271 25155 10797 1 13 . 1 1 112 112 GLY C C 112 176.223 176.223 174.293 1.930 25155 10798 1 13 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.314 1.612 25155 10799 1 13 . 1 1 112 112 GLY H H 112 8.315 8.315 7.608 0.707 25155 10800 1 13 . 1 1 113 113 VAL N N 113 113.536 113.536 114.293 -0.757 25155 10801 1 13 . 1 1 113 113 VAL HA H 113 4.494 4.494 4.352 0.142 25155 10802 1 13 . 1 1 113 113 VAL C C 113 174.560 174.560 174.823 -0.263 25155 10803 1 13 . 1 1 113 113 VAL CA C 113 59.550 59.550 61.445 -1.895 25155 10804 1 13 . 1 1 113 113 VAL CB C 113 32.800 32.800 32.498 0.302 25155 10805 1 13 . 1 1 113 113 VAL H H 113 6.835 6.835 7.021 -0.186 25155 10806 1 13 . 1 1 114 114 LYS N N 114 122.920 122.920 121.008 1.912 25155 10807 1 13 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.367 0.127 25155 10808 1 13 . 1 1 114 114 LYS C C 114 174.925 174.925 174.847 0.078 25155 10809 1 13 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.038 0.241 25155 10810 1 13 . 1 1 114 114 LYS CB C 114 33.630 33.630 35.715 -2.085 25155 10811 1 13 . 1 1 115 115 PHE N N 115 123.140 123.140 121.718 1.422 25155 10812 1 13 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.618 0.082 25155 10813 1 13 . 1 1 115 115 PHE C C 115 177.580 177.580 176.569 1.011 25155 10814 1 13 . 1 1 115 115 PHE CA C 115 58.677 58.677 56.601 2.076 25155 10815 1 13 . 1 1 115 115 PHE CB C 115 41.120 41.120 40.702 0.418 25155 10816 1 13 . 1 1 115 115 PHE H H 115 8.506 8.506 8.339 0.167 25155 10817 1 13 . 1 1 116 116 VAL N N 116 115.737 115.737 116.288 -0.551 25155 10818 1 13 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.400 0.078 25155 10819 1 13 . 1 1 116 116 VAL C C 116 175.300 175.300 175.879 -0.579 25155 10820 1 13 . 1 1 116 116 VAL CA C 116 58.877 58.877 60.478 -1.601 25155 10821 1 13 . 1 1 116 116 VAL CB C 116 34.120 34.120 34.511 -0.391 25155 10822 1 13 . 1 1 116 116 VAL H H 116 8.860 8.860 8.925 -0.065 25155 10823 1 13 . 1 1 117 117 GLY N N 117 108.137 108.137 109.954 -1.817 25155 10824 1 13 . 1 1 117 117 GLY C C 117 176.110 176.110 174.990 1.120 25155 10825 1 13 . 1 1 117 117 GLY CA C 117 47.500 47.500 45.699 1.801 25155 10826 1 13 . 1 1 117 117 GLY H H 117 9.838 9.838 9.430 0.408 25155 10827 1 13 . 1 1 118 118 TYR N N 118 120.380 120.380 119.698 0.682 25155 10828 1 13 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.574 0.396 25155 10829 1 13 . 1 1 118 118 TYR C C 118 177.630 177.630 175.250 2.380 25155 10830 1 13 . 1 1 118 118 TYR CA C 118 55.800 55.800 58.463 -2.663 25155 10831 1 13 . 1 1 118 118 TYR CB C 118 35.970 35.970 38.620 -2.650 25155 10832 1 13 . 1 1 118 118 TYR H H 118 8.652 8.652 8.153 0.499 25155 10833 1 13 . 1 1 119 119 TRP N N 119 126.040 126.040 123.607 2.433 25155 10834 1 13 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.091 0.929 25155 10835 1 13 . 1 1 119 119 TRP C C 119 173.000 173.000 173.366 -0.366 25155 10836 1 13 . 1 1 119 119 TRP CA C 119 53.820 53.820 54.039 -0.219 25155 10837 1 13 . 1 1 119 119 TRP CB C 119 36.050 36.050 33.698 2.352 25155 10838 1 13 . 1 1 119 119 TRP H H 119 8.070 8.070 8.577 -0.507 25155 10839 1 13 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.645 0.139 25155 10840 1 13 . 1 1 120 120 PRO C C 120 176.870 176.870 176.868 0.002 25155 10841 1 13 . 1 1 120 120 PRO CA C 120 63.780 63.780 63.146 0.634 25155 10842 1 13 . 1 1 120 120 PRO CB C 120 31.990 31.990 31.995 -0.005 25155 10843 1 13 . 1 1 121 121 THR N N 121 109.310 109.310 114.764 -5.454 25155 10844 1 13 . 1 1 121 121 THR HA H 121 4.073 4.073 3.038 1.035 25155 10845 1 13 . 1 1 121 121 THR C C 121 176.324 176.324 175.123 1.201 25155 10846 1 13 . 1 1 121 121 THR CA C 121 61.250 61.250 63.395 -2.146 25155 10847 1 13 . 1 1 121 121 THR CB C 121 69.730 69.730 68.692 1.038 25155 10848 1 13 . 1 1 121 121 THR H H 121 7.370 7.370 8.394 -1.024 25155 10849 1 13 . 1 1 122 122 GLU N N 122 123.937 123.937 121.183 2.754 25155 10850 1 13 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.013 0.211 25155 10851 1 13 . 1 1 122 122 GLU C C 122 177.737 177.737 177.879 -0.142 25155 10852 1 13 . 1 1 122 122 GLU CA C 122 58.200 58.200 57.773 0.427 25155 10853 1 13 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.627 0.173 25155 10854 1 13 . 1 1 123 123 GLY N N 123 114.563 114.563 111.904 2.659 25155 10855 1 13 . 1 1 123 123 GLY C C 123 173.783 173.783 173.918 -0.135 25155 10856 1 13 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.479 -0.099 25155 10857 1 13 . 1 1 123 123 GLY H H 123 9.144 9.144 8.839 0.305 25155 10858 1 13 . 1 1 124 124 TYR N N 124 118.800 118.800 119.914 -1.114 25155 10859 1 13 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.682 0.536 25155 10860 1 13 . 1 1 124 124 TYR C C 124 175.673 175.673 175.868 -0.195 25155 10861 1 13 . 1 1 124 124 TYR CA C 124 56.950 56.950 58.235 -1.285 25155 10862 1 13 . 1 1 124 124 TYR CB C 124 41.100 41.100 40.005 1.095 25155 10863 1 13 . 1 1 124 124 TYR H H 124 7.895 7.895 7.740 0.155 25155 10864 1 13 . 1 1 125 125 GLU N N 125 124.790 124.790 123.238 1.552 25155 10865 1 13 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.586 0.099 25155 10866 1 13 . 1 1 125 125 GLU C C 125 172.877 172.877 174.931 -2.054 25155 10867 1 13 . 1 1 125 125 GLU CA C 125 55.700 55.700 55.156 0.544 25155 10868 1 13 . 1 1 125 125 GLU CB C 125 31.340 31.340 30.875 0.466 25155 10869 1 13 . 1 1 126 126 PHE N N 126 118.670 118.670 119.402 -0.732 25155 10870 1 13 . 1 1 126 126 PHE HA H 126 4.841 4.841 5.181 -0.341 25155 10871 1 13 . 1 1 126 126 PHE C C 126 173.800 173.800 174.051 -0.251 25155 10872 1 13 . 1 1 126 126 PHE CA C 126 56.950 56.950 56.580 0.370 25155 10873 1 13 . 1 1 126 126 PHE CB C 126 40.300 40.300 40.860 -0.560 25155 10874 1 13 . 1 1 126 126 PHE H H 126 7.645 7.645 8.016 -0.371 25155 10875 1 13 . 1 1 127 127 THR N N 127 107.038 107.038 113.721 -6.683 25155 10876 1 13 . 1 1 127 127 THR HA H 127 4.370 4.370 4.220 0.150 25155 10877 1 13 . 1 1 127 127 THR C C 127 175.100 175.100 175.008 0.092 25155 10878 1 13 . 1 1 127 127 THR CA C 127 61.080 61.080 61.540 -0.460 25155 10879 1 13 . 1 1 127 127 THR CB C 127 70.500 70.500 69.540 0.961 25155 10880 1 13 . 1 1 127 127 THR H H 127 7.306 7.306 8.720 -1.414 25155 10881 1 13 . 1 1 128 128 SER N N 128 118.150 118.150 120.876 -2.726 25155 10882 1 13 . 1 1 128 128 SER HA H 128 4.650 4.650 4.549 0.101 25155 10883 1 13 . 1 1 128 128 SER C C 128 175.760 175.760 174.012 1.748 25155 10884 1 13 . 1 1 128 128 SER CA C 128 55.813 55.813 59.563 -3.750 25155 10885 1 13 . 1 1 128 128 SER CB C 128 65.300 65.300 63.631 1.669 25155 10886 1 13 . 1 1 128 128 SER H H 128 7.354 7.354 8.078 -0.724 25155 10887 1 13 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.725 0.039 25155 10888 1 13 . 1 1 129 129 PRO C C 129 178.860 178.860 177.981 0.879 25155 10889 1 13 . 1 1 129 129 PRO CA C 129 62.728 62.728 64.208 -1.480 25155 10890 1 13 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.720 -0.320 25155 10891 1 13 . 1 1 130 130 LYS N N 130 122.158 122.158 119.899 2.259 25155 10892 1 13 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.161 0.049 25155 10893 1 13 . 1 1 130 130 LYS C C 130 176.890 176.890 176.082 0.808 25155 10894 1 13 . 1 1 130 130 LYS CA C 130 61.375 61.375 60.499 0.876 25155 10895 1 13 . 1 1 130 130 LYS CB C 130 30.350 30.350 30.750 -0.400 25155 10896 1 13 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.414 0.119 25155 10897 1 13 . 1 1 131 131 PRO C C 131 173.810 173.810 175.193 -1.383 25155 10898 1 13 . 1 1 131 131 PRO CA C 131 64.510 64.510 62.887 1.623 25155 10899 1 13 . 1 1 131 131 PRO CB C 131 31.745 31.745 30.867 0.878 25155 10900 1 13 . 1 1 132 132 VAL N N 132 114.480 114.480 112.934 1.546 25155 10901 1 13 . 1 1 132 132 VAL HA H 132 5.158 5.158 5.125 0.033 25155 10902 1 13 . 1 1 132 132 VAL C C 132 175.137 175.137 175.429 -0.292 25155 10903 1 13 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.467 0.333 25155 10904 1 13 . 1 1 132 132 VAL CB C 132 34.780 34.780 35.471 -0.692 25155 10905 1 13 . 1 1 132 132 VAL H H 132 6.716 6.716 7.452 -0.736 25155 10906 1 13 . 1 1 133 133 ILE N N 133 120.670 120.670 117.595 3.075 25155 10907 1 13 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.502 -0.110 25155 10908 1 13 . 1 1 133 133 ILE C C 133 175.485 175.485 175.893 -0.408 25155 10909 1 13 . 1 1 133 133 ILE CA C 133 60.000 60.000 59.691 0.309 25155 10910 1 13 . 1 1 133 133 ILE CB C 133 42.020 42.020 40.061 1.959 25155 10911 1 13 . 1 1 133 133 ILE H H 133 8.740 8.740 7.852 0.888 25155 10912 1 13 . 1 1 134 134 ALA N N 134 122.454 122.454 123.780 -1.326 25155 10913 1 13 . 1 1 134 134 ALA HA H 134 3.953 3.953 3.944 0.009 25155 10914 1 13 . 1 1 134 134 ALA C C 134 178.387 178.387 176.669 1.718 25155 10915 1 13 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.228 -0.178 25155 10916 1 13 . 1 1 134 134 ALA CB C 134 16.982 16.982 16.952 0.030 25155 10917 1 13 . 1 1 134 134 ALA H H 134 8.490 8.490 8.518 -0.028 25155 10918 1 13 . 1 1 135 135 ASP N N 135 117.310 117.310 117.053 0.257 25155 10919 1 13 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.319 -0.075 25155 10920 1 13 . 1 1 135 135 ASP C C 135 176.390 176.390 176.024 0.366 25155 10921 1 13 . 1 1 135 135 ASP CA C 135 55.120 55.120 54.692 0.428 25155 10922 1 13 . 1 1 135 135 ASP CB C 135 39.865 39.865 40.136 -0.271 25155 10923 1 13 . 1 1 136 136 GLY N N 136 104.336 104.336 105.685 -1.349 25155 10924 1 13 . 1 1 136 136 GLY C C 136 174.940 174.940 174.347 0.593 25155 10925 1 13 . 1 1 136 136 GLY CA C 136 45.150 45.150 45.069 0.081 25155 10926 1 13 . 1 1 136 136 GLY H H 136 7.592 7.592 8.081 -0.489 25155 10927 1 13 . 1 1 137 137 GLN N N 137 118.675 118.675 118.336 0.339 25155 10928 1 13 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.619 -0.557 25155 10929 1 13 . 1 1 137 137 GLN C C 137 176.420 176.420 174.939 1.481 25155 10930 1 13 . 1 1 137 137 GLN CA C 137 57.760 57.760 56.256 1.504 25155 10931 1 13 . 1 1 137 137 GLN CB C 137 30.400 30.400 31.665 -1.265 25155 10932 1 13 . 1 1 137 137 GLN H H 137 7.843 7.843 8.234 -0.391 25155 10933 1 13 . 1 1 138 138 LEU N N 138 118.160 118.160 118.483 -0.323 25155 10934 1 13 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.870 0.091 25155 10935 1 13 . 1 1 138 138 LEU C C 138 175.700 175.700 177.430 -1.730 25155 10936 1 13 . 1 1 138 138 LEU CA C 138 53.705 53.705 53.356 0.349 25155 10937 1 13 . 1 1 138 138 LEU CB C 138 46.480 46.480 44.393 2.087 25155 10938 1 13 . 1 1 138 138 LEU H H 138 7.356 7.356 7.404 -0.048 25155 10939 1 13 . 1 1 139 139 PHE N N 139 119.060 119.060 122.653 -3.593 25155 10940 1 13 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.492 0.852 25155 10941 1 13 . 1 1 139 139 PHE C C 139 178.850 178.850 175.805 3.045 25155 10942 1 13 . 1 1 139 139 PHE CA C 139 56.670 56.670 58.420 -1.750 25155 10943 1 13 . 1 1 139 139 PHE CB C 139 43.652 43.652 37.965 5.688 25155 10944 1 13 . 1 1 139 139 PHE H H 139 10.026 10.026 8.679 1.347 25155 10945 1 13 . 1 1 140 140 VAL N N 140 109.905 109.905 111.894 -1.989 25155 10946 1 13 . 1 1 140 140 VAL HA H 140 3.500 3.500 2.420 1.080 25155 10947 1 13 . 1 1 140 140 VAL C C 140 172.860 172.860 174.595 -1.735 25155 10948 1 13 . 1 1 140 140 VAL CA C 140 61.812 61.812 62.695 -0.883 25155 10949 1 13 . 1 1 140 140 VAL CB C 140 30.250 30.250 29.872 0.378 25155 10950 1 13 . 1 1 140 140 VAL H H 140 7.550 7.550 6.847 0.703 25155 10951 1 13 . 1 1 141 141 GLY N N 141 106.600 106.600 103.914 2.686 25155 10952 1 13 . 1 1 141 141 GLY C C 141 171.350 171.350 172.616 -1.266 25155 10953 1 13 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.357 1.103 25155 10954 1 13 . 1 1 141 141 GLY H H 141 7.052 7.052 7.186 -0.134 25155 10955 1 13 . 1 1 142 142 LEU N N 142 117.820 117.820 119.648 -1.828 25155 10956 1 13 . 1 1 142 142 LEU HA H 142 4.962 4.962 4.328 0.634 25155 10957 1 13 . 1 1 142 142 LEU CA C 142 55.600 55.600 54.548 1.052 25155 10958 1 13 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.825 -4.895 25155 10959 1 13 . 1 1 142 142 LEU H H 142 7.643 7.643 8.394 -0.751 25155 10960 1 13 . 1 1 143 143 ALA HA H 143 4.220 4.220 3.864 0.356 25155 10961 1 13 . 1 1 143 143 ALA C C 143 175.505 175.505 175.631 -0.126 25155 10962 1 13 . 1 1 143 143 ALA CA C 143 49.600 49.600 50.472 -0.872 25155 10963 1 13 . 1 1 143 143 ALA CB C 143 23.330 23.330 18.728 4.602 25155 10964 1 13 . 1 1 144 144 LEU N N 144 124.960 124.960 122.415 2.545 25155 10965 1 13 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.409 0.371 25155 10966 1 13 . 1 1 144 144 LEU C C 144 174.700 174.700 174.857 -0.157 25155 10967 1 13 . 1 1 144 144 LEU CA C 144 52.790 52.790 53.835 -1.045 25155 10968 1 13 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.027 0.273 25155 10969 1 13 . 1 1 144 144 LEU H H 144 8.583 8.583 7.493 1.090 25155 10970 1 13 . 1 1 145 145 ASP N N 145 119.100 119.100 121.436 -2.336 25155 10971 1 13 . 1 1 145 145 ASP HA H 145 5.422 5.422 5.127 0.295 25155 10972 1 13 . 1 1 145 145 ASP C C 145 176.180 176.180 176.263 -0.083 25155 10973 1 13 . 1 1 145 145 ASP CA C 145 53.600 53.600 53.504 0.096 25155 10974 1 13 . 1 1 145 145 ASP CB C 145 43.180 43.180 42.002 1.179 25155 10975 1 13 . 1 1 147 147 THR HA H 147 4.093 4.093 4.188 -0.095 25155 10976 1 13 . 1 1 147 147 THR C C 147 175.858 175.858 176.292 -0.434 25155 10977 1 13 . 1 1 147 147 THR CA C 147 66.400 66.400 65.616 0.784 25155 10978 1 13 . 1 1 147 147 THR CB C 147 69.400 69.400 68.667 0.733 25155 10979 1 13 . 1 1 147 147 THR H H 147 8.745 8.745 8.017 0.728 25155 10980 1 13 . 1 1 148 148 ASN N N 148 115.408 115.408 117.980 -2.572 25155 10981 1 13 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.794 0.216 25155 10982 1 13 . 1 1 148 148 ASN C C 148 175.750 175.750 175.170 0.580 25155 10983 1 13 . 1 1 148 148 ASN CA C 148 53.400 53.400 54.658 -1.258 25155 10984 1 13 . 1 1 148 148 ASN CB C 148 41.900 41.900 40.654 1.246 25155 10985 1 13 . 1 1 148 148 ASN H H 148 8.975 8.975 8.590 0.385 25155 10986 1 13 . 1 1 149 149 GLN N N 149 117.900 117.900 117.482 0.418 25155 10987 1 13 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.477 0.459 25155 10988 1 13 . 1 1 149 149 GLN C C 149 178.280 178.280 175.606 2.674 25155 10989 1 13 . 1 1 149 149 GLN CA C 149 53.730 53.730 54.745 -1.014 25155 10990 1 13 . 1 1 149 149 GLN CB C 149 29.790 29.790 28.041 1.749 25155 10991 1 13 . 1 1 149 149 GLN H H 149 7.430 7.430 8.113 -0.683 25155 10992 1 13 . 1 1 150 150 TYR N N 150 121.060 121.060 121.358 -0.298 25155 10993 1 13 . 1 1 150 150 TYR HA H 150 4.671 4.671 4.147 0.524 25155 10994 1 13 . 1 1 150 150 TYR C C 150 178.680 178.680 176.252 2.428 25155 10995 1 13 . 1 1 150 150 TYR CA C 150 57.930 57.930 60.375 -2.445 25155 10996 1 13 . 1 1 150 150 TYR CB C 150 38.860 38.860 37.244 1.616 25155 10997 1 13 . 1 1 150 150 TYR H H 150 8.115 8.115 7.698 0.417 25155 10998 1 13 . 1 1 151 151 ASP N N 151 121.175 121.175 119.854 1.321 25155 10999 1 13 . 1 1 151 151 ASP CA C 151 57.000 57.000 56.374 0.626 25155 11000 1 13 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.671 1.329 25155 11001 1 13 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.582 0.008 25155 11002 1 13 . 1 1 152 152 LEU C C 152 178.300 178.300 178.033 0.267 25155 11003 1 13 . 1 1 152 152 LEU CA C 152 54.788 54.788 54.944 -0.156 25155 11004 1 13 . 1 1 152 152 LEU CB C 152 42.200 42.200 41.380 0.820 25155 11005 1 13 . 1 1 153 153 SER N N 153 116.170 116.170 117.262 -1.092 25155 11006 1 13 . 1 1 153 153 SER HA H 153 3.911 3.911 4.116 -0.205 25155 11007 1 13 . 1 1 153 153 SER CA C 153 63.400 63.400 62.722 0.678 25155 11008 1 13 . 1 1 153 153 SER CB C 153 63.200 63.200 62.854 0.346 25155 11009 1 13 . 1 1 153 153 SER H H 153 7.378 7.378 7.732 -0.354 25155 11010 1 13 . 1 1 154 154 ASP N N 154 121.640 121.640 120.726 0.914 25155 11011 1 13 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.363 -0.123 25155 11012 1 13 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.863 1.437 25155 11013 1 13 . 1 1 154 154 ASP CB C 154 40.000 40.000 40.902 -0.902 25155 11014 1 13 . 1 1 155 155 GLU HA H 155 4.170 4.170 4.018 0.152 25155 11015 1 13 . 1 1 155 155 GLU C C 155 179.420 179.420 178.930 0.490 25155 11016 1 13 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.242 -0.042 25155 11017 1 13 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.676 -0.196 25155 11018 1 13 . 1 1 156 156 ARG N N 156 121.230 121.230 119.172 2.058 25155 11019 1 13 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.294 -0.018 25155 11020 1 13 . 1 1 156 156 ARG C C 156 177.350 177.350 179.386 -2.036 25155 11021 1 13 . 1 1 156 156 ARG CA C 156 59.950 59.950 59.065 0.885 25155 11022 1 13 . 1 1 156 156 ARG CB C 156 31.100 31.100 29.897 1.203 25155 11023 1 13 . 1 1 157 157 ILE N N 157 118.190 118.190 120.251 -2.061 25155 11024 1 13 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.663 -0.233 25155 11025 1 13 . 1 1 157 157 ILE C C 157 178.480 178.480 178.189 0.291 25155 11026 1 13 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.462 1.098 25155 11027 1 13 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.756 0.724 25155 11028 1 13 . 1 1 157 157 ILE H H 157 8.705 8.705 8.136 0.569 25155 11029 1 13 . 1 1 158 158 GLN N N 158 119.975 119.975 120.326 -0.351 25155 11030 1 13 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.923 0.033 25155 11031 1 13 . 1 1 158 158 GLN C C 158 178.730 178.730 178.319 0.411 25155 11032 1 13 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.338 1.362 25155 11033 1 13 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.280 0.202 25155 11034 1 13 . 1 1 158 158 GLN H H 158 8.262 8.262 8.646 -0.384 25155 11035 1 13 . 1 1 159 159 SER N N 159 115.466 115.466 114.431 1.035 25155 11036 1 13 . 1 1 159 159 SER HA H 159 4.446 4.446 4.285 0.161 25155 11037 1 13 . 1 1 159 159 SER C C 159 177.320 177.320 177.053 0.267 25155 11038 1 13 . 1 1 159 159 SER CA C 159 63.500 63.500 61.787 1.713 25155 11039 1 13 . 1 1 159 159 SER CB C 159 63.818 63.818 62.855 0.963 25155 11040 1 13 . 1 1 159 159 SER H H 159 8.440 8.440 7.908 0.532 25155 11041 1 13 . 1 1 160 160 TRP N N 160 126.784 126.784 125.071 1.713 25155 11042 1 13 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.413 0.041 25155 11043 1 13 . 1 1 160 160 TRP C C 160 177.934 177.934 177.715 0.219 25155 11044 1 13 . 1 1 160 160 TRP CA C 160 62.745 62.745 62.272 0.473 25155 11045 1 13 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.258 0.093 25155 11046 1 13 . 1 1 160 160 TRP H H 160 9.243 9.243 7.708 1.535 25155 11047 1 13 . 1 1 161 161 CYS N N 161 116.395 116.395 118.151 -1.756 25155 11048 1 13 . 1 1 161 161 CYS HA H 161 3.886 3.886 3.763 0.123 25155 11049 1 13 . 1 1 161 161 CYS C C 161 176.245 176.245 177.084 -0.839 25155 11050 1 13 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.575 0.726 25155 11051 1 13 . 1 1 161 161 CYS CB C 161 27.723 27.723 27.200 0.523 25155 11052 1 13 . 1 1 161 161 CYS H H 161 8.845 8.845 9.009 -0.164 25155 11053 1 13 . 1 1 162 162 GLU N N 162 118.030 118.030 119.477 -1.447 25155 11054 1 13 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.867 0.053 25155 11055 1 13 . 1 1 162 162 GLU C C 162 178.700 178.700 178.734 -0.034 25155 11056 1 13 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.542 0.258 25155 11057 1 13 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.252 0.248 25155 11058 1 13 . 1 1 163 163 GLN N N 163 120.650 120.650 119.540 1.110 25155 11059 1 13 . 1 1 163 163 GLN HA H 163 4.173 4.173 4.042 0.131 25155 11060 1 13 . 1 1 163 163 GLN C C 163 179.700 179.700 178.472 1.228 25155 11061 1 13 . 1 1 163 163 GLN CA C 163 59.688 59.688 58.959 0.729 25155 11062 1 13 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.790 0.111 25155 11063 1 13 . 1 1 163 163 GLN H H 163 8.148 8.148 7.692 0.456 25155 11064 1 13 . 1 1 164 164 ILE N N 164 114.836 114.836 117.152 -2.316 25155 11065 1 13 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.615 0.445 25155 11066 1 13 . 1 1 164 164 ILE C C 164 178.676 178.676 177.651 1.025 25155 11067 1 13 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.429 1.731 25155 11068 1 13 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.275 0.355 25155 11069 1 13 . 1 1 164 164 ILE H H 164 8.958 8.958 8.259 0.699 25155 11070 1 13 . 1 1 165 165 LEU N N 165 123.700 123.700 119.508 4.192 25155 11071 1 13 . 1 1 165 165 LEU HA H 165 4.100 4.100 4.028 0.072 25155 11072 1 13 . 1 1 165 165 LEU C C 165 180.548 180.548 178.375 2.173 25155 11073 1 13 . 1 1 165 165 LEU CA C 165 58.150 58.150 58.294 -0.144 25155 11074 1 13 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.458 -0.328 25155 11075 1 13 . 1 1 165 165 LEU H H 165 7.830 7.830 7.804 0.025 25155 11076 1 13 . 1 1 166 166 ASN N N 166 120.160 120.160 118.547 1.613 25155 11077 1 13 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.371 0.199 25155 11078 1 13 . 1 1 166 166 ASN C C 166 175.690 175.690 177.372 -1.682 25155 11079 1 13 . 1 1 166 166 ASN CA C 166 55.946 55.946 56.923 -0.977 25155 11080 1 13 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.338 0.142 25155 11081 1 13 . 1 1 166 166 ASN H H 166 7.706 7.706 7.750 -0.044 25155 11082 1 13 . 1 1 167 167 GLU N N 167 121.286 121.286 121.138 0.148 25155 11083 1 13 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.041 0.063 25155 11084 1 13 . 1 1 167 167 GLU C C 167 180.520 180.520 179.344 1.176 25155 11085 1 13 . 1 1 167 167 GLU CA C 167 59.920 59.920 59.208 0.712 25155 11086 1 13 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.717 1.208 25155 11087 1 13 . 1 1 168 168 MET N N 168 118.622 118.622 115.678 2.944 25155 11088 1 13 . 1 1 168 168 MET HA H 168 3.996 3.996 4.300 -0.304 25155 11089 1 13 . 1 1 168 168 MET C C 168 176.856 176.856 177.804 -0.948 25155 11090 1 13 . 1 1 168 168 MET CA C 168 59.500 59.500 58.754 0.746 25155 11091 1 13 . 1 1 168 168 MET CB C 168 33.700 33.700 32.655 1.045 25155 11092 1 13 . 1 1 168 168 MET H H 168 8.723 8.723 8.381 0.342 25155 11093 1 13 . 1 1 169 169 ALA N N 169 121.760 121.760 123.617 -1.857 25155 11094 1 13 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.296 -0.140 25155 11095 1 13 . 1 1 169 169 ALA C C 169 179.790 179.790 179.809 -0.019 25155 11096 1 13 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.463 0.337 25155 11097 1 13 . 1 1 169 169 ALA CB C 169 18.220 18.220 18.656 -0.436 25155 11098 1 13 . 1 1 169 169 ALA H H 169 7.494 7.494 7.742 -0.248 25155 11099 1 13 . 1 1 170 170 GLU N N 170 116.970 116.970 117.949 -0.979 25155 11100 1 13 . 1 1 170 170 GLU HA H 170 4.091 4.091 4.006 0.085 25155 11101 1 13 . 1 1 170 170 GLU C C 170 177.745 177.745 178.297 -0.552 25155 11102 1 13 . 1 1 170 170 GLU CA C 170 58.000 58.000 58.832 -0.832 25155 11103 1 13 . 1 1 170 170 GLU CB C 170 29.730 29.730 29.564 0.166 25155 11104 1 13 . 1 1 171 171 HIS N N 171 118.150 118.150 117.157 0.993 25155 11105 1 13 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.349 0.121 25155 11106 1 13 . 1 1 171 171 HIS C C 171 175.848 175.848 176.203 -0.355 25155 11107 1 13 . 1 1 171 171 HIS CA C 171 57.600 57.600 58.250 -0.650 25155 11108 1 13 . 1 1 171 171 HIS CB C 171 30.800 30.800 29.946 0.854 25155 11109 1 13 . 1 1 171 171 HIS H H 171 7.717 7.717 7.911 -0.194 25155 11110 1 13 . 1 1 172 172 TYR N N 172 119.483 119.483 118.085 1.398 25155 11111 1 13 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.372 0.218 25155 11112 1 13 . 1 1 172 172 TYR C C 172 174.590 174.590 176.242 -1.652 25155 11113 1 13 . 1 1 172 172 TYR CA C 172 57.813 57.813 58.535 -0.722 25155 11114 1 13 . 1 1 172 172 TYR CB C 172 38.900 38.900 38.689 0.211 25155 11115 1 13 . 1 1 172 172 TYR H H 172 7.778 7.778 7.609 0.169 25155 11116 1 14 . 1 1 2 2 ASN N N 2 122.966 122.966 119.324 3.642 25155 11117 1 14 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.108 0.067 25155 11118 1 14 . 1 1 2 2 ASN C C 2 175.200 175.200 173.161 2.039 25155 11119 1 14 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.372 0.548 25155 11120 1 14 . 1 1 2 2 ASN CB C 2 40.000 40.000 41.587 -1.587 25155 11121 1 14 . 1 1 2 2 ASN H H 2 9.392 9.392 8.284 1.108 25155 11122 1 14 . 1 1 3 3 MET N N 3 120.660 120.660 116.991 3.669 25155 11123 1 14 . 1 1 3 3 MET HA H 3 5.565 5.565 5.270 0.295 25155 11124 1 14 . 1 1 3 3 MET C C 3 174.200 174.200 175.504 -1.304 25155 11125 1 14 . 1 1 3 3 MET CA C 3 54.550 54.550 54.520 0.030 25155 11126 1 14 . 1 1 3 3 MET CB C 3 34.100 34.100 36.716 -2.616 25155 11127 1 14 . 1 1 3 3 MET H H 3 8.745 8.745 9.137 -0.392 25155 11128 1 14 . 1 1 4 4 GLY N N 4 115.792 115.792 109.707 6.085 25155 11129 1 14 . 1 1 4 4 GLY C C 4 170.444 170.444 171.383 -0.939 25155 11130 1 14 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.098 -0.211 25155 11131 1 14 . 1 1 4 4 GLY H H 4 8.989 8.989 9.036 -0.047 25155 11132 1 14 . 1 1 5 5 LEU N N 5 131.175 131.175 126.703 4.472 25155 11133 1 14 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.184 1.138 25155 11134 1 14 . 1 1 5 5 LEU C C 5 175.700 175.700 174.283 1.417 25155 11135 1 14 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.113 0.207 25155 11136 1 14 . 1 1 5 5 LEU CB C 5 44.700 44.700 44.047 0.653 25155 11137 1 14 . 1 1 5 5 LEU H H 5 8.917 8.917 8.473 0.444 25155 11138 1 14 . 1 1 6 6 PHE N N 6 125.990 125.990 123.934 2.056 25155 11139 1 14 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.138 0.600 25155 11140 1 14 . 1 1 6 6 PHE C C 6 174.358 174.358 173.216 1.142 25155 11141 1 14 . 1 1 6 6 PHE CA C 6 55.480 55.480 55.106 0.374 25155 11142 1 14 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.686 -0.636 25155 11143 1 14 . 1 1 6 6 PHE H H 6 9.225 9.225 8.975 0.250 25155 11144 1 14 . 1 1 7 7 TYR N N 7 118.040 118.040 117.463 0.577 25155 11145 1 14 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.558 0.371 25155 11146 1 14 . 1 1 7 7 TYR C C 7 171.690 171.690 174.490 -2.800 25155 11147 1 14 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.470 -1.010 25155 11148 1 14 . 1 1 7 7 TYR CB C 7 40.800 40.800 40.578 0.222 25155 11149 1 14 . 1 1 7 7 TYR H H 7 8.235 8.235 8.168 0.067 25155 11150 1 14 . 1 1 8 8 GLY N N 8 106.640 106.640 106.970 -0.330 25155 11151 1 14 . 1 1 8 8 GLY C C 8 171.682 171.682 174.698 -3.016 25155 11152 1 14 . 1 1 8 8 GLY CA C 8 44.050 44.050 44.933 -0.883 25155 11153 1 14 . 1 1 8 8 GLY H H 8 6.996 6.996 8.957 -1.961 25155 11154 1 14 . 1 1 9 9 SER N N 9 118.164 118.164 120.683 -2.519 25155 11155 1 14 . 1 1 9 9 SER C C 9 174.560 174.560 175.535 -0.975 25155 11156 1 14 . 1 1 9 9 SER CA C 9 57.140 57.140 58.988 -1.848 25155 11157 1 14 . 1 1 9 9 SER H H 9 9.680 9.680 9.285 0.395 25155 11158 1 14 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.815 -0.185 25155 11159 1 14 . 1 1 17 17 ALA C C 17 177.740 177.740 179.190 -1.450 25155 11160 1 14 . 1 1 17 17 ALA CA C 17 54.900 54.900 55.050 -0.150 25155 11161 1 14 . 1 1 17 17 ALA CB C 17 17.790 17.790 17.777 0.013 25155 11162 1 14 . 1 1 17 17 ALA H H 17 8.055 8.055 7.349 0.706 25155 11163 1 14 . 1 1 18 18 ALA N N 18 120.026 120.026 121.097 -1.071 25155 11164 1 14 . 1 1 18 18 ALA HA H 18 3.713 3.713 3.803 -0.090 25155 11165 1 14 . 1 1 18 18 ALA C C 18 179.040 179.040 179.611 -0.571 25155 11166 1 14 . 1 1 18 18 ALA CA C 18 54.860 54.860 54.950 -0.090 25155 11167 1 14 . 1 1 18 18 ALA CB C 18 18.200 18.200 17.851 0.349 25155 11168 1 14 . 1 1 18 18 ALA H H 18 7.015 7.015 8.212 -1.197 25155 11169 1 14 . 1 1 19 19 GLU N N 19 116.656 116.656 118.466 -1.810 25155 11170 1 14 . 1 1 19 19 GLU HA H 19 3.580 3.580 3.904 -0.324 25155 11171 1 14 . 1 1 19 19 GLU C C 19 178.487 178.487 179.227 -0.740 25155 11172 1 14 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.885 -0.215 25155 11173 1 14 . 1 1 19 19 GLU CB C 19 29.400 29.400 29.566 -0.166 25155 11174 1 14 . 1 1 20 20 LYS N N 20 120.100 120.100 119.673 0.427 25155 11175 1 14 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.052 0.294 25155 11176 1 14 . 1 1 20 20 LYS C C 20 175.330 175.330 179.105 -3.775 25155 11177 1 14 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.296 -2.196 25155 11178 1 14 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.479 0.521 25155 11179 1 14 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.610 -0.145 25155 11180 1 14 . 1 1 21 21 ILE C C 21 177.680 177.680 177.878 -0.198 25155 11181 1 14 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.766 -0.126 25155 11182 1 14 . 1 1 21 21 ILE CB C 21 38.030 38.030 37.781 0.249 25155 11183 1 14 . 1 1 21 21 ILE H H 21 8.220 8.220 8.555 -0.335 25155 11184 1 14 . 1 1 22 22 ARG N N 22 119.433 119.433 119.720 -0.287 25155 11185 1 14 . 1 1 22 22 ARG HA H 22 3.550 3.550 3.897 -0.347 25155 11186 1 14 . 1 1 22 22 ARG C C 22 177.268 177.268 178.260 -0.992 25155 11187 1 14 . 1 1 22 22 ARG CA C 22 59.760 59.760 59.697 0.063 25155 11188 1 14 . 1 1 22 22 ARG CB C 22 28.900 28.900 29.913 -1.013 25155 11189 1 14 . 1 1 23 23 ASP N N 23 118.945 118.945 119.610 -0.665 25155 11190 1 14 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.439 -0.097 25155 11191 1 14 . 1 1 23 23 ASP C C 23 178.470 178.470 178.871 -0.401 25155 11192 1 14 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.251 0.199 25155 11193 1 14 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.863 -0.493 25155 11194 1 14 . 1 1 24 24 ILE N N 24 121.200 121.200 119.269 1.931 25155 11195 1 14 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.799 -0.065 25155 11196 1 14 . 1 1 24 24 ILE C C 24 178.297 178.297 177.874 0.423 25155 11197 1 14 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.662 -0.162 25155 11198 1 14 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.449 0.291 25155 11199 1 14 . 1 1 24 24 ILE H H 24 8.160 8.160 8.032 0.128 25155 11200 1 14 . 1 1 25 25 ILE N N 25 121.166 121.166 117.732 3.434 25155 11201 1 14 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.905 -0.262 25155 11202 1 14 . 1 1 25 25 ILE C C 25 176.825 176.825 176.636 0.189 25155 11203 1 14 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.090 2.800 25155 11204 1 14 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.933 -1.183 25155 11205 1 14 . 1 1 25 25 ILE H H 25 8.480 8.480 8.025 0.455 25155 11206 1 14 . 1 1 26 26 GLY N N 26 109.050 109.050 105.057 3.993 25155 11207 1 14 . 1 1 26 26 GLY C C 26 173.800 173.800 172.575 1.225 25155 11208 1 14 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.475 -0.075 25155 11209 1 14 . 1 1 26 26 GLY H H 26 7.945 7.945 7.685 0.260 25155 11210 1 14 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.461 -0.098 25155 11211 1 14 . 1 1 27 27 PRO C C 27 177.157 177.157 176.964 0.193 25155 11212 1 14 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.794 0.736 25155 11213 1 14 . 1 1 27 27 PRO CB C 27 32.000 32.000 32.093 -0.093 25155 11214 1 14 . 1 1 28 28 GLU N N 28 116.510 116.510 116.900 -0.390 25155 11215 1 14 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.235 0.025 25155 11216 1 14 . 1 1 28 28 GLU C C 28 177.000 177.000 177.016 -0.016 25155 11217 1 14 . 1 1 28 28 GLU CA C 28 57.680 57.680 57.789 -0.109 25155 11218 1 14 . 1 1 28 28 GLU CB C 28 28.620 28.620 29.197 -0.577 25155 11219 1 14 . 1 1 29 29 LEU N N 29 120.334 120.334 112.217 8.117 25155 11220 1 14 . 1 1 29 29 LEU HA H 29 4.650 4.650 4.762 -0.112 25155 11221 1 14 . 1 1 29 29 LEU C C 29 175.676 175.676 175.187 0.489 25155 11222 1 14 . 1 1 29 29 LEU CA C 29 55.924 55.924 54.995 0.929 25155 11223 1 14 . 1 1 29 29 LEU CB C 29 44.880 44.880 44.238 0.642 25155 11224 1 14 . 1 1 29 29 LEU H H 29 7.924 7.924 7.556 0.368 25155 11225 1 14 . 1 1 30 30 VAL N N 30 118.900 118.900 120.491 -1.591 25155 11226 1 14 . 1 1 30 30 VAL HA H 30 4.639 4.639 4.901 -0.262 25155 11227 1 14 . 1 1 30 30 VAL C C 30 174.368 174.368 176.053 -1.685 25155 11228 1 14 . 1 1 30 30 VAL CA C 30 61.110 61.110 60.679 0.431 25155 11229 1 14 . 1 1 30 30 VAL CB C 30 34.500 34.500 33.823 0.677 25155 11230 1 14 . 1 1 30 30 VAL H H 30 7.486 7.486 7.584 -0.098 25155 11231 1 14 . 1 1 31 31 THR N N 31 124.000 124.000 119.798 4.202 25155 11232 1 14 . 1 1 31 31 THR HA H 31 4.331 4.331 4.742 -0.411 25155 11233 1 14 . 1 1 31 31 THR C C 31 172.670 172.670 172.917 -0.247 25155 11234 1 14 . 1 1 31 31 THR CA C 31 61.784 61.784 61.310 0.474 25155 11235 1 14 . 1 1 31 31 THR CB C 31 70.483 70.483 71.068 -0.585 25155 11236 1 14 . 1 1 31 31 THR H H 31 7.947 7.947 8.279 -0.332 25155 11237 1 14 . 1 1 32 32 LEU N N 32 127.408 127.408 125.953 1.455 25155 11238 1 14 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.844 -0.207 25155 11239 1 14 . 1 1 32 32 LEU C C 32 176.425 176.425 177.612 -1.187 25155 11240 1 14 . 1 1 32 32 LEU CA C 32 54.760 54.760 54.376 0.384 25155 11241 1 14 . 1 1 32 32 LEU CB C 32 43.809 43.809 42.871 0.938 25155 11242 1 14 . 1 1 32 32 LEU H H 32 8.614 8.614 8.883 -0.269 25155 11243 1 14 . 1 1 33 33 HIS N N 33 120.230 120.230 123.156 -2.926 25155 11244 1 14 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.938 -0.518 25155 11245 1 14 . 1 1 33 33 HIS C C 33 171.914 171.914 174.502 -2.588 25155 11246 1 14 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.805 0.495 25155 11247 1 14 . 1 1 33 33 HIS CB C 33 32.050 32.050 31.998 0.052 25155 11248 1 14 . 1 1 33 33 HIS H H 33 9.130 9.130 8.895 0.235 25155 11249 1 14 . 1 1 34 34 ASN N N 34 123.987 123.987 119.948 4.039 25155 11250 1 14 . 1 1 34 34 ASN HA H 34 3.600 3.600 4.776 -1.176 25155 11251 1 14 . 1 1 34 34 ASN C C 34 177.930 177.930 174.734 3.196 25155 11252 1 14 . 1 1 34 34 ASN CA C 34 51.730 51.730 51.897 -0.167 25155 11253 1 14 . 1 1 34 34 ASN CB C 34 38.747 38.747 39.562 -0.814 25155 11254 1 14 . 1 1 34 34 ASN H H 34 8.759 8.759 9.372 -0.613 25155 11255 1 14 . 1 1 35 35 LEU N N 35 128.751 128.751 125.790 2.961 25155 11256 1 14 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.495 -0.205 25155 11257 1 14 . 1 1 35 35 LEU C C 35 177.363 177.363 177.888 -0.525 25155 11258 1 14 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.131 0.419 25155 11259 1 14 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.818 0.944 25155 11260 1 14 . 1 1 35 35 LEU H H 35 8.758 8.758 8.463 0.295 25155 11261 1 14 . 1 1 36 36 LYS N N 36 120.870 120.870 118.713 2.157 25155 11262 1 14 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.192 -0.259 25155 11263 1 14 . 1 1 36 36 LYS C C 36 176.540 176.540 176.557 -0.017 25155 11264 1 14 . 1 1 36 36 LYS CA C 36 59.260 59.260 57.781 1.479 25155 11265 1 14 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.573 0.227 25155 11266 1 14 . 1 1 37 37 ASP N N 37 115.288 115.288 118.348 -3.060 25155 11267 1 14 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.661 0.086 25155 11268 1 14 . 1 1 37 37 ASP C C 37 175.500 175.500 175.944 -0.444 25155 11269 1 14 . 1 1 37 37 ASP CA C 37 54.805 54.805 54.500 0.305 25155 11270 1 14 . 1 1 37 37 ASP CB C 37 44.650 44.650 42.746 1.904 25155 11271 1 14 . 1 1 38 38 ASP N N 38 121.550 121.550 118.980 2.570 25155 11272 1 14 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.896 -0.031 25155 11273 1 14 . 1 1 38 38 ASP C C 38 174.895 174.895 175.627 -0.732 25155 11274 1 14 . 1 1 38 38 ASP CA C 38 52.840 52.840 52.905 -0.065 25155 11275 1 14 . 1 1 38 38 ASP CB C 38 42.240 42.240 42.916 -0.676 25155 11276 1 14 . 1 1 39 39 SER N N 39 115.170 115.170 115.122 0.048 25155 11277 1 14 . 1 1 39 39 SER HA H 39 4.600 4.600 4.663 -0.063 25155 11278 1 14 . 1 1 39 39 SER C C 39 174.930 174.930 174.512 0.418 25155 11279 1 14 . 1 1 39 39 SER CA C 39 54.786 54.786 55.581 -0.796 25155 11280 1 14 . 1 1 39 39 SER CB C 39 64.840 64.840 63.653 1.187 25155 11281 1 14 . 1 1 39 39 SER H H 39 8.330 8.330 8.415 -0.085 25155 11282 1 14 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.212 -0.212 25155 11283 1 14 . 1 1 40 40 PRO C C 40 176.620 176.620 178.287 -1.667 25155 11284 1 14 . 1 1 40 40 PRO CA C 40 63.870 63.870 64.473 -0.603 25155 11285 1 14 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.942 -0.581 25155 11286 1 14 . 1 1 41 41 LYS N N 41 120.913 120.913 118.362 2.551 25155 11287 1 14 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.050 -0.154 25155 11288 1 14 . 1 1 41 41 LYS C C 41 179.580 179.580 178.956 0.624 25155 11289 1 14 . 1 1 41 41 LYS CA C 41 58.000 58.000 58.935 -0.936 25155 11290 1 14 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.121 0.979 25155 11291 1 14 . 1 1 42 42 LEU N N 42 118.206 118.206 119.972 -1.766 25155 11292 1 14 . 1 1 42 42 LEU HA H 42 4.025 4.025 3.984 0.041 25155 11293 1 14 . 1 1 42 42 LEU C C 42 178.630 178.630 178.559 0.071 25155 11294 1 14 . 1 1 42 42 LEU CA C 42 57.030 57.030 57.563 -0.533 25155 11295 1 14 . 1 1 42 42 LEU CB C 42 41.820 41.820 41.412 0.408 25155 11296 1 14 . 1 1 42 42 LEU H H 42 7.598 7.598 8.049 -0.451 25155 11297 1 14 . 1 1 43 43 MET N N 43 118.913 118.913 116.974 1.939 25155 11298 1 14 . 1 1 43 43 MET HA H 43 3.760 3.760 4.354 -0.594 25155 11299 1 14 . 1 1 43 43 MET C C 43 177.710 177.710 178.630 -0.920 25155 11300 1 14 . 1 1 43 43 MET CA C 43 59.864 59.864 58.846 1.018 25155 11301 1 14 . 1 1 43 43 MET CB C 43 32.680 32.680 31.999 0.681 25155 11302 1 14 . 1 1 43 43 MET H H 43 8.180 8.180 8.101 0.079 25155 11303 1 14 . 1 1 44 44 GLU N N 44 110.906 110.906 119.591 -8.685 25155 11304 1 14 . 1 1 44 44 GLU HA H 44 3.732 3.732 4.058 -0.326 25155 11305 1 14 . 1 1 44 44 GLU C C 44 178.120 178.120 179.117 -0.997 25155 11306 1 14 . 1 1 44 44 GLU CA C 44 59.450 59.450 59.340 0.110 25155 11307 1 14 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.174 0.626 25155 11308 1 14 . 1 1 45 45 GLN N N 45 115.770 115.770 116.894 -1.124 25155 11309 1 14 . 1 1 45 45 GLN HA H 45 4.190 4.190 4.077 0.113 25155 11310 1 14 . 1 1 45 45 GLN C C 45 175.480 175.480 176.710 -1.230 25155 11311 1 14 . 1 1 45 45 GLN CA C 45 56.100 56.100 56.919 -0.819 25155 11312 1 14 . 1 1 45 45 GLN CB C 45 28.490 28.490 29.101 -0.611 25155 11313 1 14 . 1 1 45 45 GLN H H 45 7.517 7.517 7.673 -0.156 25155 11314 1 14 . 1 1 46 46 TYR N N 46 117.840 117.840 118.533 -0.693 25155 11315 1 14 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.603 0.057 25155 11316 1 14 . 1 1 46 46 TYR C C 46 175.480 175.480 176.445 -0.965 25155 11317 1 14 . 1 1 46 46 TYR CA C 46 58.827 58.827 58.643 0.184 25155 11318 1 14 . 1 1 46 46 TYR CB C 46 41.720 41.720 38.760 2.960 25155 11319 1 14 . 1 1 46 46 TYR H H 46 6.955 6.955 7.536 -0.581 25155 11320 1 14 . 1 1 47 47 ASP N N 47 121.540 121.540 122.845 -1.305 25155 11321 1 14 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.639 0.057 25155 11322 1 14 . 1 1 47 47 ASP C C 47 175.677 175.677 175.844 -0.167 25155 11323 1 14 . 1 1 47 47 ASP CA C 47 56.812 56.812 57.691 -0.879 25155 11324 1 14 . 1 1 47 47 ASP CB C 47 42.978 42.978 41.860 1.118 25155 11325 1 14 . 1 1 48 48 VAL N N 48 118.666 118.666 117.223 1.443 25155 11326 1 14 . 1 1 48 48 VAL HA H 48 5.057 5.057 4.851 0.206 25155 11327 1 14 . 1 1 48 48 VAL C C 48 174.180 174.180 174.516 -0.336 25155 11328 1 14 . 1 1 48 48 VAL CA C 48 60.000 60.000 61.428 -1.428 25155 11329 1 14 . 1 1 48 48 VAL CB C 48 36.200 36.200 34.246 1.954 25155 11330 1 14 . 1 1 48 48 VAL H H 48 7.631 7.631 8.188 -0.557 25155 11331 1 14 . 1 1 49 49 LEU N N 49 128.300 128.300 126.547 1.753 25155 11332 1 14 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.436 0.164 25155 11333 1 14 . 1 1 49 49 LEU C C 49 174.810 174.810 174.906 -0.096 25155 11334 1 14 . 1 1 49 49 LEU CA C 49 52.230 52.230 53.257 -1.026 25155 11335 1 14 . 1 1 49 49 LEU CB C 49 45.400 45.400 46.853 -1.454 25155 11336 1 14 . 1 1 49 49 LEU H H 49 9.469 9.469 9.040 0.429 25155 11337 1 14 . 1 1 50 50 ILE N N 50 124.400 124.400 124.134 0.266 25155 11338 1 14 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.593 1.057 25155 11339 1 14 . 1 1 50 50 ILE C C 50 175.286 175.286 173.795 1.491 25155 11340 1 14 . 1 1 50 50 ILE CA C 50 59.900 59.900 60.442 -0.542 25155 11341 1 14 . 1 1 50 50 ILE CB C 50 40.200 40.200 41.323 -1.123 25155 11342 1 14 . 1 1 50 50 ILE H H 50 9.213 9.213 9.031 0.182 25155 11343 1 14 . 1 1 51 51 LEU N N 51 127.410 127.410 128.253 -0.843 25155 11344 1 14 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.008 2.062 25155 11345 1 14 . 1 1 51 51 LEU C C 51 174.540 174.540 175.328 -0.788 25155 11346 1 14 . 1 1 51 51 LEU CA C 51 52.950 52.950 53.147 -0.197 25155 11347 1 14 . 1 1 51 51 LEU CB C 51 43.190 43.190 43.080 0.110 25155 11348 1 14 . 1 1 51 51 LEU H H 51 9.256 9.256 8.818 0.438 25155 11349 1 14 . 1 1 52 52 GLY N N 52 108.290 108.290 111.351 -3.061 25155 11350 1 14 . 1 1 52 52 GLY C C 52 174.330 174.330 171.638 2.692 25155 11351 1 14 . 1 1 52 52 GLY CA C 52 44.040 44.040 43.066 0.973 25155 11352 1 14 . 1 1 52 52 GLY H H 52 8.949 8.949 8.309 0.640 25155 11353 1 14 . 1 1 53 53 ILE N N 53 124.912 124.912 121.641 3.271 25155 11354 1 14 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.354 -0.179 25155 11355 1 14 . 1 1 53 53 ILE C C 53 174.470 174.470 172.710 1.760 25155 11356 1 14 . 1 1 53 53 ILE CA C 53 55.850 55.850 58.169 -2.319 25155 11357 1 14 . 1 1 53 53 ILE CB C 53 42.800 42.800 41.951 0.849 25155 11358 1 14 . 1 1 53 53 ILE H H 53 8.612 8.612 7.631 0.981 25155 11359 1 14 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.499 0.313 25155 11360 1 14 . 1 1 54 54 PRO C C 54 174.565 174.565 175.713 -1.148 25155 11361 1 14 . 1 1 54 54 PRO CA C 54 61.850 61.850 62.504 -0.654 25155 11362 1 14 . 1 1 54 54 PRO CB C 54 32.400 32.400 31.984 0.416 25155 11363 1 14 . 1 1 55 55 THR N N 55 116.040 116.040 119.679 -3.639 25155 11364 1 14 . 1 1 55 55 THR HA H 55 4.522 4.522 4.789 -0.267 25155 11365 1 14 . 1 1 55 55 THR C C 55 173.990 173.990 172.990 1.000 25155 11366 1 14 . 1 1 55 55 THR CA C 55 62.845 62.845 61.879 0.966 25155 11367 1 14 . 1 1 55 55 THR CB C 55 70.795 70.795 70.378 0.417 25155 11368 1 14 . 1 1 55 55 THR H H 55 7.663 7.663 8.314 -0.651 25155 11369 1 14 . 1 1 56 56 TRP N N 56 130.540 130.540 125.973 4.567 25155 11370 1 14 . 1 1 56 56 TRP CA C 56 54.800 54.800 56.432 -1.633 25155 11371 1 14 . 1 1 56 56 TRP H H 56 9.075 9.075 8.980 0.095 25155 11372 1 14 . 1 1 58 58 PHE HA H 58 4.540 4.540 4.318 0.222 25155 11373 1 14 . 1 1 58 58 PHE C C 58 177.070 177.070 176.334 0.736 25155 11374 1 14 . 1 1 58 58 PHE CA C 58 55.460 55.460 57.438 -1.978 25155 11375 1 14 . 1 1 58 58 PHE CB C 58 41.200 41.200 38.282 2.918 25155 11376 1 14 . 1 1 59 59 GLY N N 59 109.796 109.796 104.067 5.729 25155 11377 1 14 . 1 1 59 59 GLY CA C 59 45.763 45.763 45.602 0.161 25155 11378 1 14 . 1 1 59 59 GLY H H 59 8.392 8.392 7.443 0.949 25155 11379 1 14 . 1 1 60 60 GLU C C 60 175.660 175.660 175.662 -0.002 25155 11380 1 14 . 1 1 61 61 ILE N N 61 122.380 122.380 122.458 -0.078 25155 11381 1 14 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.564 0.876 25155 11382 1 14 . 1 1 61 61 ILE CA C 61 62.100 62.100 61.784 0.316 25155 11383 1 14 . 1 1 61 61 ILE CB C 61 38.750 38.750 36.196 2.554 25155 11384 1 14 . 1 1 61 61 ILE H H 61 8.436 8.436 8.265 0.171 25155 11385 1 14 . 1 1 62 62 GLN CB C 62 30.570 30.570 29.398 1.172 25155 11386 1 14 . 1 1 63 63 GLU HA H 63 4.030 4.030 3.980 0.050 25155 11387 1 14 . 1 1 63 63 GLU C C 63 177.134 177.134 178.121 -0.987 25155 11388 1 14 . 1 1 63 63 GLU CA C 63 60.520 60.520 60.114 0.407 25155 11389 1 14 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.639 0.011 25155 11390 1 14 . 1 1 64 64 ASP N N 64 119.630 119.630 116.903 2.727 25155 11391 1 14 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.491 0.101 25155 11392 1 14 . 1 1 64 64 ASP C C 64 178.680 178.680 176.795 1.885 25155 11393 1 14 . 1 1 64 64 ASP CA C 64 57.823 57.823 55.971 1.852 25155 11394 1 14 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.100 1.000 25155 11395 1 14 . 1 1 65 65 TRP N N 65 120.535 120.535 122.038 -1.503 25155 11396 1 14 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.626 -0.301 25155 11397 1 14 . 1 1 65 65 TRP C C 65 178.684 178.684 177.837 0.847 25155 11398 1 14 . 1 1 65 65 TRP CA C 65 60.500 60.500 60.108 0.392 25155 11399 1 14 . 1 1 65 65 TRP CB C 65 30.100 30.100 31.913 -1.813 25155 11400 1 14 . 1 1 65 65 TRP H H 65 7.416 7.416 7.732 -0.316 25155 11401 1 14 . 1 1 66 66 GLU N N 66 120.760 120.760 121.085 -0.325 25155 11402 1 14 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.211 -0.391 25155 11403 1 14 . 1 1 66 66 GLU C C 66 178.860 178.860 178.812 0.048 25155 11404 1 14 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.841 0.259 25155 11405 1 14 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.511 -0.501 25155 11406 1 14 . 1 1 67 67 ALA N N 67 118.972 118.972 121.531 -2.559 25155 11407 1 14 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.217 0.030 25155 11408 1 14 . 1 1 67 67 ALA C C 67 179.610 179.610 178.916 0.694 25155 11409 1 14 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.777 -0.177 25155 11410 1 14 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.793 -0.005 25155 11411 1 14 . 1 1 67 67 ALA H H 67 7.690 7.690 8.561 -0.871 25155 11412 1 14 . 1 1 68 68 VAL N N 68 107.530 107.530 111.214 -3.684 25155 11413 1 14 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.113 0.597 25155 11414 1 14 . 1 1 68 68 VAL C C 68 176.800 176.800 176.676 0.124 25155 11415 1 14 . 1 1 68 68 VAL CA C 68 60.060 60.060 62.934 -2.874 25155 11416 1 14 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.535 0.065 25155 11417 1 14 . 1 1 68 68 VAL H H 68 7.240 7.240 7.400 -0.160 25155 11418 1 14 . 1 1 69 69 TRP N N 69 126.960 126.960 124.328 2.632 25155 11419 1 14 . 1 1 69 69 TRP HA H 69 4.182 4.182 4.050 0.132 25155 11420 1 14 . 1 1 69 69 TRP C C 69 178.640 178.640 177.182 1.458 25155 11421 1 14 . 1 1 69 69 TRP CA C 69 61.300 61.300 62.797 -1.497 25155 11422 1 14 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.468 2.102 25155 11423 1 14 . 1 1 69 69 TRP H H 69 7.810 7.810 8.534 -0.724 25155 11424 1 14 . 1 1 70 70 ASP N N 70 114.644 114.644 116.889 -2.245 25155 11425 1 14 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.208 0.311 25155 11426 1 14 . 1 1 70 70 ASP C C 70 178.685 178.685 177.940 0.745 25155 11427 1 14 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.590 -0.591 25155 11428 1 14 . 1 1 70 70 ASP CB C 70 39.810 39.810 41.035 -1.226 25155 11429 1 14 . 1 1 71 71 GLN N N 71 120.100 120.100 116.807 3.293 25155 11430 1 14 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.262 -0.072 25155 11431 1 14 . 1 1 71 71 GLN C C 71 178.870 178.870 177.975 0.895 25155 11432 1 14 . 1 1 71 71 GLN CA C 71 57.617 57.617 57.168 0.449 25155 11433 1 14 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.759 -0.939 25155 11434 1 14 . 1 1 71 71 GLN H H 71 7.980 7.980 7.855 0.125 25155 11435 1 14 . 1 1 72 72 LEU N N 72 117.535 117.535 119.645 -2.110 25155 11436 1 14 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.932 -0.135 25155 11437 1 14 . 1 1 72 72 LEU C C 72 178.308 178.308 178.084 0.224 25155 11438 1 14 . 1 1 72 72 LEU CA C 72 57.340 57.340 57.455 -0.115 25155 11439 1 14 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.649 0.051 25155 11440 1 14 . 1 1 72 72 LEU H H 72 7.435 7.435 8.242 -0.806 25155 11441 1 14 . 1 1 73 73 ASP N N 73 115.534 115.534 117.385 -1.851 25155 11442 1 14 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.368 -0.218 25155 11443 1 14 . 1 1 73 73 ASP C C 73 177.553 177.553 177.002 0.551 25155 11444 1 14 . 1 1 73 73 ASP CA C 73 57.350 57.350 56.540 0.810 25155 11445 1 14 . 1 1 73 73 ASP CB C 73 40.040 40.040 41.441 -1.401 25155 11446 1 14 . 1 1 74 74 ASP N N 74 117.300 117.300 119.965 -2.665 25155 11447 1 14 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.466 0.240 25155 11448 1 14 . 1 1 74 74 ASP C C 74 176.424 176.424 177.286 -0.862 25155 11449 1 14 . 1 1 74 74 ASP CA C 74 54.170 54.170 55.564 -1.394 25155 11450 1 14 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.219 0.601 25155 11451 1 14 . 1 1 75 75 LEU N N 75 118.500 118.500 120.677 -2.177 25155 11452 1 14 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.104 0.191 25155 11453 1 14 . 1 1 75 75 LEU C C 75 176.800 176.800 176.435 0.365 25155 11454 1 14 . 1 1 75 75 LEU CA C 75 54.400 54.400 55.295 -0.895 25155 11455 1 14 . 1 1 75 75 LEU CB C 75 43.280 43.280 41.660 1.620 25155 11456 1 14 . 1 1 75 75 LEU H H 75 6.966 6.966 7.838 -0.872 25155 11457 1 14 . 1 1 76 76 ASN N N 76 123.040 123.040 122.210 0.830 25155 11458 1 14 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.623 0.239 25155 11459 1 14 . 1 1 76 76 ASN C C 76 174.927 174.927 173.821 1.106 25155 11460 1 14 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.366 -1.485 25155 11461 1 14 . 1 1 76 76 ASN CB C 76 37.510 37.510 37.809 -0.299 25155 11462 1 14 . 1 1 76 76 ASN H H 76 9.882 9.882 8.931 0.951 25155 11463 1 14 . 1 1 77 77 LEU N N 77 123.614 123.614 119.918 3.696 25155 11464 1 14 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.824 -0.454 25155 11465 1 14 . 1 1 77 77 LEU C C 77 175.110 175.110 174.176 0.934 25155 11466 1 14 . 1 1 77 77 LEU CA C 77 52.200 52.200 54.492 -2.292 25155 11467 1 14 . 1 1 77 77 LEU CB C 77 42.786 42.786 44.463 -1.677 25155 11468 1 14 . 1 1 77 77 LEU H H 77 8.700 8.700 7.549 1.151 25155 11469 1 14 . 1 1 78 78 GLU N N 78 120.822 120.822 121.717 -0.895 25155 11470 1 14 . 1 1 78 78 GLU HA H 78 3.900 3.900 5.013 -1.113 25155 11471 1 14 . 1 1 78 78 GLU C C 78 178.670 178.670 177.091 1.579 25155 11472 1 14 . 1 1 78 78 GLU CA C 78 58.700 58.700 54.779 3.921 25155 11473 1 14 . 1 1 78 78 GLU CB C 78 29.467 29.467 33.139 -3.672 25155 11474 1 14 . 1 1 79 79 GLY N N 79 113.160 113.160 112.139 1.021 25155 11475 1 14 . 1 1 79 79 GLY C C 79 174.523 174.523 173.319 1.204 25155 11476 1 14 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.885 -0.465 25155 11477 1 14 . 1 1 79 79 GLY H H 79 8.450 8.450 8.468 -0.018 25155 11478 1 14 . 1 1 80 80 LYS N N 80 120.283 120.283 118.762 1.521 25155 11479 1 14 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.291 0.067 25155 11480 1 14 . 1 1 80 80 LYS C C 80 175.304 175.304 175.613 -0.309 25155 11481 1 14 . 1 1 80 80 LYS CA C 80 56.890 56.890 55.798 1.092 25155 11482 1 14 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.506 -0.386 25155 11483 1 14 . 1 1 81 81 ILE N N 81 122.288 122.288 120.985 1.303 25155 11484 1 14 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.470 0.336 25155 11485 1 14 . 1 1 81 81 ILE C C 81 174.750 174.750 175.361 -0.611 25155 11486 1 14 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.488 -1.668 25155 11487 1 14 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.117 0.733 25155 11488 1 14 . 1 1 81 81 ILE H H 81 7.405 7.405 8.016 -0.611 25155 11489 1 14 . 1 1 82 82 VAL N N 82 127.793 127.793 126.404 1.389 25155 11490 1 14 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.155 0.125 25155 11491 1 14 . 1 1 82 82 VAL C C 82 172.680 172.680 174.296 -1.616 25155 11492 1 14 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.139 -0.039 25155 11493 1 14 . 1 1 82 82 VAL CB C 82 35.280 35.280 35.305 -0.025 25155 11494 1 14 . 1 1 82 82 VAL H H 82 8.800 8.800 9.011 -0.211 25155 11495 1 14 . 1 1 83 83 ALA N N 83 130.911 130.911 129.609 1.302 25155 11496 1 14 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.539 -0.150 25155 11497 1 14 . 1 1 83 83 ALA C C 83 175.870 175.870 175.948 -0.078 25155 11498 1 14 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.282 0.718 25155 11499 1 14 . 1 1 83 83 ALA CB C 83 23.722 23.722 22.667 1.055 25155 11500 1 14 . 1 1 83 83 ALA H H 83 9.252 9.252 9.115 0.137 25155 11501 1 14 . 1 1 84 84 LEU N N 84 124.269 124.269 121.760 2.509 25155 11502 1 14 . 1 1 84 84 LEU HA H 84 5.508 5.508 5.458 0.050 25155 11503 1 14 . 1 1 84 84 LEU C C 84 175.490 175.490 175.358 0.132 25155 11504 1 14 . 1 1 84 84 LEU CA C 84 53.670 53.670 53.845 -0.175 25155 11505 1 14 . 1 1 84 84 LEU CB C 84 45.000 45.000 45.870 -0.869 25155 11506 1 14 . 1 1 84 84 LEU H H 84 10.378 10.378 8.905 1.473 25155 11507 1 14 . 1 1 85 85 TYR N N 85 115.826 115.826 119.308 -3.482 25155 11508 1 14 . 1 1 85 85 TYR HA H 85 4.950 4.950 5.084 -0.134 25155 11509 1 14 . 1 1 85 85 TYR C C 85 172.661 172.661 173.270 -0.609 25155 11510 1 14 . 1 1 85 85 TYR CA C 85 55.853 55.853 55.585 0.268 25155 11511 1 14 . 1 1 85 85 TYR CB C 85 43.200 43.200 40.962 2.238 25155 11512 1 14 . 1 1 85 85 TYR H H 85 9.200 9.200 8.751 0.449 25155 11513 1 14 . 1 1 86 86 GLY N N 86 106.802 106.802 104.507 2.295 25155 11514 1 14 . 1 1 86 86 GLY C C 86 170.348 170.348 171.286 -0.938 25155 11515 1 14 . 1 1 86 86 GLY CA C 86 44.687 44.687 44.702 -0.015 25155 11516 1 14 . 1 1 86 86 GLY H H 86 8.752 8.752 7.911 0.841 25155 11517 1 14 . 1 1 87 87 LEU N N 87 120.860 120.860 121.108 -0.248 25155 11518 1 14 . 1 1 87 87 LEU HA H 87 5.476 5.476 4.843 0.633 25155 11519 1 14 . 1 1 87 87 LEU C C 87 177.720 177.720 175.546 2.174 25155 11520 1 14 . 1 1 87 87 LEU CA C 87 52.630 52.630 53.304 -0.674 25155 11521 1 14 . 1 1 87 87 LEU CB C 87 45.900 45.900 44.614 1.286 25155 11522 1 14 . 1 1 87 87 LEU H H 87 6.320 6.320 8.121 -1.801 25155 11523 1 14 . 1 1 88 88 GLY N N 88 109.910 109.910 109.323 0.587 25155 11524 1 14 . 1 1 88 88 GLY C C 88 171.386 171.386 171.586 -0.200 25155 11525 1 14 . 1 1 88 88 GLY CA C 88 45.710 45.710 45.024 0.686 25155 11526 1 14 . 1 1 88 88 GLY H H 88 8.320 8.320 7.827 0.493 25155 11527 1 14 . 1 1 89 89 ASP N N 89 121.580 121.580 119.337 2.243 25155 11528 1 14 . 1 1 89 89 ASP HA H 89 5.190 5.190 5.513 -0.323 25155 11529 1 14 . 1 1 89 89 ASP C C 89 176.608 176.608 176.980 -0.372 25155 11530 1 14 . 1 1 89 89 ASP CA C 89 52.200 52.200 52.734 -0.534 25155 11531 1 14 . 1 1 89 89 ASP CB C 89 41.900 41.900 43.370 -1.470 25155 11532 1 14 . 1 1 90 90 GLN N N 90 123.900 123.900 125.433 -1.533 25155 11533 1 14 . 1 1 90 90 GLN HA H 90 3.645 3.645 4.221 -0.576 25155 11534 1 14 . 1 1 90 90 GLN C C 90 173.523 173.523 176.374 -2.851 25155 11535 1 14 . 1 1 90 90 GLN CA C 90 58.706 58.706 57.936 0.770 25155 11536 1 14 . 1 1 90 90 GLN CB C 90 28.800 28.800 28.441 0.359 25155 11537 1 14 . 1 1 90 90 GLN H H 90 8.726 8.726 9.065 -0.339 25155 11538 1 14 . 1 1 91 91 LEU N N 91 117.080 117.080 119.431 -2.351 25155 11539 1 14 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.203 0.267 25155 11540 1 14 . 1 1 91 91 LEU C C 91 179.840 179.840 179.172 0.668 25155 11541 1 14 . 1 1 91 91 LEU CA C 91 55.800 55.800 56.096 -0.296 25155 11542 1 14 . 1 1 91 91 LEU CB C 91 41.640 41.640 42.086 -0.446 25155 11543 1 14 . 1 1 91 91 LEU H H 91 7.092 7.092 8.582 -1.490 25155 11544 1 14 . 1 1 92 92 GLY N N 92 110.460 110.460 106.309 4.151 25155 11545 1 14 . 1 1 92 92 GLY C C 92 174.824 174.824 175.728 -0.904 25155 11546 1 14 . 1 1 92 92 GLY CA C 92 46.390 46.390 46.352 0.038 25155 11547 1 14 . 1 1 92 92 GLY H H 92 9.243 9.243 8.633 0.610 25155 11548 1 14 . 1 1 93 93 TYR N N 93 118.140 118.140 122.745 -4.605 25155 11549 1 14 . 1 1 93 93 TYR HA H 93 5.173 5.173 5.032 0.141 25155 11550 1 14 . 1 1 93 93 TYR C C 93 177.805 177.805 175.002 2.803 25155 11551 1 14 . 1 1 93 93 TYR CA C 93 57.430 57.430 55.329 2.101 25155 11552 1 14 . 1 1 93 93 TYR CB C 93 39.300 39.300 37.703 1.597 25155 11553 1 14 . 1 1 93 93 TYR H H 93 7.252 7.252 8.555 -1.303 25155 11554 1 14 . 1 1 94 94 GLY N N 94 112.455 112.455 109.396 3.059 25155 11555 1 14 . 1 1 94 94 GLY C C 94 177.740 177.740 175.290 2.450 25155 11556 1 14 . 1 1 94 94 GLY CA C 94 49.880 49.880 45.864 4.016 25155 11557 1 14 . 1 1 94 94 GLY H H 94 8.154 8.154 8.033 0.121 25155 11558 1 14 . 1 1 95 95 GLU N N 95 123.040 123.040 120.402 2.638 25155 11559 1 14 . 1 1 95 95 GLU HA H 95 4.000 4.000 3.962 0.038 25155 11560 1 14 . 1 1 95 95 GLU C C 95 175.145 175.145 176.391 -1.246 25155 11561 1 14 . 1 1 95 95 GLU CA C 95 57.950 57.950 58.001 -0.051 25155 11562 1 14 . 1 1 95 95 GLU CB C 95 27.400 27.400 28.876 -1.476 25155 11563 1 14 . 1 1 96 96 TRP N N 96 118.000 118.000 115.384 2.616 25155 11564 1 14 . 1 1 96 96 TRP HA H 96 5.213 5.213 4.836 0.377 25155 11565 1 14 . 1 1 96 96 TRP C C 96 176.616 176.616 175.533 1.083 25155 11566 1 14 . 1 1 96 96 TRP CA C 96 57.120 57.120 54.872 2.248 25155 11567 1 14 . 1 1 96 96 TRP CB C 96 29.970 29.970 28.370 1.599 25155 11568 1 14 . 1 1 96 96 TRP H H 96 7.785 7.785 7.620 0.165 25155 11569 1 14 . 1 1 97 97 PHE N N 97 123.268 123.268 123.152 0.116 25155 11570 1 14 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.366 0.294 25155 11571 1 14 . 1 1 97 97 PHE CA C 97 58.742 58.742 59.946 -1.204 25155 11572 1 14 . 1 1 97 97 PHE CB C 97 40.835 40.835 39.371 1.464 25155 11573 1 14 . 1 1 97 97 PHE H H 97 7.054 7.054 7.586 -0.532 25155 11574 1 14 . 1 1 98 98 LEU HA H 98 3.440 3.440 3.449 -0.009 25155 11575 1 14 . 1 1 98 98 LEU C C 98 176.613 176.613 177.341 -0.728 25155 11576 1 14 . 1 1 98 98 LEU CA C 98 56.000 56.000 55.324 0.676 25155 11577 1 14 . 1 1 98 98 LEU CB C 98 38.600 38.600 39.265 -0.665 25155 11578 1 14 . 1 1 98 98 LEU H H 98 8.584 8.584 8.054 0.530 25155 11579 1 14 . 1 1 99 99 ASP N N 99 123.268 123.268 120.533 2.735 25155 11580 1 14 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.298 -0.333 25155 11581 1 14 . 1 1 99 99 ASP C C 99 178.876 178.876 176.763 2.113 25155 11582 1 14 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.491 1.769 25155 11583 1 14 . 1 1 99 99 ASP CB C 99 40.350 40.350 41.151 -0.801 25155 11584 1 14 . 1 1 100 100 ALA N N 100 119.124 119.124 120.816 -1.692 25155 11585 1 14 . 1 1 100 100 ALA HA H 100 3.822 3.822 4.110 -0.288 25155 11586 1 14 . 1 1 100 100 ALA C C 100 178.490 178.490 179.503 -1.013 25155 11587 1 14 . 1 1 100 100 ALA CA C 100 55.100 55.100 54.477 0.623 25155 11588 1 14 . 1 1 100 100 ALA CB C 100 19.700 19.700 18.236 1.464 25155 11589 1 14 . 1 1 100 100 ALA H H 100 8.400 8.400 7.529 0.871 25155 11590 1 14 . 1 1 101 101 LEU N N 101 118.687 118.687 119.451 -0.764 25155 11591 1 14 . 1 1 101 101 LEU HA H 101 3.674 3.674 4.010 -0.336 25155 11592 1 14 . 1 1 101 101 LEU C C 101 179.050 179.050 179.084 -0.034 25155 11593 1 14 . 1 1 101 101 LEU CA C 101 57.800 57.800 58.219 -0.419 25155 11594 1 14 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.143 1.507 25155 11595 1 14 . 1 1 101 101 LEU H H 101 6.518 6.518 7.859 -1.341 25155 11596 1 14 . 1 1 102 102 GLY N N 102 104.410 104.410 106.773 -2.363 25155 11597 1 14 . 1 1 102 102 GLY C C 102 176.056 176.056 176.254 -0.198 25155 11598 1 14 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.186 0.564 25155 11599 1 14 . 1 1 102 102 GLY H H 102 7.712 7.712 7.403 0.309 25155 11600 1 14 . 1 1 103 103 MET N N 103 120.550 120.550 121.600 -1.050 25155 11601 1 14 . 1 1 103 103 MET HA H 103 4.256 4.256 4.378 -0.122 25155 11602 1 14 . 1 1 103 103 MET C C 103 179.650 179.650 178.679 0.971 25155 11603 1 14 . 1 1 103 103 MET CA C 103 59.450 59.450 59.602 -0.152 25155 11604 1 14 . 1 1 103 103 MET CB C 103 32.300 32.300 32.739 -0.439 25155 11605 1 14 . 1 1 103 103 MET H H 103 8.485 8.485 8.022 0.463 25155 11606 1 14 . 1 1 104 104 LEU N N 104 123.480 123.480 120.044 3.436 25155 11607 1 14 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.359 -0.298 25155 11608 1 14 . 1 1 104 104 LEU C C 104 177.750 177.750 179.005 -1.255 25155 11609 1 14 . 1 1 104 104 LEU CA C 104 58.100 58.100 57.663 0.437 25155 11610 1 14 . 1 1 104 104 LEU CB C 104 41.450 41.450 41.197 0.253 25155 11611 1 14 . 1 1 104 104 LEU H H 104 8.392 8.392 7.844 0.548 25155 11612 1 14 . 1 1 105 105 HIS N N 105 119.570 119.570 120.021 -0.451 25155 11613 1 14 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.196 -0.344 25155 11614 1 14 . 1 1 105 105 HIS C C 105 177.550 177.550 177.019 0.531 25155 11615 1 14 . 1 1 105 105 HIS CA C 105 61.000 61.000 60.816 0.184 25155 11616 1 14 . 1 1 105 105 HIS CB C 105 28.820 28.820 30.009 -1.189 25155 11617 1 14 . 1 1 105 105 HIS H H 105 8.247 8.247 8.751 -0.504 25155 11618 1 14 . 1 1 106 106 ASP N N 106 119.780 119.780 119.055 0.725 25155 11619 1 14 . 1 1 106 106 ASP HA H 106 4.333 4.333 4.420 -0.087 25155 11620 1 14 . 1 1 106 106 ASP C C 106 179.410 179.410 178.370 1.040 25155 11621 1 14 . 1 1 106 106 ASP CA C 106 57.800 57.800 57.291 0.508 25155 11622 1 14 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.198 -0.598 25155 11623 1 14 . 1 1 107 107 LYS N N 107 121.660 121.660 118.741 2.919 25155 11624 1 14 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.042 0.058 25155 11625 1 14 . 1 1 107 107 LYS C C 107 178.316 178.316 178.373 -0.057 25155 11626 1 14 . 1 1 107 107 LYS CA C 107 58.750 58.750 59.044 -0.293 25155 11627 1 14 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.562 -0.712 25155 11628 1 14 . 1 1 108 108 LEU N N 108 116.050 116.050 117.903 -1.853 25155 11629 1 14 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.357 -0.347 25155 11630 1 14 . 1 1 108 108 LEU C C 108 179.050 179.050 178.380 0.670 25155 11631 1 14 . 1 1 108 108 LEU CA C 108 56.240 56.240 55.805 0.435 25155 11632 1 14 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.240 -0.440 25155 11633 1 14 . 1 1 108 108 LEU H H 108 8.072 8.072 7.657 0.415 25155 11634 1 14 . 1 1 109 109 SER N N 109 116.280 116.280 115.436 0.844 25155 11635 1 14 . 1 1 109 109 SER HA H 109 4.300 4.300 4.275 0.025 25155 11636 1 14 . 1 1 109 109 SER C C 109 175.848 175.848 176.019 -0.171 25155 11637 1 14 . 1 1 109 109 SER CA C 109 62.410 62.410 61.689 0.721 25155 11638 1 14 . 1 1 109 109 SER CB C 109 62.850 62.850 63.348 -0.498 25155 11639 1 14 . 1 1 109 109 SER H H 109 8.366 8.366 8.106 0.260 25155 11640 1 14 . 1 1 110 110 THR N N 110 110.416 110.416 110.750 -0.334 25155 11641 1 14 . 1 1 110 110 THR HA H 110 4.614 4.614 4.266 0.348 25155 11642 1 14 . 1 1 110 110 THR C C 110 175.675 175.675 175.835 -0.160 25155 11643 1 14 . 1 1 110 110 THR CA C 110 62.030 62.030 63.678 -1.648 25155 11644 1 14 . 1 1 110 110 THR CB C 110 68.810 68.810 69.032 -0.222 25155 11645 1 14 . 1 1 110 110 THR H H 110 7.185 7.185 7.979 -0.794 25155 11646 1 14 . 1 1 111 111 LYS N N 111 120.090 120.090 120.128 -0.038 25155 11647 1 14 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.258 0.255 25155 11648 1 14 . 1 1 111 111 LYS C C 111 176.814 176.814 177.114 -0.300 25155 11649 1 14 . 1 1 111 111 LYS CA C 111 55.730 55.730 56.316 -0.586 25155 11650 1 14 . 1 1 111 111 LYS CB C 111 30.930 30.930 31.788 -0.858 25155 11651 1 14 . 1 1 112 112 GLY N N 112 107.540 107.540 107.315 0.225 25155 11652 1 14 . 1 1 112 112 GLY C C 112 176.223 176.223 174.654 1.569 25155 11653 1 14 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.292 1.633 25155 11654 1 14 . 1 1 112 112 GLY H H 112 8.315 8.315 7.421 0.894 25155 11655 1 14 . 1 1 113 113 VAL N N 113 113.536 113.536 116.174 -2.638 25155 11656 1 14 . 1 1 113 113 VAL HA H 113 4.494 4.494 3.934 0.560 25155 11657 1 14 . 1 1 113 113 VAL C C 113 174.560 174.560 174.413 0.147 25155 11658 1 14 . 1 1 113 113 VAL CA C 113 59.550 59.550 61.511 -1.961 25155 11659 1 14 . 1 1 113 113 VAL CB C 113 32.800 32.800 31.679 1.121 25155 11660 1 14 . 1 1 113 113 VAL H H 113 6.835 6.835 7.127 -0.292 25155 11661 1 14 . 1 1 114 114 LYS N N 114 122.920 122.920 121.717 1.203 25155 11662 1 14 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.378 0.116 25155 11663 1 14 . 1 1 114 114 LYS C C 114 174.925 174.925 174.836 0.089 25155 11664 1 14 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.189 0.091 25155 11665 1 14 . 1 1 114 114 LYS CB C 114 33.630 33.630 33.910 -0.280 25155 11666 1 14 . 1 1 115 115 PHE N N 115 123.140 123.140 124.462 -1.322 25155 11667 1 14 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.544 0.156 25155 11668 1 14 . 1 1 115 115 PHE C C 115 177.580 177.580 176.194 1.386 25155 11669 1 14 . 1 1 115 115 PHE CA C 115 58.677 58.677 56.893 1.784 25155 11670 1 14 . 1 1 115 115 PHE CB C 115 41.120 41.120 40.623 0.497 25155 11671 1 14 . 1 1 115 115 PHE H H 115 8.506 8.506 8.619 -0.113 25155 11672 1 14 . 1 1 116 116 VAL N N 116 115.737 115.737 117.107 -1.370 25155 11673 1 14 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.751 -0.273 25155 11674 1 14 . 1 1 116 116 VAL C C 116 175.300 175.300 175.489 -0.189 25155 11675 1 14 . 1 1 116 116 VAL CA C 116 58.877 58.877 60.025 -1.148 25155 11676 1 14 . 1 1 116 116 VAL CB C 116 34.120 34.120 35.020 -0.900 25155 11677 1 14 . 1 1 116 116 VAL H H 116 8.860 8.860 8.777 0.083 25155 11678 1 14 . 1 1 117 117 GLY N N 117 108.137 108.137 111.267 -3.130 25155 11679 1 14 . 1 1 117 117 GLY C C 117 176.110 176.110 174.325 1.785 25155 11680 1 14 . 1 1 117 117 GLY CA C 117 47.500 47.500 45.226 2.274 25155 11681 1 14 . 1 1 117 117 GLY H H 117 9.838 9.838 9.543 0.295 25155 11682 1 14 . 1 1 118 118 TYR N N 118 120.380 120.380 119.950 0.430 25155 11683 1 14 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.297 0.673 25155 11684 1 14 . 1 1 118 118 TYR C C 118 177.630 177.630 174.817 2.813 25155 11685 1 14 . 1 1 118 118 TYR CA C 118 55.800 55.800 60.529 -4.729 25155 11686 1 14 . 1 1 118 118 TYR CB C 118 35.970 35.970 38.166 -2.196 25155 11687 1 14 . 1 1 118 118 TYR H H 118 8.652 8.652 7.942 0.710 25155 11688 1 14 . 1 1 119 119 TRP N N 119 126.040 126.040 117.539 8.501 25155 11689 1 14 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.137 0.884 25155 11690 1 14 . 1 1 119 119 TRP C C 119 173.000 173.000 173.866 -0.866 25155 11691 1 14 . 1 1 119 119 TRP CA C 119 53.820 53.820 56.124 -2.304 25155 11692 1 14 . 1 1 119 119 TRP CB C 119 36.050 36.050 33.483 2.567 25155 11693 1 14 . 1 1 119 119 TRP H H 119 8.070 8.070 8.406 -0.336 25155 11694 1 14 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.572 0.212 25155 11695 1 14 . 1 1 120 120 PRO C C 120 176.870 176.870 176.397 0.473 25155 11696 1 14 . 1 1 120 120 PRO CA C 120 63.780 63.780 63.193 0.587 25155 11697 1 14 . 1 1 120 120 PRO CB C 120 31.990 31.990 32.082 -0.092 25155 11698 1 14 . 1 1 121 121 THR N N 121 109.310 109.310 113.982 -4.672 25155 11699 1 14 . 1 1 121 121 THR HA H 121 4.073 4.073 4.045 0.028 25155 11700 1 14 . 1 1 121 121 THR C C 121 176.324 176.324 175.066 1.258 25155 11701 1 14 . 1 1 121 121 THR CA C 121 61.250 61.250 63.148 -1.898 25155 11702 1 14 . 1 1 121 121 THR CB C 121 69.730 69.730 69.062 0.668 25155 11703 1 14 . 1 1 121 121 THR H H 121 7.370 7.370 8.551 -1.181 25155 11704 1 14 . 1 1 122 122 GLU N N 122 123.937 123.937 122.571 1.366 25155 11705 1 14 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.146 0.078 25155 11706 1 14 . 1 1 122 122 GLU C C 122 177.737 177.737 177.687 0.050 25155 11707 1 14 . 1 1 122 122 GLU CA C 122 58.200 58.200 58.061 0.139 25155 11708 1 14 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.230 0.570 25155 11709 1 14 . 1 1 123 123 GLY N N 123 114.563 114.563 112.044 2.519 25155 11710 1 14 . 1 1 123 123 GLY C C 123 173.783 173.783 174.208 -0.425 25155 11711 1 14 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.311 0.069 25155 11712 1 14 . 1 1 123 123 GLY H H 123 9.144 9.144 8.961 0.183 25155 11713 1 14 . 1 1 124 124 TYR N N 124 118.800 118.800 121.379 -2.579 25155 11714 1 14 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.627 0.591 25155 11715 1 14 . 1 1 124 124 TYR C C 124 175.673 175.673 175.571 0.102 25155 11716 1 14 . 1 1 124 124 TYR CA C 124 56.950 56.950 59.671 -2.721 25155 11717 1 14 . 1 1 124 124 TYR CB C 124 41.100 41.100 40.290 0.810 25155 11718 1 14 . 1 1 124 124 TYR H H 124 7.895 7.895 7.917 -0.022 25155 11719 1 14 . 1 1 125 125 GLU N N 125 124.790 124.790 124.420 0.370 25155 11720 1 14 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.699 -0.014 25155 11721 1 14 . 1 1 125 125 GLU C C 125 172.877 172.877 175.224 -2.347 25155 11722 1 14 . 1 1 125 125 GLU CA C 125 55.700 55.700 55.515 0.185 25155 11723 1 14 . 1 1 125 125 GLU CB C 125 31.340 31.340 31.150 0.190 25155 11724 1 14 . 1 1 126 126 PHE N N 126 118.670 118.670 120.061 -1.391 25155 11725 1 14 . 1 1 126 126 PHE HA H 126 4.841 4.841 4.817 0.024 25155 11726 1 14 . 1 1 126 126 PHE C C 126 173.800 173.800 173.226 0.574 25155 11727 1 14 . 1 1 126 126 PHE CA C 126 56.950 56.950 56.973 -0.023 25155 11728 1 14 . 1 1 126 126 PHE CB C 126 40.300 40.300 40.595 -0.295 25155 11729 1 14 . 1 1 126 126 PHE H H 126 7.645 7.645 8.139 -0.494 25155 11730 1 14 . 1 1 127 127 THR N N 127 107.038 107.038 114.078 -7.040 25155 11731 1 14 . 1 1 127 127 THR HA H 127 4.370 4.370 4.256 0.114 25155 11732 1 14 . 1 1 127 127 THR C C 127 175.100 175.100 172.883 2.217 25155 11733 1 14 . 1 1 127 127 THR CA C 127 61.080 61.080 60.438 0.642 25155 11734 1 14 . 1 1 127 127 THR CB C 127 70.500 70.500 70.031 0.468 25155 11735 1 14 . 1 1 127 127 THR H H 127 7.306 7.306 8.733 -1.427 25155 11736 1 14 . 1 1 128 128 SER N N 128 118.150 118.150 115.417 2.733 25155 11737 1 14 . 1 1 128 128 SER HA H 128 4.650 4.650 4.319 0.331 25155 11738 1 14 . 1 1 128 128 SER C C 128 175.760 175.760 173.161 2.599 25155 11739 1 14 . 1 1 128 128 SER CA C 128 55.813 55.813 58.515 -2.702 25155 11740 1 14 . 1 1 128 128 SER CB C 128 65.300 65.300 62.948 2.352 25155 11741 1 14 . 1 1 128 128 SER H H 128 7.354 7.354 8.320 -0.966 25155 11742 1 14 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.524 0.240 25155 11743 1 14 . 1 1 129 129 PRO C C 129 178.860 178.860 178.341 0.519 25155 11744 1 14 . 1 1 129 129 PRO CA C 129 62.728 62.728 64.190 -1.462 25155 11745 1 14 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.492 -0.092 25155 11746 1 14 . 1 1 130 130 LYS N N 130 122.158 122.158 120.169 1.989 25155 11747 1 14 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.159 0.051 25155 11748 1 14 . 1 1 130 130 LYS C C 130 176.890 176.890 176.125 0.765 25155 11749 1 14 . 1 1 130 130 LYS CA C 130 61.375 61.375 60.999 0.376 25155 11750 1 14 . 1 1 130 130 LYS CB C 130 30.350 30.350 31.012 -0.662 25155 11751 1 14 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.389 0.144 25155 11752 1 14 . 1 1 131 131 PRO C C 131 173.810 173.810 175.934 -2.124 25155 11753 1 14 . 1 1 131 131 PRO CA C 131 64.510 64.510 63.907 0.603 25155 11754 1 14 . 1 1 131 131 PRO CB C 131 31.745 31.745 31.503 0.242 25155 11755 1 14 . 1 1 132 132 VAL N N 132 114.480 114.480 112.023 2.457 25155 11756 1 14 . 1 1 132 132 VAL HA H 132 5.158 5.158 5.117 0.041 25155 11757 1 14 . 1 1 132 132 VAL C C 132 175.137 175.137 174.549 0.588 25155 11758 1 14 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.321 0.479 25155 11759 1 14 . 1 1 132 132 VAL CB C 132 34.780 34.780 35.761 -0.981 25155 11760 1 14 . 1 1 132 132 VAL H H 132 6.716 6.716 7.587 -0.871 25155 11761 1 14 . 1 1 133 133 ILE N N 133 120.670 120.670 116.673 3.997 25155 11762 1 14 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.432 -0.040 25155 11763 1 14 . 1 1 133 133 ILE C C 133 175.485 175.485 175.937 -0.452 25155 11764 1 14 . 1 1 133 133 ILE CA C 133 60.000 60.000 60.512 -0.512 25155 11765 1 14 . 1 1 133 133 ILE CB C 133 42.020 42.020 38.895 3.125 25155 11766 1 14 . 1 1 133 133 ILE H H 133 8.740 8.740 8.600 0.140 25155 11767 1 14 . 1 1 134 134 ALA N N 134 122.454 122.454 123.368 -0.914 25155 11768 1 14 . 1 1 134 134 ALA HA H 134 3.953 3.953 3.987 -0.034 25155 11769 1 14 . 1 1 134 134 ALA C C 134 178.387 178.387 177.663 0.724 25155 11770 1 14 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.697 -0.647 25155 11771 1 14 . 1 1 134 134 ALA CB C 134 16.982 16.982 18.229 -1.247 25155 11772 1 14 . 1 1 134 134 ALA H H 134 8.490 8.490 8.443 0.047 25155 11773 1 14 . 1 1 135 135 ASP N N 135 117.310 117.310 123.017 -5.707 25155 11774 1 14 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.571 -0.327 25155 11775 1 14 . 1 1 135 135 ASP C C 135 176.390 176.390 176.861 -0.471 25155 11776 1 14 . 1 1 135 135 ASP CA C 135 55.120 55.120 53.047 2.073 25155 11777 1 14 . 1 1 135 135 ASP CB C 135 39.865 39.865 39.502 0.363 25155 11778 1 14 . 1 1 136 136 GLY N N 136 104.336 104.336 109.107 -4.771 25155 11779 1 14 . 1 1 136 136 GLY C C 136 174.940 174.940 175.600 -0.660 25155 11780 1 14 . 1 1 136 136 GLY CA C 136 45.150 45.150 45.970 -0.820 25155 11781 1 14 . 1 1 136 136 GLY H H 136 7.592 7.592 8.053 -0.461 25155 11782 1 14 . 1 1 137 137 GLN N N 137 118.675 118.675 117.761 0.914 25155 11783 1 14 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.248 -0.186 25155 11784 1 14 . 1 1 137 137 GLN C C 137 176.420 176.420 175.428 0.992 25155 11785 1 14 . 1 1 137 137 GLN CA C 137 57.760 57.760 57.244 0.516 25155 11786 1 14 . 1 1 137 137 GLN CB C 137 30.400 30.400 29.761 0.639 25155 11787 1 14 . 1 1 137 137 GLN H H 137 7.843 7.843 7.878 -0.035 25155 11788 1 14 . 1 1 138 138 LEU N N 138 118.160 118.160 118.341 -0.181 25155 11789 1 14 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.629 0.332 25155 11790 1 14 . 1 1 138 138 LEU C C 138 175.700 175.700 174.441 1.259 25155 11791 1 14 . 1 1 138 138 LEU CA C 138 53.705 53.705 54.612 -0.907 25155 11792 1 14 . 1 1 138 138 LEU CB C 138 46.480 46.480 46.068 0.412 25155 11793 1 14 . 1 1 138 138 LEU H H 138 7.356 7.356 7.240 0.116 25155 11794 1 14 . 1 1 139 139 PHE N N 139 119.060 119.060 122.736 -3.676 25155 11795 1 14 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.902 0.442 25155 11796 1 14 . 1 1 139 139 PHE C C 139 178.850 178.850 177.798 1.052 25155 11797 1 14 . 1 1 139 139 PHE CA C 139 56.670 56.670 57.989 -1.319 25155 11798 1 14 . 1 1 139 139 PHE CB C 139 43.652 43.652 39.349 4.303 25155 11799 1 14 . 1 1 139 139 PHE H H 139 10.026 10.026 9.204 0.822 25155 11800 1 14 . 1 1 140 140 VAL N N 140 109.905 109.905 117.497 -7.592 25155 11801 1 14 . 1 1 140 140 VAL HA H 140 3.500 3.500 3.704 -0.204 25155 11802 1 14 . 1 1 140 140 VAL C C 140 172.860 172.860 175.197 -2.337 25155 11803 1 14 . 1 1 140 140 VAL CA C 140 61.812 61.812 63.254 -1.442 25155 11804 1 14 . 1 1 140 140 VAL CB C 140 30.250 30.250 30.558 -0.308 25155 11805 1 14 . 1 1 140 140 VAL H H 140 7.550 7.550 8.355 -0.805 25155 11806 1 14 . 1 1 141 141 GLY N N 141 106.600 106.600 106.335 0.265 25155 11807 1 14 . 1 1 141 141 GLY C C 141 171.350 171.350 172.611 -1.261 25155 11808 1 14 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.795 0.665 25155 11809 1 14 . 1 1 141 141 GLY H H 141 7.052 7.052 7.236 -0.184 25155 11810 1 14 . 1 1 142 142 LEU N N 142 117.820 117.820 120.704 -2.884 25155 11811 1 14 . 1 1 142 142 LEU HA H 142 4.962 4.962 3.917 1.045 25155 11812 1 14 . 1 1 142 142 LEU CA C 142 55.600 55.600 54.483 1.117 25155 11813 1 14 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.170 -4.240 25155 11814 1 14 . 1 1 142 142 LEU H H 142 7.643 7.643 8.039 -0.396 25155 11815 1 14 . 1 1 143 143 ALA HA H 143 4.220 4.220 3.446 0.774 25155 11816 1 14 . 1 1 143 143 ALA C C 143 175.505 175.505 175.587 -0.082 25155 11817 1 14 . 1 1 143 143 ALA CA C 143 49.600 49.600 50.922 -1.323 25155 11818 1 14 . 1 1 143 143 ALA CB C 143 23.330 23.330 17.738 5.592 25155 11819 1 14 . 1 1 144 144 LEU N N 144 124.960 124.960 124.331 0.629 25155 11820 1 14 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.411 0.369 25155 11821 1 14 . 1 1 144 144 LEU C C 144 174.700 174.700 174.557 0.143 25155 11822 1 14 . 1 1 144 144 LEU CA C 144 52.790 52.790 54.009 -1.219 25155 11823 1 14 . 1 1 144 144 LEU CB C 144 45.300 45.300 46.282 -0.982 25155 11824 1 14 . 1 1 144 144 LEU H H 144 8.583 8.583 7.828 0.755 25155 11825 1 14 . 1 1 145 145 ASP N N 145 119.100 119.100 122.500 -3.400 25155 11826 1 14 . 1 1 145 145 ASP HA H 145 5.422 5.422 5.422 -0.000 25155 11827 1 14 . 1 1 145 145 ASP C C 145 176.180 176.180 175.108 1.072 25155 11828 1 14 . 1 1 145 145 ASP CA C 145 53.600 53.600 53.009 0.591 25155 11829 1 14 . 1 1 145 145 ASP CB C 145 43.180 43.180 44.730 -1.550 25155 11830 1 14 . 1 1 147 147 THR HA H 147 4.093 4.093 4.459 -0.366 25155 11831 1 14 . 1 1 147 147 THR C C 147 175.858 175.858 175.898 -0.040 25155 11832 1 14 . 1 1 147 147 THR CA C 147 66.400 66.400 64.501 1.899 25155 11833 1 14 . 1 1 147 147 THR CB C 147 69.400 69.400 70.231 -0.831 25155 11834 1 14 . 1 1 147 147 THR H H 147 8.745 8.745 8.854 -0.109 25155 11835 1 14 . 1 1 148 148 ASN N N 148 115.408 115.408 118.447 -3.039 25155 11836 1 14 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.762 0.248 25155 11837 1 14 . 1 1 148 148 ASN C C 148 175.750 175.750 174.955 0.795 25155 11838 1 14 . 1 1 148 148 ASN CA C 148 53.400 53.400 54.723 -1.323 25155 11839 1 14 . 1 1 148 148 ASN CB C 148 41.900 41.900 39.738 2.162 25155 11840 1 14 . 1 1 148 148 ASN H H 148 8.975 8.975 8.964 0.011 25155 11841 1 14 . 1 1 149 149 GLN N N 149 117.900 117.900 116.816 1.084 25155 11842 1 14 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.667 0.269 25155 11843 1 14 . 1 1 149 149 GLN C C 149 178.280 178.280 174.101 4.179 25155 11844 1 14 . 1 1 149 149 GLN CA C 149 53.730 53.730 55.150 -1.420 25155 11845 1 14 . 1 1 149 149 GLN CB C 149 29.790 29.790 32.631 -2.841 25155 11846 1 14 . 1 1 149 149 GLN H H 149 7.430 7.430 7.690 -0.260 25155 11847 1 14 . 1 1 150 150 TYR N N 150 121.060 121.060 121.338 -0.278 25155 11848 1 14 . 1 1 150 150 TYR HA H 150 4.671 4.671 4.695 -0.024 25155 11849 1 14 . 1 1 150 150 TYR C C 150 178.680 178.680 175.906 2.774 25155 11850 1 14 . 1 1 150 150 TYR CA C 150 57.930 57.930 59.843 -1.913 25155 11851 1 14 . 1 1 150 150 TYR CB C 150 38.860 38.860 40.538 -1.678 25155 11852 1 14 . 1 1 150 150 TYR H H 150 8.115 8.115 8.752 -0.637 25155 11853 1 14 . 1 1 151 151 ASP N N 151 121.175 121.175 120.574 0.601 25155 11854 1 14 . 1 1 151 151 ASP CA C 151 57.000 57.000 56.938 0.062 25155 11855 1 14 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.663 1.337 25155 11856 1 14 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.249 0.341 25155 11857 1 14 . 1 1 152 152 LEU C C 152 178.300 178.300 177.855 0.445 25155 11858 1 14 . 1 1 152 152 LEU CA C 152 54.788 54.788 56.099 -1.311 25155 11859 1 14 . 1 1 152 152 LEU CB C 152 42.200 42.200 40.738 1.462 25155 11860 1 14 . 1 1 153 153 SER N N 153 116.170 116.170 115.473 0.697 25155 11861 1 14 . 1 1 153 153 SER HA H 153 3.911 3.911 4.099 -0.188 25155 11862 1 14 . 1 1 153 153 SER CA C 153 63.400 63.400 62.247 1.153 25155 11863 1 14 . 1 1 153 153 SER CB C 153 63.200 63.200 62.712 0.488 25155 11864 1 14 . 1 1 153 153 SER H H 153 7.378 7.378 8.299 -0.921 25155 11865 1 14 . 1 1 154 154 ASP N N 154 121.640 121.640 121.430 0.210 25155 11866 1 14 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.350 -0.110 25155 11867 1 14 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.331 1.969 25155 11868 1 14 . 1 1 154 154 ASP CB C 154 40.000 40.000 40.920 -0.920 25155 11869 1 14 . 1 1 155 155 GLU HA H 155 4.170 4.170 3.958 0.212 25155 11870 1 14 . 1 1 155 155 GLU C C 155 179.420 179.420 178.973 0.447 25155 11871 1 14 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.282 -0.082 25155 11872 1 14 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.585 -0.105 25155 11873 1 14 . 1 1 156 156 ARG N N 156 121.230 121.230 118.371 2.859 25155 11874 1 14 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.335 -0.059 25155 11875 1 14 . 1 1 156 156 ARG C C 156 177.350 177.350 179.400 -2.050 25155 11876 1 14 . 1 1 156 156 ARG CA C 156 59.950 59.950 57.760 2.190 25155 11877 1 14 . 1 1 156 156 ARG CB C 156 31.100 31.100 29.452 1.648 25155 11878 1 14 . 1 1 157 157 ILE N N 157 118.190 118.190 120.444 -2.254 25155 11879 1 14 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.696 -0.266 25155 11880 1 14 . 1 1 157 157 ILE C C 157 178.480 178.480 178.450 0.030 25155 11881 1 14 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.416 1.144 25155 11882 1 14 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.786 0.694 25155 11883 1 14 . 1 1 157 157 ILE H H 157 8.705 8.705 7.973 0.732 25155 11884 1 14 . 1 1 158 158 GLN N N 158 119.975 119.975 120.729 -0.754 25155 11885 1 14 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.880 0.076 25155 11886 1 14 . 1 1 158 158 GLN C C 158 178.730 178.730 178.270 0.460 25155 11887 1 14 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.231 1.468 25155 11888 1 14 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.347 0.135 25155 11889 1 14 . 1 1 158 158 GLN H H 158 8.262 8.262 8.625 -0.363 25155 11890 1 14 . 1 1 159 159 SER N N 159 115.466 115.466 114.714 0.752 25155 11891 1 14 . 1 1 159 159 SER HA H 159 4.446 4.446 4.300 0.146 25155 11892 1 14 . 1 1 159 159 SER C C 159 177.320 177.320 176.934 0.386 25155 11893 1 14 . 1 1 159 159 SER CA C 159 63.500 63.500 61.953 1.547 25155 11894 1 14 . 1 1 159 159 SER CB C 159 63.818 63.818 63.108 0.710 25155 11895 1 14 . 1 1 159 159 SER H H 159 8.440 8.440 8.252 0.188 25155 11896 1 14 . 1 1 160 160 TRP N N 160 126.784 126.784 125.028 1.756 25155 11897 1 14 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.479 -0.025 25155 11898 1 14 . 1 1 160 160 TRP C C 160 177.934 177.934 177.453 0.481 25155 11899 1 14 . 1 1 160 160 TRP CA C 160 62.745 62.745 62.386 0.359 25155 11900 1 14 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.369 -0.019 25155 11901 1 14 . 1 1 160 160 TRP H H 160 9.243 9.243 7.716 1.527 25155 11902 1 14 . 1 1 161 161 CYS N N 161 116.395 116.395 118.766 -2.371 25155 11903 1 14 . 1 1 161 161 CYS HA H 161 3.886 3.886 3.774 0.112 25155 11904 1 14 . 1 1 161 161 CYS C C 161 176.245 176.245 177.051 -0.806 25155 11905 1 14 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.687 0.613 25155 11906 1 14 . 1 1 161 161 CYS CB C 161 27.723 27.723 26.972 0.751 25155 11907 1 14 . 1 1 161 161 CYS H H 161 8.845 8.845 9.104 -0.259 25155 11908 1 14 . 1 1 162 162 GLU N N 162 118.030 118.030 119.469 -1.439 25155 11909 1 14 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.877 0.043 25155 11910 1 14 . 1 1 162 162 GLU C C 162 178.700 178.700 178.720 -0.020 25155 11911 1 14 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.428 0.372 25155 11912 1 14 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.285 0.215 25155 11913 1 14 . 1 1 163 163 GLN N N 163 120.650 120.650 119.734 0.916 25155 11914 1 14 . 1 1 163 163 GLN HA H 163 4.173 4.173 3.938 0.235 25155 11915 1 14 . 1 1 163 163 GLN C C 163 179.700 179.700 178.286 1.414 25155 11916 1 14 . 1 1 163 163 GLN CA C 163 59.688 59.688 59.214 0.474 25155 11917 1 14 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.745 0.155 25155 11918 1 14 . 1 1 163 163 GLN H H 163 8.148 8.148 7.867 0.281 25155 11919 1 14 . 1 1 164 164 ILE N N 164 114.836 114.836 117.029 -2.193 25155 11920 1 14 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.612 0.448 25155 11921 1 14 . 1 1 164 164 ILE C C 164 178.676 178.676 177.645 1.031 25155 11922 1 14 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.307 1.853 25155 11923 1 14 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.240 0.390 25155 11924 1 14 . 1 1 164 164 ILE H H 164 8.958 8.958 8.224 0.734 25155 11925 1 14 . 1 1 165 165 LEU N N 165 123.700 123.700 120.074 3.626 25155 11926 1 14 . 1 1 165 165 LEU HA H 165 4.100 4.100 3.996 0.104 25155 11927 1 14 . 1 1 165 165 LEU C C 165 180.548 180.548 178.121 2.427 25155 11928 1 14 . 1 1 165 165 LEU CA C 165 58.150 58.150 58.422 -0.272 25155 11929 1 14 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.619 -0.489 25155 11930 1 14 . 1 1 165 165 LEU H H 165 7.830 7.830 7.870 -0.040 25155 11931 1 14 . 1 1 166 166 ASN N N 166 120.160 120.160 117.320 2.840 25155 11932 1 14 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.438 0.132 25155 11933 1 14 . 1 1 166 166 ASN C C 166 175.690 175.690 177.316 -1.626 25155 11934 1 14 . 1 1 166 166 ASN CA C 166 55.946 55.946 56.685 -0.739 25155 11935 1 14 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.503 -0.023 25155 11936 1 14 . 1 1 166 166 ASN H H 166 7.706 7.706 7.725 -0.019 25155 11937 1 14 . 1 1 167 167 GLU N N 167 121.286 121.286 121.402 -0.116 25155 11938 1 14 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.374 -0.270 25155 11939 1 14 . 1 1 167 167 GLU C C 167 180.520 180.520 179.361 1.159 25155 11940 1 14 . 1 1 167 167 GLU CA C 167 59.920 59.920 59.139 0.781 25155 11941 1 14 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.805 1.119 25155 11942 1 14 . 1 1 168 168 MET N N 168 118.622 118.622 116.414 2.208 25155 11943 1 14 . 1 1 168 168 MET HA H 168 3.996 3.996 4.339 -0.343 25155 11944 1 14 . 1 1 168 168 MET C C 168 176.856 176.856 177.466 -0.610 25155 11945 1 14 . 1 1 168 168 MET CA C 168 59.500 59.500 58.894 0.606 25155 11946 1 14 . 1 1 168 168 MET CB C 168 33.700 33.700 32.771 0.929 25155 11947 1 14 . 1 1 168 168 MET H H 168 8.723 8.723 8.444 0.279 25155 11948 1 14 . 1 1 169 169 ALA N N 169 121.760 121.760 122.948 -1.188 25155 11949 1 14 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.274 -0.118 25155 11950 1 14 . 1 1 169 169 ALA C C 169 179.790 179.790 179.504 0.286 25155 11951 1 14 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.835 -0.035 25155 11952 1 14 . 1 1 169 169 ALA CB C 169 18.220 18.220 18.364 -0.144 25155 11953 1 14 . 1 1 169 169 ALA H H 169 7.494 7.494 7.478 0.016 25155 11954 1 14 . 1 1 170 170 GLU N N 170 116.970 116.970 118.517 -1.547 25155 11955 1 14 . 1 1 170 170 GLU HA H 170 4.091 4.091 4.043 0.048 25155 11956 1 14 . 1 1 170 170 GLU C C 170 177.745 177.745 177.989 -0.244 25155 11957 1 14 . 1 1 170 170 GLU CA C 170 58.000 58.000 58.787 -0.787 25155 11958 1 14 . 1 1 170 170 GLU CB C 170 29.730 29.730 29.417 0.313 25155 11959 1 14 . 1 1 171 171 HIS N N 171 118.150 118.150 117.773 0.377 25155 11960 1 14 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.274 0.196 25155 11961 1 14 . 1 1 171 171 HIS C C 171 175.848 175.848 176.669 -0.821 25155 11962 1 14 . 1 1 171 171 HIS CA C 171 57.600 57.600 58.596 -0.996 25155 11963 1 14 . 1 1 171 171 HIS CB C 171 30.800 30.800 29.951 0.849 25155 11964 1 14 . 1 1 171 171 HIS H H 171 7.717 7.717 7.836 -0.119 25155 11965 1 14 . 1 1 172 172 TYR N N 172 119.483 119.483 118.123 1.360 25155 11966 1 14 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.394 0.198 25155 11967 1 14 . 1 1 172 172 TYR C C 172 174.590 174.590 176.270 -1.680 25155 11968 1 14 . 1 1 172 172 TYR CA C 172 57.813 57.813 58.478 -0.665 25155 11969 1 14 . 1 1 172 172 TYR CB C 172 38.900 38.900 38.681 0.219 25155 11970 1 14 . 1 1 172 172 TYR H H 172 7.778 7.778 7.635 0.143 25155 11971 1 15 . 1 1 2 2 ASN N N 2 122.966 122.966 117.735 5.231 25155 11972 1 15 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.160 0.015 25155 11973 1 15 . 1 1 2 2 ASN C C 2 175.200 175.200 173.994 1.206 25155 11974 1 15 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.278 0.642 25155 11975 1 15 . 1 1 2 2 ASN CB C 2 40.000 40.000 41.646 -1.646 25155 11976 1 15 . 1 1 2 2 ASN H H 2 9.392 9.392 8.362 1.030 25155 11977 1 15 . 1 1 3 3 MET N N 3 120.660 120.660 119.137 1.523 25155 11978 1 15 . 1 1 3 3 MET HA H 3 5.565 5.565 4.843 0.722 25155 11979 1 15 . 1 1 3 3 MET C C 3 174.200 174.200 175.596 -1.396 25155 11980 1 15 . 1 1 3 3 MET CA C 3 54.550 54.550 54.686 -0.136 25155 11981 1 15 . 1 1 3 3 MET CB C 3 34.100 34.100 34.524 -0.424 25155 11982 1 15 . 1 1 3 3 MET H H 3 8.745 8.745 9.026 -0.281 25155 11983 1 15 . 1 1 4 4 GLY N N 4 115.792 115.792 110.355 5.437 25155 11984 1 15 . 1 1 4 4 GLY C C 4 170.444 170.444 171.965 -1.521 25155 11985 1 15 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.169 -0.282 25155 11986 1 15 . 1 1 4 4 GLY H H 4 8.989 8.989 9.078 -0.089 25155 11987 1 15 . 1 1 5 5 LEU N N 5 131.175 131.175 124.755 6.420 25155 11988 1 15 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.326 0.996 25155 11989 1 15 . 1 1 5 5 LEU C C 5 175.700 175.700 174.671 1.029 25155 11990 1 15 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.710 -0.390 25155 11991 1 15 . 1 1 5 5 LEU CB C 5 44.700 44.700 43.890 0.810 25155 11992 1 15 . 1 1 5 5 LEU H H 5 8.917 8.917 7.950 0.967 25155 11993 1 15 . 1 1 6 6 PHE N N 6 125.990 125.990 125.178 0.812 25155 11994 1 15 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.842 -0.104 25155 11995 1 15 . 1 1 6 6 PHE C C 6 174.358 174.358 173.472 0.886 25155 11996 1 15 . 1 1 6 6 PHE CA C 6 55.480 55.480 55.086 0.395 25155 11997 1 15 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.488 -0.438 25155 11998 1 15 . 1 1 6 6 PHE H H 6 9.225 9.225 9.351 -0.126 25155 11999 1 15 . 1 1 7 7 TYR N N 7 118.040 118.040 118.479 -0.439 25155 12000 1 15 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.466 0.463 25155 12001 1 15 . 1 1 7 7 TYR C C 7 171.690 171.690 174.429 -2.739 25155 12002 1 15 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.323 -0.863 25155 12003 1 15 . 1 1 7 7 TYR CB C 7 40.800 40.800 39.991 0.809 25155 12004 1 15 . 1 1 7 7 TYR H H 7 8.235 8.235 8.076 0.159 25155 12005 1 15 . 1 1 8 8 GLY N N 8 106.640 106.640 107.449 -0.809 25155 12006 1 15 . 1 1 8 8 GLY C C 8 171.682 171.682 173.850 -2.168 25155 12007 1 15 . 1 1 8 8 GLY CA C 8 44.050 44.050 44.104 -0.054 25155 12008 1 15 . 1 1 8 8 GLY H H 8 6.996 6.996 8.541 -1.545 25155 12009 1 15 . 1 1 9 9 SER N N 9 118.164 118.164 116.068 2.096 25155 12010 1 15 . 1 1 9 9 SER C C 9 174.560 174.560 175.148 -0.588 25155 12011 1 15 . 1 1 9 9 SER CA C 9 57.140 57.140 58.945 -1.805 25155 12012 1 15 . 1 1 9 9 SER H H 9 9.680 9.680 8.580 1.100 25155 12013 1 15 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.756 -0.126 25155 12014 1 15 . 1 1 17 17 ALA C C 17 177.740 177.740 178.253 -0.513 25155 12015 1 15 . 1 1 17 17 ALA CA C 17 54.900 54.900 54.880 0.020 25155 12016 1 15 . 1 1 17 17 ALA CB C 17 17.790 17.790 18.636 -0.846 25155 12017 1 15 . 1 1 17 17 ALA H H 17 8.055 8.055 7.939 0.116 25155 12018 1 15 . 1 1 18 18 ALA N N 18 120.026 120.026 120.703 -0.677 25155 12019 1 15 . 1 1 18 18 ALA HA H 18 3.713 3.713 3.813 -0.100 25155 12020 1 15 . 1 1 18 18 ALA C C 18 179.040 179.040 179.181 -0.141 25155 12021 1 15 . 1 1 18 18 ALA CA C 18 54.860 54.860 55.272 -0.412 25155 12022 1 15 . 1 1 18 18 ALA CB C 18 18.200 18.200 17.792 0.408 25155 12023 1 15 . 1 1 18 18 ALA H H 18 7.015 7.015 7.822 -0.807 25155 12024 1 15 . 1 1 19 19 GLU N N 19 116.656 116.656 118.097 -1.441 25155 12025 1 15 . 1 1 19 19 GLU HA H 19 3.580 3.580 3.980 -0.400 25155 12026 1 15 . 1 1 19 19 GLU C C 19 178.487 178.487 178.814 -0.327 25155 12027 1 15 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.087 0.583 25155 12028 1 15 . 1 1 19 19 GLU CB C 19 29.400 29.400 28.879 0.521 25155 12029 1 15 . 1 1 20 20 LYS N N 20 120.100 120.100 120.402 -0.302 25155 12030 1 15 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.040 0.306 25155 12031 1 15 . 1 1 20 20 LYS C C 20 175.330 175.330 179.081 -3.751 25155 12032 1 15 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.377 -2.277 25155 12033 1 15 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.460 0.540 25155 12034 1 15 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.647 -0.182 25155 12035 1 15 . 1 1 21 21 ILE C C 21 177.680 177.680 178.106 -0.426 25155 12036 1 15 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.645 -0.005 25155 12037 1 15 . 1 1 21 21 ILE CB C 21 38.030 38.030 37.867 0.163 25155 12038 1 15 . 1 1 21 21 ILE H H 21 8.220 8.220 8.606 -0.386 25155 12039 1 15 . 1 1 22 22 ARG N N 22 119.433 119.433 119.691 -0.258 25155 12040 1 15 . 1 1 22 22 ARG HA H 22 3.550 3.550 3.932 -0.382 25155 12041 1 15 . 1 1 22 22 ARG C C 22 177.268 177.268 178.273 -1.005 25155 12042 1 15 . 1 1 22 22 ARG CA C 22 59.760 59.760 59.642 0.118 25155 12043 1 15 . 1 1 22 22 ARG CB C 22 28.900 28.900 29.834 -0.934 25155 12044 1 15 . 1 1 23 23 ASP N N 23 118.945 118.945 119.755 -0.810 25155 12045 1 15 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.461 -0.119 25155 12046 1 15 . 1 1 23 23 ASP C C 23 178.470 178.470 178.831 -0.361 25155 12047 1 15 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.212 0.238 25155 12048 1 15 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.899 -0.529 25155 12049 1 15 . 1 1 24 24 ILE N N 24 121.200 121.200 119.269 1.931 25155 12050 1 15 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.814 -0.080 25155 12051 1 15 . 1 1 24 24 ILE C C 24 178.297 178.297 177.886 0.411 25155 12052 1 15 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.687 -0.187 25155 12053 1 15 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.472 0.268 25155 12054 1 15 . 1 1 24 24 ILE H H 24 8.160 8.160 8.108 0.052 25155 12055 1 15 . 1 1 25 25 ILE N N 25 121.166 121.166 117.739 3.427 25155 12056 1 15 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.890 -0.247 25155 12057 1 15 . 1 1 25 25 ILE C C 25 176.825 176.825 176.647 0.178 25155 12058 1 15 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.121 2.769 25155 12059 1 15 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.854 -1.104 25155 12060 1 15 . 1 1 25 25 ILE H H 25 8.480 8.480 7.999 0.481 25155 12061 1 15 . 1 1 26 26 GLY N N 26 109.050 109.050 104.880 4.170 25155 12062 1 15 . 1 1 26 26 GLY C C 26 173.800 173.800 172.551 1.249 25155 12063 1 15 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.475 -0.075 25155 12064 1 15 . 1 1 26 26 GLY H H 26 7.945 7.945 7.711 0.234 25155 12065 1 15 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.486 -0.123 25155 12066 1 15 . 1 1 27 27 PRO C C 27 177.157 177.157 176.977 0.180 25155 12067 1 15 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.745 0.785 25155 12068 1 15 . 1 1 27 27 PRO CB C 27 32.000 32.000 32.125 -0.125 25155 12069 1 15 . 1 1 28 28 GLU N N 28 116.510 116.510 116.946 -0.436 25155 12070 1 15 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.251 0.009 25155 12071 1 15 . 1 1 28 28 GLU C C 28 177.000 177.000 176.997 0.003 25155 12072 1 15 . 1 1 28 28 GLU CA C 28 57.680 57.680 57.696 -0.016 25155 12073 1 15 . 1 1 28 28 GLU CB C 28 28.620 28.620 29.235 -0.615 25155 12074 1 15 . 1 1 29 29 LEU N N 29 120.334 120.334 112.591 7.743 25155 12075 1 15 . 1 1 29 29 LEU HA H 29 4.650 4.650 4.778 -0.128 25155 12076 1 15 . 1 1 29 29 LEU C C 29 175.676 175.676 174.924 0.752 25155 12077 1 15 . 1 1 29 29 LEU CA C 29 55.924 55.924 54.767 1.157 25155 12078 1 15 . 1 1 29 29 LEU CB C 29 44.880 44.880 43.918 0.962 25155 12079 1 15 . 1 1 29 29 LEU H H 29 7.924 7.924 7.500 0.424 25155 12080 1 15 . 1 1 30 30 VAL N N 30 118.900 118.900 121.051 -2.151 25155 12081 1 15 . 1 1 30 30 VAL HA H 30 4.639 4.639 5.101 -0.462 25155 12082 1 15 . 1 1 30 30 VAL C C 30 174.368 174.368 175.797 -1.429 25155 12083 1 15 . 1 1 30 30 VAL CA C 30 61.110 61.110 60.939 0.171 25155 12084 1 15 . 1 1 30 30 VAL CB C 30 34.500 34.500 35.041 -0.541 25155 12085 1 15 . 1 1 30 30 VAL H H 30 7.486 7.486 7.417 0.069 25155 12086 1 15 . 1 1 31 31 THR N N 31 124.000 124.000 120.361 3.639 25155 12087 1 15 . 1 1 31 31 THR HA H 31 4.331 4.331 4.758 -0.427 25155 12088 1 15 . 1 1 31 31 THR C C 31 172.670 172.670 173.408 -0.738 25155 12089 1 15 . 1 1 31 31 THR CA C 31 61.784 61.784 61.141 0.643 25155 12090 1 15 . 1 1 31 31 THR CB C 31 70.483 70.483 71.368 -0.885 25155 12091 1 15 . 1 1 31 31 THR H H 31 7.947 7.947 8.357 -0.410 25155 12092 1 15 . 1 1 32 32 LEU N N 32 127.408 127.408 126.001 1.407 25155 12093 1 15 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.472 0.165 25155 12094 1 15 . 1 1 32 32 LEU C C 32 176.425 176.425 176.565 -0.140 25155 12095 1 15 . 1 1 32 32 LEU CA C 32 54.760 54.760 55.127 -0.367 25155 12096 1 15 . 1 1 32 32 LEU CB C 32 43.809 43.809 42.784 1.025 25155 12097 1 15 . 1 1 32 32 LEU H H 32 8.614 8.614 8.721 -0.107 25155 12098 1 15 . 1 1 33 33 HIS N N 33 120.230 120.230 124.040 -3.810 25155 12099 1 15 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.731 -0.311 25155 12100 1 15 . 1 1 33 33 HIS C C 33 171.914 171.914 174.007 -2.093 25155 12101 1 15 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.222 1.077 25155 12102 1 15 . 1 1 33 33 HIS CB C 33 32.050 32.050 31.167 0.883 25155 12103 1 15 . 1 1 33 33 HIS H H 33 9.130 9.130 9.056 0.074 25155 12104 1 15 . 1 1 34 34 ASN N N 34 123.987 123.987 121.073 2.914 25155 12105 1 15 . 1 1 34 34 ASN HA H 34 3.600 3.600 3.774 -0.174 25155 12106 1 15 . 1 1 34 34 ASN C C 34 177.930 177.930 175.562 2.368 25155 12107 1 15 . 1 1 34 34 ASN CA C 34 51.730 51.730 52.862 -1.132 25155 12108 1 15 . 1 1 34 34 ASN CB C 34 38.747 38.747 38.072 0.675 25155 12109 1 15 . 1 1 34 34 ASN H H 34 8.759 8.759 8.503 0.256 25155 12110 1 15 . 1 1 35 35 LEU N N 35 128.751 128.751 126.143 2.608 25155 12111 1 15 . 1 1 35 35 LEU HA H 35 4.290 4.290 3.977 0.313 25155 12112 1 15 . 1 1 35 35 LEU C C 35 177.363 177.363 178.640 -1.277 25155 12113 1 15 . 1 1 35 35 LEU CA C 35 56.550 56.550 57.294 -0.744 25155 12114 1 15 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.833 0.929 25155 12115 1 15 . 1 1 35 35 LEU H H 35 8.758 8.758 8.532 0.226 25155 12116 1 15 . 1 1 36 36 LYS N N 36 120.870 120.870 117.517 3.353 25155 12117 1 15 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.099 -0.166 25155 12118 1 15 . 1 1 36 36 LYS C C 36 176.540 176.540 177.413 -0.873 25155 12119 1 15 . 1 1 36 36 LYS CA C 36 59.260 59.260 58.484 0.776 25155 12120 1 15 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.313 0.487 25155 12121 1 15 . 1 1 37 37 ASP N N 37 115.288 115.288 116.981 -1.693 25155 12122 1 15 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.655 0.092 25155 12123 1 15 . 1 1 37 37 ASP C C 37 175.500 175.500 176.142 -0.642 25155 12124 1 15 . 1 1 37 37 ASP CA C 37 54.805 54.805 55.056 -0.251 25155 12125 1 15 . 1 1 37 37 ASP CB C 37 44.650 44.650 42.521 2.129 25155 12126 1 15 . 1 1 38 38 ASP N N 38 121.550 121.550 118.329 3.221 25155 12127 1 15 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.930 -0.065 25155 12128 1 15 . 1 1 38 38 ASP C C 38 174.895 174.895 174.822 0.073 25155 12129 1 15 . 1 1 38 38 ASP CA C 38 52.840 52.840 53.118 -0.278 25155 12130 1 15 . 1 1 38 38 ASP CB C 38 42.240 42.240 44.178 -1.938 25155 12131 1 15 . 1 1 39 39 SER N N 39 115.170 115.170 118.085 -2.915 25155 12132 1 15 . 1 1 39 39 SER HA H 39 4.600 4.600 4.706 -0.106 25155 12133 1 15 . 1 1 39 39 SER C C 39 174.930 174.930 174.357 0.573 25155 12134 1 15 . 1 1 39 39 SER CA C 39 54.786 54.786 57.520 -2.733 25155 12135 1 15 . 1 1 39 39 SER CB C 39 64.840 64.840 63.211 1.629 25155 12136 1 15 . 1 1 39 39 SER H H 39 8.330 8.330 8.704 -0.374 25155 12137 1 15 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.485 -0.485 25155 12138 1 15 . 1 1 40 40 PRO C C 40 176.620 176.620 177.929 -1.309 25155 12139 1 15 . 1 1 40 40 PRO CA C 40 63.870 63.870 65.044 -1.174 25155 12140 1 15 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.818 -0.458 25155 12141 1 15 . 1 1 41 41 LYS N N 41 120.913 120.913 117.796 3.117 25155 12142 1 15 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.205 -0.309 25155 12143 1 15 . 1 1 41 41 LYS C C 41 179.580 179.580 178.520 1.060 25155 12144 1 15 . 1 1 41 41 LYS CA C 41 58.000 58.000 57.805 0.195 25155 12145 1 15 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.195 0.905 25155 12146 1 15 . 1 1 42 42 LEU N N 42 118.206 118.206 120.785 -2.579 25155 12147 1 15 . 1 1 42 42 LEU HA H 42 4.025 4.025 4.042 -0.017 25155 12148 1 15 . 1 1 42 42 LEU C C 42 178.630 178.630 178.549 0.081 25155 12149 1 15 . 1 1 42 42 LEU CA C 42 57.030 57.030 57.039 -0.009 25155 12150 1 15 . 1 1 42 42 LEU CB C 42 41.820 41.820 40.773 1.047 25155 12151 1 15 . 1 1 42 42 LEU H H 42 7.598 7.598 7.607 -0.009 25155 12152 1 15 . 1 1 43 43 MET N N 43 118.913 118.913 116.968 1.945 25155 12153 1 15 . 1 1 43 43 MET HA H 43 3.760 3.760 4.149 -0.389 25155 12154 1 15 . 1 1 43 43 MET C C 43 177.710 177.710 177.815 -0.105 25155 12155 1 15 . 1 1 43 43 MET CA C 43 59.864 59.864 58.411 1.452 25155 12156 1 15 . 1 1 43 43 MET CB C 43 32.680 32.680 31.895 0.785 25155 12157 1 15 . 1 1 43 43 MET H H 43 8.180 8.180 8.071 0.109 25155 12158 1 15 . 1 1 44 44 GLU N N 44 110.906 110.906 117.802 -6.896 25155 12159 1 15 . 1 1 44 44 GLU HA H 44 3.732 3.732 4.098 -0.366 25155 12160 1 15 . 1 1 44 44 GLU C C 44 178.120 178.120 178.970 -0.850 25155 12161 1 15 . 1 1 44 44 GLU CA C 44 59.450 59.450 58.905 0.545 25155 12162 1 15 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.579 0.221 25155 12163 1 15 . 1 1 45 45 GLN N N 45 115.770 115.770 118.020 -2.250 25155 12164 1 15 . 1 1 45 45 GLN HA H 45 4.190 4.190 3.986 0.204 25155 12165 1 15 . 1 1 45 45 GLN C C 45 175.480 175.480 176.455 -0.975 25155 12166 1 15 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.327 -1.227 25155 12167 1 15 . 1 1 45 45 GLN CB C 45 28.490 28.490 28.802 -0.312 25155 12168 1 15 . 1 1 45 45 GLN H H 45 7.517 7.517 7.517 -0.000 25155 12169 1 15 . 1 1 46 46 TYR N N 46 117.840 117.840 117.001 0.839 25155 12170 1 15 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.538 0.122 25155 12171 1 15 . 1 1 46 46 TYR C C 46 175.480 175.480 176.706 -1.226 25155 12172 1 15 . 1 1 46 46 TYR CA C 46 58.827 58.827 58.424 0.403 25155 12173 1 15 . 1 1 46 46 TYR CB C 46 41.720 41.720 38.726 2.994 25155 12174 1 15 . 1 1 46 46 TYR H H 46 6.955 6.955 7.389 -0.434 25155 12175 1 15 . 1 1 47 47 ASP N N 47 121.540 121.540 121.826 -0.286 25155 12176 1 15 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.634 0.062 25155 12177 1 15 . 1 1 47 47 ASP C C 47 175.677 175.677 175.630 0.047 25155 12178 1 15 . 1 1 47 47 ASP CA C 47 56.812 56.812 56.724 0.088 25155 12179 1 15 . 1 1 47 47 ASP CB C 47 42.978 42.978 42.202 0.776 25155 12180 1 15 . 1 1 48 48 VAL N N 48 118.666 118.666 117.045 1.621 25155 12181 1 15 . 1 1 48 48 VAL HA H 48 5.057 5.057 5.081 -0.024 25155 12182 1 15 . 1 1 48 48 VAL C C 48 174.180 174.180 173.563 0.617 25155 12183 1 15 . 1 1 48 48 VAL CA C 48 60.000 60.000 59.853 0.147 25155 12184 1 15 . 1 1 48 48 VAL CB C 48 36.200 36.200 34.847 1.353 25155 12185 1 15 . 1 1 48 48 VAL H H 48 7.631 7.631 8.165 -0.534 25155 12186 1 15 . 1 1 49 49 LEU N N 49 128.300 128.300 129.563 -1.263 25155 12187 1 15 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.028 0.572 25155 12188 1 15 . 1 1 49 49 LEU C C 49 174.810 174.810 174.984 -0.174 25155 12189 1 15 . 1 1 49 49 LEU CA C 49 52.230 52.230 54.314 -2.084 25155 12190 1 15 . 1 1 49 49 LEU CB C 49 45.400 45.400 44.788 0.612 25155 12191 1 15 . 1 1 49 49 LEU H H 49 9.469 9.469 8.613 0.856 25155 12192 1 15 . 1 1 50 50 ILE N N 50 124.400 124.400 127.377 -2.977 25155 12193 1 15 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.684 0.966 25155 12194 1 15 . 1 1 50 50 ILE C C 50 175.286 175.286 174.331 0.955 25155 12195 1 15 . 1 1 50 50 ILE CA C 50 59.900 59.900 61.474 -1.575 25155 12196 1 15 . 1 1 50 50 ILE CB C 50 40.200 40.200 39.512 0.688 25155 12197 1 15 . 1 1 50 50 ILE H H 50 9.213 9.213 9.223 -0.010 25155 12198 1 15 . 1 1 51 51 LEU N N 51 127.410 127.410 129.114 -1.704 25155 12199 1 15 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.596 1.474 25155 12200 1 15 . 1 1 51 51 LEU C C 51 174.540 174.540 174.489 0.051 25155 12201 1 15 . 1 1 51 51 LEU CA C 51 52.950 52.950 52.559 0.391 25155 12202 1 15 . 1 1 51 51 LEU CB C 51 43.190 43.190 44.953 -1.763 25155 12203 1 15 . 1 1 51 51 LEU H H 51 9.256 9.256 8.925 0.331 25155 12204 1 15 . 1 1 52 52 GLY N N 52 108.290 108.290 113.214 -4.924 25155 12205 1 15 . 1 1 52 52 GLY C C 52 174.330 174.330 171.139 3.191 25155 12206 1 15 . 1 1 52 52 GLY CA C 52 44.040 44.040 43.107 0.933 25155 12207 1 15 . 1 1 52 52 GLY H H 52 8.949 8.949 8.348 0.601 25155 12208 1 15 . 1 1 53 53 ILE N N 53 124.912 124.912 121.186 3.726 25155 12209 1 15 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.394 -0.219 25155 12210 1 15 . 1 1 53 53 ILE C C 53 174.470 174.470 172.963 1.507 25155 12211 1 15 . 1 1 53 53 ILE CA C 53 55.850 55.850 57.414 -1.564 25155 12212 1 15 . 1 1 53 53 ILE CB C 53 42.800 42.800 42.193 0.607 25155 12213 1 15 . 1 1 53 53 ILE H H 53 8.612 8.612 7.194 1.418 25155 12214 1 15 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.370 0.442 25155 12215 1 15 . 1 1 54 54 PRO C C 54 174.565 174.565 175.457 -0.892 25155 12216 1 15 . 1 1 54 54 PRO CA C 54 61.850 61.850 61.471 0.379 25155 12217 1 15 . 1 1 54 54 PRO CB C 54 32.400 32.400 31.189 1.211 25155 12218 1 15 . 1 1 55 55 THR N N 55 116.040 116.040 119.824 -3.784 25155 12219 1 15 . 1 1 55 55 THR HA H 55 4.522 4.522 4.105 0.417 25155 12220 1 15 . 1 1 55 55 THR C C 55 173.990 173.990 172.950 1.040 25155 12221 1 15 . 1 1 55 55 THR CA C 55 62.845 62.845 61.803 1.042 25155 12222 1 15 . 1 1 55 55 THR CB C 55 70.795 70.795 69.816 0.980 25155 12223 1 15 . 1 1 55 55 THR H H 55 7.663 7.663 8.314 -0.651 25155 12224 1 15 . 1 1 56 56 TRP N N 56 130.540 130.540 125.209 5.331 25155 12225 1 15 . 1 1 56 56 TRP CA C 56 54.800 54.800 55.889 -1.089 25155 12226 1 15 . 1 1 56 56 TRP H H 56 9.075 9.075 8.053 1.022 25155 12227 1 15 . 1 1 58 58 PHE HA H 58 4.540 4.540 4.637 -0.097 25155 12228 1 15 . 1 1 58 58 PHE C C 58 177.070 177.070 177.330 -0.260 25155 12229 1 15 . 1 1 58 58 PHE CA C 58 55.460 55.460 56.938 -1.478 25155 12230 1 15 . 1 1 58 58 PHE CB C 58 41.200 41.200 39.847 1.353 25155 12231 1 15 . 1 1 59 59 GLY N N 59 109.796 109.796 110.779 -0.983 25155 12232 1 15 . 1 1 59 59 GLY CA C 59 45.763 45.763 45.295 0.468 25155 12233 1 15 . 1 1 59 59 GLY H H 59 8.392 8.392 8.800 -0.408 25155 12234 1 15 . 1 1 60 60 GLU C C 60 175.660 175.660 175.755 -0.095 25155 12235 1 15 . 1 1 61 61 ILE N N 61 122.380 122.380 121.137 1.243 25155 12236 1 15 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.340 1.100 25155 12237 1 15 . 1 1 61 61 ILE CA C 61 62.100 62.100 62.383 -0.283 25155 12238 1 15 . 1 1 61 61 ILE CB C 61 38.750 38.750 37.137 1.613 25155 12239 1 15 . 1 1 61 61 ILE H H 61 8.436 8.436 8.169 0.267 25155 12240 1 15 . 1 1 62 62 GLN CB C 62 30.570 30.570 28.666 1.904 25155 12241 1 15 . 1 1 63 63 GLU HA H 63 4.030 4.030 3.889 0.141 25155 12242 1 15 . 1 1 63 63 GLU C C 63 177.134 177.134 178.180 -1.046 25155 12243 1 15 . 1 1 63 63 GLU CA C 63 60.520 60.520 59.976 0.544 25155 12244 1 15 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.546 0.104 25155 12245 1 15 . 1 1 64 64 ASP N N 64 119.630 119.630 118.915 0.715 25155 12246 1 15 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.463 0.129 25155 12247 1 15 . 1 1 64 64 ASP C C 64 178.680 178.680 178.212 0.468 25155 12248 1 15 . 1 1 64 64 ASP CA C 64 57.823 57.823 57.481 0.342 25155 12249 1 15 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.823 0.277 25155 12250 1 15 . 1 1 65 65 TRP N N 65 120.535 120.535 120.744 -0.209 25155 12251 1 15 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.341 -0.016 25155 12252 1 15 . 1 1 65 65 TRP C C 65 178.684 178.684 177.791 0.893 25155 12253 1 15 . 1 1 65 65 TRP CA C 65 60.500 60.500 60.928 -0.428 25155 12254 1 15 . 1 1 65 65 TRP CB C 65 30.100 30.100 30.278 -0.178 25155 12255 1 15 . 1 1 65 65 TRP H H 65 7.416 7.416 7.624 -0.208 25155 12256 1 15 . 1 1 66 66 GLU N N 66 120.760 120.760 120.130 0.630 25155 12257 1 15 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.314 -0.494 25155 12258 1 15 . 1 1 66 66 GLU C C 66 178.860 178.860 178.885 -0.025 25155 12259 1 15 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.794 0.306 25155 12260 1 15 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.532 -0.522 25155 12261 1 15 . 1 1 67 67 ALA N N 67 118.972 118.972 122.003 -3.031 25155 12262 1 15 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.234 0.013 25155 12263 1 15 . 1 1 67 67 ALA C C 67 179.610 179.610 179.015 0.595 25155 12264 1 15 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.859 -0.259 25155 12265 1 15 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.818 -0.030 25155 12266 1 15 . 1 1 67 67 ALA H H 67 7.690 7.690 8.444 -0.754 25155 12267 1 15 . 1 1 68 68 VAL N N 68 107.530 107.530 111.949 -4.419 25155 12268 1 15 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.307 0.403 25155 12269 1 15 . 1 1 68 68 VAL C C 68 176.800 176.800 177.186 -0.386 25155 12270 1 15 . 1 1 68 68 VAL CA C 68 60.060 60.060 62.371 -2.311 25155 12271 1 15 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.159 0.441 25155 12272 1 15 . 1 1 68 68 VAL H H 68 7.240 7.240 7.444 -0.204 25155 12273 1 15 . 1 1 69 69 TRP N N 69 126.960 126.960 125.648 1.312 25155 12274 1 15 . 1 1 69 69 TRP HA H 69 4.182 4.182 4.008 0.174 25155 12275 1 15 . 1 1 69 69 TRP C C 69 178.640 178.640 176.675 1.965 25155 12276 1 15 . 1 1 69 69 TRP CA C 69 61.300 61.300 61.953 -0.653 25155 12277 1 15 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.008 2.562 25155 12278 1 15 . 1 1 69 69 TRP H H 69 7.810 7.810 8.266 -0.456 25155 12279 1 15 . 1 1 70 70 ASP N N 70 114.644 114.644 116.449 -1.805 25155 12280 1 15 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.248 0.271 25155 12281 1 15 . 1 1 70 70 ASP C C 70 178.685 178.685 178.037 0.648 25155 12282 1 15 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.335 -0.335 25155 12283 1 15 . 1 1 70 70 ASP CB C 70 39.810 39.810 41.042 -1.232 25155 12284 1 15 . 1 1 71 71 GLN N N 71 120.100 120.100 117.087 3.013 25155 12285 1 15 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.240 -0.050 25155 12286 1 15 . 1 1 71 71 GLN C C 71 178.870 178.870 178.223 0.647 25155 12287 1 15 . 1 1 71 71 GLN CA C 71 57.617 57.617 56.998 0.619 25155 12288 1 15 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.501 -0.681 25155 12289 1 15 . 1 1 71 71 GLN H H 71 7.980 7.980 7.917 0.063 25155 12290 1 15 . 1 1 72 72 LEU N N 72 117.535 117.535 120.212 -2.677 25155 12291 1 15 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.945 -0.148 25155 12292 1 15 . 1 1 72 72 LEU C C 72 178.308 178.308 178.080 0.228 25155 12293 1 15 . 1 1 72 72 LEU CA C 72 57.340 57.340 57.240 0.100 25155 12294 1 15 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.546 0.154 25155 12295 1 15 . 1 1 72 72 LEU H H 72 7.435 7.435 7.746 -0.311 25155 12296 1 15 . 1 1 73 73 ASP N N 73 115.534 115.534 117.472 -1.938 25155 12297 1 15 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.422 -0.272 25155 12298 1 15 . 1 1 73 73 ASP C C 73 177.553 177.553 176.801 0.752 25155 12299 1 15 . 1 1 73 73 ASP CA C 73 57.350 57.350 56.196 1.154 25155 12300 1 15 . 1 1 73 73 ASP CB C 73 40.040 40.040 41.592 -1.552 25155 12301 1 15 . 1 1 74 74 ASP N N 74 117.300 117.300 120.175 -2.875 25155 12302 1 15 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.496 0.210 25155 12303 1 15 . 1 1 74 74 ASP C C 74 176.424 176.424 177.231 -0.807 25155 12304 1 15 . 1 1 74 74 ASP CA C 74 54.170 54.170 55.557 -1.387 25155 12305 1 15 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.353 0.467 25155 12306 1 15 . 1 1 75 75 LEU N N 75 118.500 118.500 120.369 -1.869 25155 12307 1 15 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.168 0.127 25155 12308 1 15 . 1 1 75 75 LEU C C 75 176.800 176.800 176.484 0.316 25155 12309 1 15 . 1 1 75 75 LEU CA C 75 54.400 54.400 55.027 -0.627 25155 12310 1 15 . 1 1 75 75 LEU CB C 75 43.280 43.280 41.833 1.447 25155 12311 1 15 . 1 1 75 75 LEU H H 75 6.966 6.966 7.328 -0.362 25155 12312 1 15 . 1 1 76 76 ASN N N 76 123.040 123.040 120.768 2.272 25155 12313 1 15 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.623 0.239 25155 12314 1 15 . 1 1 76 76 ASN C C 76 174.927 174.927 174.792 0.135 25155 12315 1 15 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.544 -1.663 25155 12316 1 15 . 1 1 76 76 ASN CB C 76 37.510 37.510 38.443 -0.933 25155 12317 1 15 . 1 1 76 76 ASN H H 76 9.882 9.882 9.024 0.858 25155 12318 1 15 . 1 1 77 77 LEU N N 77 123.614 123.614 123.412 0.202 25155 12319 1 15 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.548 -0.178 25155 12320 1 15 . 1 1 77 77 LEU C C 77 175.110 175.110 176.665 -1.555 25155 12321 1 15 . 1 1 77 77 LEU CA C 77 52.200 52.200 54.066 -1.866 25155 12322 1 15 . 1 1 77 77 LEU CB C 77 42.786 42.786 42.780 0.006 25155 12323 1 15 . 1 1 77 77 LEU H H 77 8.700 8.700 7.893 0.807 25155 12324 1 15 . 1 1 78 78 GLU N N 78 120.822 120.822 121.538 -0.716 25155 12325 1 15 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.248 -0.348 25155 12326 1 15 . 1 1 78 78 GLU C C 78 178.670 178.670 178.078 0.592 25155 12327 1 15 . 1 1 78 78 GLU CA C 78 58.700 58.700 58.052 0.648 25155 12328 1 15 . 1 1 78 78 GLU CB C 78 29.467 29.467 29.445 0.022 25155 12329 1 15 . 1 1 79 79 GLY N N 79 113.160 113.160 113.989 -0.829 25155 12330 1 15 . 1 1 79 79 GLY C C 79 174.523 174.523 173.669 0.854 25155 12331 1 15 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.433 -0.013 25155 12332 1 15 . 1 1 79 79 GLY H H 79 8.450 8.450 8.815 -0.365 25155 12333 1 15 . 1 1 80 80 LYS N N 80 120.283 120.283 119.559 0.724 25155 12334 1 15 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.378 -0.020 25155 12335 1 15 . 1 1 80 80 LYS C C 80 175.304 175.304 176.054 -0.750 25155 12336 1 15 . 1 1 80 80 LYS CA C 80 56.890 56.890 55.807 1.083 25155 12337 1 15 . 1 1 80 80 LYS CB C 80 33.120 33.120 34.038 -0.918 25155 12338 1 15 . 1 1 81 81 ILE N N 81 122.288 122.288 121.399 0.889 25155 12339 1 15 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.408 0.398 25155 12340 1 15 . 1 1 81 81 ILE C C 81 174.750 174.750 175.481 -0.731 25155 12341 1 15 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.762 -1.942 25155 12342 1 15 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.481 0.369 25155 12343 1 15 . 1 1 81 81 ILE H H 81 7.405 7.405 8.409 -1.004 25155 12344 1 15 . 1 1 82 82 VAL N N 82 127.793 127.793 125.384 2.409 25155 12345 1 15 . 1 1 82 82 VAL HA H 82 5.280 5.280 4.963 0.317 25155 12346 1 15 . 1 1 82 82 VAL C C 82 172.680 172.680 173.941 -1.261 25155 12347 1 15 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.189 -0.089 25155 12348 1 15 . 1 1 82 82 VAL CB C 82 35.280 35.280 36.518 -1.238 25155 12349 1 15 . 1 1 82 82 VAL H H 82 8.800 8.800 8.983 -0.183 25155 12350 1 15 . 1 1 83 83 ALA N N 83 130.911 130.911 128.473 2.438 25155 12351 1 15 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.747 -0.358 25155 12352 1 15 . 1 1 83 83 ALA C C 83 175.870 175.870 175.868 0.002 25155 12353 1 15 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.540 0.460 25155 12354 1 15 . 1 1 83 83 ALA CB C 83 23.722 23.722 22.930 0.792 25155 12355 1 15 . 1 1 83 83 ALA H H 83 9.252 9.252 8.731 0.521 25155 12356 1 15 . 1 1 84 84 LEU N N 84 124.269 124.269 122.232 2.037 25155 12357 1 15 . 1 1 84 84 LEU HA H 84 5.508 5.508 5.533 -0.025 25155 12358 1 15 . 1 1 84 84 LEU C C 84 175.490 175.490 175.731 -0.241 25155 12359 1 15 . 1 1 84 84 LEU CA C 84 53.670 53.670 54.312 -0.642 25155 12360 1 15 . 1 1 84 84 LEU CB C 84 45.000 45.000 46.225 -1.225 25155 12361 1 15 . 1 1 84 84 LEU H H 84 10.378 10.378 8.773 1.605 25155 12362 1 15 . 1 1 85 85 TYR N N 85 115.826 115.826 118.528 -2.702 25155 12363 1 15 . 1 1 85 85 TYR HA H 85 4.950 4.950 5.189 -0.239 25155 12364 1 15 . 1 1 85 85 TYR C C 85 172.661 172.661 173.626 -0.965 25155 12365 1 15 . 1 1 85 85 TYR CA C 85 55.853 55.853 55.250 0.603 25155 12366 1 15 . 1 1 85 85 TYR CB C 85 43.200 43.200 41.236 1.964 25155 12367 1 15 . 1 1 85 85 TYR H H 85 9.200 9.200 8.556 0.644 25155 12368 1 15 . 1 1 86 86 GLY N N 86 106.802 106.802 105.124 1.678 25155 12369 1 15 . 1 1 86 86 GLY C C 86 170.348 170.348 170.803 -0.455 25155 12370 1 15 . 1 1 86 86 GLY CA C 86 44.687 44.687 44.549 0.138 25155 12371 1 15 . 1 1 86 86 GLY H H 86 8.752 8.752 8.290 0.462 25155 12372 1 15 . 1 1 87 87 LEU N N 87 120.860 120.860 121.061 -0.201 25155 12373 1 15 . 1 1 87 87 LEU HA H 87 5.476 5.476 5.101 0.375 25155 12374 1 15 . 1 1 87 87 LEU C C 87 177.720 177.720 174.712 3.008 25155 12375 1 15 . 1 1 87 87 LEU CA C 87 52.630 52.630 51.885 0.745 25155 12376 1 15 . 1 1 87 87 LEU CB C 87 45.900 45.900 45.042 0.858 25155 12377 1 15 . 1 1 87 87 LEU H H 87 6.320 6.320 7.704 -1.384 25155 12378 1 15 . 1 1 88 88 GLY N N 88 109.910 109.910 111.465 -1.555 25155 12379 1 15 . 1 1 88 88 GLY C C 88 171.386 171.386 171.542 -0.156 25155 12380 1 15 . 1 1 88 88 GLY CA C 88 45.710 45.710 45.130 0.580 25155 12381 1 15 . 1 1 88 88 GLY H H 88 8.320 8.320 8.099 0.221 25155 12382 1 15 . 1 1 89 89 ASP N N 89 121.580 121.580 118.194 3.386 25155 12383 1 15 . 1 1 89 89 ASP HA H 89 5.190 5.190 5.179 0.011 25155 12384 1 15 . 1 1 89 89 ASP C C 89 176.608 176.608 176.501 0.107 25155 12385 1 15 . 1 1 89 89 ASP CA C 89 52.200 52.200 52.847 -0.647 25155 12386 1 15 . 1 1 89 89 ASP CB C 89 41.900 41.900 43.230 -1.330 25155 12387 1 15 . 1 1 90 90 GLN N N 90 123.900 123.900 125.406 -1.506 25155 12388 1 15 . 1 1 90 90 GLN HA H 90 3.645 3.645 4.210 -0.565 25155 12389 1 15 . 1 1 90 90 GLN C C 90 173.523 173.523 176.246 -2.723 25155 12390 1 15 . 1 1 90 90 GLN CA C 90 58.706 58.706 58.074 0.632 25155 12391 1 15 . 1 1 90 90 GLN CB C 90 28.800 28.800 28.505 0.295 25155 12392 1 15 . 1 1 90 90 GLN H H 90 8.726 8.726 8.847 -0.121 25155 12393 1 15 . 1 1 91 91 LEU N N 91 117.080 117.080 119.210 -2.130 25155 12394 1 15 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.126 0.344 25155 12395 1 15 . 1 1 91 91 LEU C C 91 179.840 179.840 178.605 1.235 25155 12396 1 15 . 1 1 91 91 LEU CA C 91 55.800 55.800 55.943 -0.143 25155 12397 1 15 . 1 1 91 91 LEU CB C 91 41.640 41.640 41.920 -0.280 25155 12398 1 15 . 1 1 91 91 LEU H H 91 7.092 7.092 8.648 -1.556 25155 12399 1 15 . 1 1 92 92 GLY N N 92 110.460 110.460 106.133 4.327 25155 12400 1 15 . 1 1 92 92 GLY C C 92 174.824 174.824 174.927 -0.103 25155 12401 1 15 . 1 1 92 92 GLY CA C 92 46.390 46.390 46.377 0.013 25155 12402 1 15 . 1 1 92 92 GLY H H 92 9.243 9.243 8.663 0.580 25155 12403 1 15 . 1 1 93 93 TYR N N 93 118.140 118.140 120.131 -1.991 25155 12404 1 15 . 1 1 93 93 TYR HA H 93 5.173 5.173 5.012 0.161 25155 12405 1 15 . 1 1 93 93 TYR C C 93 177.805 177.805 178.170 -0.365 25155 12406 1 15 . 1 1 93 93 TYR CA C 93 57.430 57.430 58.471 -1.041 25155 12407 1 15 . 1 1 93 93 TYR CB C 93 39.300 39.300 39.440 -0.140 25155 12408 1 15 . 1 1 93 93 TYR H H 93 7.252 7.252 7.647 -0.395 25155 12409 1 15 . 1 1 94 94 GLY N N 94 112.455 112.455 106.295 6.160 25155 12410 1 15 . 1 1 94 94 GLY C C 94 177.740 177.740 175.838 1.902 25155 12411 1 15 . 1 1 94 94 GLY CA C 94 49.880 49.880 46.832 3.048 25155 12412 1 15 . 1 1 94 94 GLY H H 94 8.154 8.154 8.676 -0.522 25155 12413 1 15 . 1 1 95 95 GLU N N 95 123.040 123.040 121.487 1.553 25155 12414 1 15 . 1 1 95 95 GLU HA H 95 4.000 4.000 4.153 -0.153 25155 12415 1 15 . 1 1 95 95 GLU C C 95 175.145 175.145 177.414 -2.269 25155 12416 1 15 . 1 1 95 95 GLU CA C 95 57.950 57.950 57.845 0.105 25155 12417 1 15 . 1 1 95 95 GLU CB C 95 27.400 27.400 29.394 -1.994 25155 12418 1 15 . 1 1 96 96 TRP N N 96 118.000 118.000 117.537 0.463 25155 12419 1 15 . 1 1 96 96 TRP HA H 96 5.213 5.213 4.977 0.236 25155 12420 1 15 . 1 1 96 96 TRP C C 96 176.616 176.616 175.556 1.060 25155 12421 1 15 . 1 1 96 96 TRP CA C 96 57.120 57.120 55.230 1.890 25155 12422 1 15 . 1 1 96 96 TRP CB C 96 29.970 29.970 28.935 1.035 25155 12423 1 15 . 1 1 96 96 TRP H H 96 7.785 7.785 7.800 -0.015 25155 12424 1 15 . 1 1 97 97 PHE N N 97 123.268 123.268 123.249 0.019 25155 12425 1 15 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.392 0.268 25155 12426 1 15 . 1 1 97 97 PHE CA C 97 58.742 58.742 59.468 -0.726 25155 12427 1 15 . 1 1 97 97 PHE CB C 97 40.835 40.835 39.932 0.903 25155 12428 1 15 . 1 1 97 97 PHE H H 97 7.054 7.054 8.393 -1.339 25155 12429 1 15 . 1 1 98 98 LEU HA H 98 3.440 3.440 3.421 0.019 25155 12430 1 15 . 1 1 98 98 LEU C C 98 176.613 176.613 177.004 -0.391 25155 12431 1 15 . 1 1 98 98 LEU CA C 98 56.000 56.000 54.914 1.086 25155 12432 1 15 . 1 1 98 98 LEU CB C 98 38.600 38.600 39.203 -0.603 25155 12433 1 15 . 1 1 98 98 LEU H H 98 8.584 8.584 8.071 0.513 25155 12434 1 15 . 1 1 99 99 ASP N N 99 123.268 123.268 120.492 2.776 25155 12435 1 15 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.243 -0.278 25155 12436 1 15 . 1 1 99 99 ASP C C 99 178.876 178.876 176.841 2.035 25155 12437 1 15 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.384 1.876 25155 12438 1 15 . 1 1 99 99 ASP CB C 99 40.350 40.350 41.039 -0.689 25155 12439 1 15 . 1 1 100 100 ALA N N 100 119.124 119.124 121.328 -2.204 25155 12440 1 15 . 1 1 100 100 ALA HA H 100 3.822 3.822 3.973 -0.151 25155 12441 1 15 . 1 1 100 100 ALA C C 100 178.490 178.490 179.481 -0.991 25155 12442 1 15 . 1 1 100 100 ALA CA C 100 55.100 55.100 54.744 0.356 25155 12443 1 15 . 1 1 100 100 ALA CB C 100 19.700 19.700 17.852 1.847 25155 12444 1 15 . 1 1 100 100 ALA H H 100 8.400 8.400 7.450 0.950 25155 12445 1 15 . 1 1 101 101 LEU N N 101 118.687 118.687 120.256 -1.569 25155 12446 1 15 . 1 1 101 101 LEU HA H 101 3.674 3.674 3.893 -0.219 25155 12447 1 15 . 1 1 101 101 LEU C C 101 179.050 179.050 178.713 0.337 25155 12448 1 15 . 1 1 101 101 LEU CA C 101 57.800 57.800 57.022 0.778 25155 12449 1 15 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.522 1.128 25155 12450 1 15 . 1 1 101 101 LEU H H 101 6.518 6.518 7.128 -0.610 25155 12451 1 15 . 1 1 102 102 GLY N N 102 104.410 104.410 106.510 -2.100 25155 12452 1 15 . 1 1 102 102 GLY C C 102 176.056 176.056 176.056 0.000 25155 12453 1 15 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.224 0.526 25155 12454 1 15 . 1 1 102 102 GLY H H 102 7.712 7.712 8.330 -0.618 25155 12455 1 15 . 1 1 103 103 MET N N 103 120.550 120.550 121.325 -0.775 25155 12456 1 15 . 1 1 103 103 MET HA H 103 4.256 4.256 4.260 -0.004 25155 12457 1 15 . 1 1 103 103 MET C C 103 179.650 179.650 178.115 1.535 25155 12458 1 15 . 1 1 103 103 MET CA C 103 59.450 59.450 59.819 -0.369 25155 12459 1 15 . 1 1 103 103 MET CB C 103 32.300 32.300 32.859 -0.559 25155 12460 1 15 . 1 1 103 103 MET H H 103 8.485 8.485 8.357 0.128 25155 12461 1 15 . 1 1 104 104 LEU N N 104 123.480 123.480 120.331 3.149 25155 12462 1 15 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.226 -0.165 25155 12463 1 15 . 1 1 104 104 LEU C C 104 177.750 177.750 179.011 -1.261 25155 12464 1 15 . 1 1 104 104 LEU CA C 104 58.100 58.100 58.017 0.083 25155 12465 1 15 . 1 1 104 104 LEU CB C 104 41.450 41.450 40.930 0.520 25155 12466 1 15 . 1 1 104 104 LEU H H 104 8.392 8.392 8.147 0.245 25155 12467 1 15 . 1 1 105 105 HIS N N 105 119.570 119.570 120.508 -0.938 25155 12468 1 15 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.226 -0.374 25155 12469 1 15 . 1 1 105 105 HIS C C 105 177.550 177.550 177.436 0.114 25155 12470 1 15 . 1 1 105 105 HIS CA C 105 61.000 61.000 61.028 -0.028 25155 12471 1 15 . 1 1 105 105 HIS CB C 105 28.820 28.820 30.257 -1.437 25155 12472 1 15 . 1 1 105 105 HIS H H 105 8.247 8.247 8.828 -0.581 25155 12473 1 15 . 1 1 106 106 ASP N N 106 119.780 119.780 120.225 -0.445 25155 12474 1 15 . 1 1 106 106 ASP HA H 106 4.333 4.333 4.375 -0.042 25155 12475 1 15 . 1 1 106 106 ASP C C 106 179.410 179.410 178.164 1.246 25155 12476 1 15 . 1 1 106 106 ASP CA C 106 57.800 57.800 57.447 0.353 25155 12477 1 15 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.077 -0.477 25155 12478 1 15 . 1 1 107 107 LYS N N 107 121.660 121.660 119.910 1.750 25155 12479 1 15 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.063 0.037 25155 12480 1 15 . 1 1 107 107 LYS C C 107 178.316 178.316 179.265 -0.949 25155 12481 1 15 . 1 1 107 107 LYS CA C 107 58.750 58.750 59.213 -0.463 25155 12482 1 15 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.628 -0.778 25155 12483 1 15 . 1 1 108 108 LEU N N 108 116.050 116.050 118.851 -2.801 25155 12484 1 15 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.203 -0.193 25155 12485 1 15 . 1 1 108 108 LEU C C 108 179.050 179.050 178.330 0.720 25155 12486 1 15 . 1 1 108 108 LEU CA C 108 56.240 56.240 56.994 -0.754 25155 12487 1 15 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.170 -0.370 25155 12488 1 15 . 1 1 108 108 LEU H H 108 8.072 8.072 8.219 -0.147 25155 12489 1 15 . 1 1 109 109 SER N N 109 116.280 116.280 114.613 1.667 25155 12490 1 15 . 1 1 109 109 SER HA H 109 4.300 4.300 4.424 -0.124 25155 12491 1 15 . 1 1 109 109 SER C C 109 175.848 175.848 176.426 -0.578 25155 12492 1 15 . 1 1 109 109 SER CA C 109 62.410 62.410 61.997 0.413 25155 12493 1 15 . 1 1 109 109 SER CB C 109 62.850 62.850 63.067 -0.217 25155 12494 1 15 . 1 1 109 109 SER H H 109 8.366 8.366 8.489 -0.123 25155 12495 1 15 . 1 1 110 110 THR N N 110 110.416 110.416 112.580 -2.164 25155 12496 1 15 . 1 1 110 110 THR HA H 110 4.614 4.614 4.378 0.236 25155 12497 1 15 . 1 1 110 110 THR C C 110 175.675 175.675 175.341 0.334 25155 12498 1 15 . 1 1 110 110 THR CA C 110 62.030 62.030 64.086 -2.056 25155 12499 1 15 . 1 1 110 110 THR CB C 110 68.810 68.810 68.750 0.060 25155 12500 1 15 . 1 1 110 110 THR H H 110 7.185 7.185 7.745 -0.560 25155 12501 1 15 . 1 1 111 111 LYS N N 111 120.090 120.090 120.555 -0.465 25155 12502 1 15 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.410 0.103 25155 12503 1 15 . 1 1 111 111 LYS C C 111 176.814 176.814 176.707 0.107 25155 12504 1 15 . 1 1 111 111 LYS CA C 111 55.730 55.730 55.676 0.054 25155 12505 1 15 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.394 -1.464 25155 12506 1 15 . 1 1 112 112 GLY N N 112 107.540 107.540 108.227 -0.687 25155 12507 1 15 . 1 1 112 112 GLY C C 112 176.223 176.223 174.373 1.850 25155 12508 1 15 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.598 1.328 25155 12509 1 15 . 1 1 112 112 GLY H H 112 8.315 8.315 7.646 0.669 25155 12510 1 15 . 1 1 113 113 VAL N N 113 113.536 113.536 116.194 -2.658 25155 12511 1 15 . 1 1 113 113 VAL HA H 113 4.494 4.494 4.398 0.096 25155 12512 1 15 . 1 1 113 113 VAL C C 113 174.560 174.560 174.926 -0.366 25155 12513 1 15 . 1 1 113 113 VAL CA C 113 59.550 59.550 60.553 -1.003 25155 12514 1 15 . 1 1 113 113 VAL CB C 113 32.800 32.800 32.012 0.788 25155 12515 1 15 . 1 1 113 113 VAL H H 113 6.835 6.835 7.030 -0.195 25155 12516 1 15 . 1 1 114 114 LYS N N 114 122.920 122.920 122.191 0.729 25155 12517 1 15 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.414 0.080 25155 12518 1 15 . 1 1 114 114 LYS C C 114 174.925 174.925 174.764 0.161 25155 12519 1 15 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.126 0.154 25155 12520 1 15 . 1 1 114 114 LYS CB C 114 33.630 33.630 33.801 -0.171 25155 12521 1 15 . 1 1 115 115 PHE N N 115 123.140 123.140 124.850 -1.710 25155 12522 1 15 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.313 0.387 25155 12523 1 15 . 1 1 115 115 PHE C C 115 177.580 177.580 176.049 1.531 25155 12524 1 15 . 1 1 115 115 PHE CA C 115 58.677 58.677 57.226 1.451 25155 12525 1 15 . 1 1 115 115 PHE CB C 115 41.120 41.120 40.157 0.963 25155 12526 1 15 . 1 1 115 115 PHE H H 115 8.506 8.506 8.491 0.015 25155 12527 1 15 . 1 1 116 116 VAL N N 116 115.737 115.737 117.679 -1.942 25155 12528 1 15 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.857 -0.379 25155 12529 1 15 . 1 1 116 116 VAL C C 116 175.300 175.300 175.536 -0.236 25155 12530 1 15 . 1 1 116 116 VAL CA C 116 58.877 58.877 59.723 -0.846 25155 12531 1 15 . 1 1 116 116 VAL CB C 116 34.120 34.120 35.050 -0.930 25155 12532 1 15 . 1 1 116 116 VAL H H 116 8.860 8.860 8.923 -0.063 25155 12533 1 15 . 1 1 117 117 GLY N N 117 108.137 108.137 110.333 -2.196 25155 12534 1 15 . 1 1 117 117 GLY C C 117 176.110 176.110 174.988 1.122 25155 12535 1 15 . 1 1 117 117 GLY CA C 117 47.500 47.500 45.766 1.734 25155 12536 1 15 . 1 1 117 117 GLY H H 117 9.838 9.838 9.454 0.384 25155 12537 1 15 . 1 1 118 118 TYR N N 118 120.380 120.380 120.171 0.209 25155 12538 1 15 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.758 0.212 25155 12539 1 15 . 1 1 118 118 TYR C C 118 177.630 177.630 175.734 1.896 25155 12540 1 15 . 1 1 118 118 TYR CA C 118 55.800 55.800 57.694 -1.894 25155 12541 1 15 . 1 1 118 118 TYR CB C 118 35.970 35.970 38.988 -3.018 25155 12542 1 15 . 1 1 118 118 TYR H H 118 8.652 8.652 8.062 0.590 25155 12543 1 15 . 1 1 119 119 TRP N N 119 126.040 126.040 122.763 3.277 25155 12544 1 15 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.132 0.889 25155 12545 1 15 . 1 1 119 119 TRP C C 119 173.000 173.000 173.452 -0.452 25155 12546 1 15 . 1 1 119 119 TRP CA C 119 53.820 53.820 53.839 -0.019 25155 12547 1 15 . 1 1 119 119 TRP CB C 119 36.050 36.050 33.489 2.562 25155 12548 1 15 . 1 1 119 119 TRP H H 119 8.070 8.070 8.624 -0.554 25155 12549 1 15 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.409 0.375 25155 12550 1 15 . 1 1 120 120 PRO C C 120 176.870 176.870 176.329 0.541 25155 12551 1 15 . 1 1 120 120 PRO CA C 120 63.780 63.780 63.584 0.196 25155 12552 1 15 . 1 1 120 120 PRO CB C 120 31.990 31.990 31.962 0.028 25155 12553 1 15 . 1 1 121 121 THR N N 121 109.310 109.310 114.627 -5.317 25155 12554 1 15 . 1 1 121 121 THR HA H 121 4.073 4.073 3.944 0.129 25155 12555 1 15 . 1 1 121 121 THR C C 121 176.324 176.324 174.846 1.478 25155 12556 1 15 . 1 1 121 121 THR CA C 121 61.250 61.250 63.024 -1.774 25155 12557 1 15 . 1 1 121 121 THR CB C 121 69.730 69.730 69.039 0.691 25155 12558 1 15 . 1 1 121 121 THR H H 121 7.370 7.370 8.633 -1.263 25155 12559 1 15 . 1 1 122 122 GLU N N 122 123.937 123.937 122.515 1.422 25155 12560 1 15 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.121 0.103 25155 12561 1 15 . 1 1 122 122 GLU C C 122 177.737 177.737 177.937 -0.200 25155 12562 1 15 . 1 1 122 122 GLU CA C 122 58.200 58.200 58.255 -0.055 25155 12563 1 15 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.134 0.666 25155 12564 1 15 . 1 1 123 123 GLY N N 123 114.563 114.563 111.952 2.611 25155 12565 1 15 . 1 1 123 123 GLY C C 123 173.783 173.783 174.063 -0.280 25155 12566 1 15 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.402 -0.022 25155 12567 1 15 . 1 1 123 123 GLY H H 123 9.144 9.144 8.944 0.200 25155 12568 1 15 . 1 1 124 124 TYR N N 124 118.800 118.800 121.619 -2.819 25155 12569 1 15 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.625 0.593 25155 12570 1 15 . 1 1 124 124 TYR C C 124 175.673 175.673 175.090 0.583 25155 12571 1 15 . 1 1 124 124 TYR CA C 124 56.950 56.950 58.063 -1.113 25155 12572 1 15 . 1 1 124 124 TYR CB C 124 41.100 41.100 40.458 0.642 25155 12573 1 15 . 1 1 124 124 TYR H H 124 7.895 7.895 7.826 0.069 25155 12574 1 15 . 1 1 125 125 GLU N N 125 124.790 124.790 122.202 2.588 25155 12575 1 15 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.607 0.078 25155 12576 1 15 . 1 1 125 125 GLU C C 125 172.877 172.877 174.942 -2.065 25155 12577 1 15 . 1 1 125 125 GLU CA C 125 55.700 55.700 55.427 0.273 25155 12578 1 15 . 1 1 125 125 GLU CB C 125 31.340 31.340 31.068 0.272 25155 12579 1 15 . 1 1 126 126 PHE N N 126 118.670 118.670 119.210 -0.540 25155 12580 1 15 . 1 1 126 126 PHE HA H 126 4.841 4.841 4.672 0.169 25155 12581 1 15 . 1 1 126 126 PHE C C 126 173.800 173.800 173.131 0.669 25155 12582 1 15 . 1 1 126 126 PHE CA C 126 56.950 56.950 57.952 -1.002 25155 12583 1 15 . 1 1 126 126 PHE CB C 126 40.300 40.300 39.437 0.863 25155 12584 1 15 . 1 1 126 126 PHE H H 126 7.645 7.645 8.014 -0.369 25155 12585 1 15 . 1 1 127 127 THR N N 127 107.038 107.038 113.760 -6.722 25155 12586 1 15 . 1 1 127 127 THR HA H 127 4.370 4.370 4.100 0.270 25155 12587 1 15 . 1 1 127 127 THR C C 127 175.100 175.100 174.716 0.384 25155 12588 1 15 . 1 1 127 127 THR CA C 127 61.080 61.080 61.339 -0.259 25155 12589 1 15 . 1 1 127 127 THR CB C 127 70.500 70.500 69.588 0.912 25155 12590 1 15 . 1 1 127 127 THR H H 127 7.306 7.306 8.529 -1.223 25155 12591 1 15 . 1 1 128 128 SER N N 128 118.150 118.150 120.676 -2.526 25155 12592 1 15 . 1 1 128 128 SER HA H 128 4.650 4.650 4.617 0.033 25155 12593 1 15 . 1 1 128 128 SER C C 128 175.760 175.760 173.982 1.778 25155 12594 1 15 . 1 1 128 128 SER CA C 128 55.813 55.813 58.797 -2.984 25155 12595 1 15 . 1 1 128 128 SER CB C 128 65.300 65.300 63.628 1.672 25155 12596 1 15 . 1 1 128 128 SER H H 128 7.354 7.354 7.990 -0.636 25155 12597 1 15 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.517 0.247 25155 12598 1 15 . 1 1 129 129 PRO C C 129 178.860 178.860 178.635 0.225 25155 12599 1 15 . 1 1 129 129 PRO CA C 129 62.728 62.728 63.923 -1.195 25155 12600 1 15 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.569 -0.169 25155 12601 1 15 . 1 1 130 130 LYS N N 130 122.158 122.158 119.282 2.876 25155 12602 1 15 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.165 0.045 25155 12603 1 15 . 1 1 130 130 LYS C C 130 176.890 176.890 175.369 1.521 25155 12604 1 15 . 1 1 130 130 LYS CA C 130 61.375 61.375 60.540 0.835 25155 12605 1 15 . 1 1 130 130 LYS CB C 130 30.350 30.350 31.231 -0.881 25155 12606 1 15 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.375 0.158 25155 12607 1 15 . 1 1 131 131 PRO C C 131 173.810 173.810 175.493 -1.683 25155 12608 1 15 . 1 1 131 131 PRO CA C 131 64.510 64.510 63.191 1.319 25155 12609 1 15 . 1 1 131 131 PRO CB C 131 31.745 31.745 31.252 0.493 25155 12610 1 15 . 1 1 132 132 VAL N N 132 114.480 114.480 113.779 0.701 25155 12611 1 15 . 1 1 132 132 VAL HA H 132 5.158 5.158 4.816 0.342 25155 12612 1 15 . 1 1 132 132 VAL C C 132 175.137 175.137 174.936 0.201 25155 12613 1 15 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.206 0.594 25155 12614 1 15 . 1 1 132 132 VAL CB C 132 34.780 34.780 34.899 -0.119 25155 12615 1 15 . 1 1 132 132 VAL H H 132 6.716 6.716 7.532 -0.816 25155 12616 1 15 . 1 1 133 133 ILE N N 133 120.670 120.670 117.653 3.017 25155 12617 1 15 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.266 0.126 25155 12618 1 15 . 1 1 133 133 ILE C C 133 175.485 175.485 175.894 -0.409 25155 12619 1 15 . 1 1 133 133 ILE CA C 133 60.000 60.000 61.019 -1.019 25155 12620 1 15 . 1 1 133 133 ILE CB C 133 42.020 42.020 38.200 3.820 25155 12621 1 15 . 1 1 133 133 ILE H H 133 8.740 8.740 8.322 0.418 25155 12622 1 15 . 1 1 134 134 ALA N N 134 122.454 122.454 123.570 -1.116 25155 12623 1 15 . 1 1 134 134 ALA HA H 134 3.953 3.953 3.992 -0.039 25155 12624 1 15 . 1 1 134 134 ALA C C 134 178.387 178.387 177.658 0.729 25155 12625 1 15 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.452 -0.402 25155 12626 1 15 . 1 1 134 134 ALA CB C 134 16.982 16.982 18.082 -1.100 25155 12627 1 15 . 1 1 134 134 ALA H H 134 8.490 8.490 8.534 -0.044 25155 12628 1 15 . 1 1 135 135 ASP N N 135 117.310 117.310 122.949 -5.639 25155 12629 1 15 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.550 -0.306 25155 12630 1 15 . 1 1 135 135 ASP C C 135 176.390 176.390 176.487 -0.097 25155 12631 1 15 . 1 1 135 135 ASP CA C 135 55.120 55.120 52.995 2.125 25155 12632 1 15 . 1 1 135 135 ASP CB C 135 39.865 39.865 39.080 0.785 25155 12633 1 15 . 1 1 136 136 GLY N N 136 104.336 104.336 111.113 -6.777 25155 12634 1 15 . 1 1 136 136 GLY C C 136 174.940 174.940 175.825 -0.885 25155 12635 1 15 . 1 1 136 136 GLY CA C 136 45.150 45.150 46.048 -0.898 25155 12636 1 15 . 1 1 136 136 GLY H H 136 7.592 7.592 8.054 -0.462 25155 12637 1 15 . 1 1 137 137 GLN N N 137 118.675 118.675 117.581 1.094 25155 12638 1 15 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.192 -0.130 25155 12639 1 15 . 1 1 137 137 GLN C C 137 176.420 176.420 175.524 0.896 25155 12640 1 15 . 1 1 137 137 GLN CA C 137 57.760 57.760 57.050 0.710 25155 12641 1 15 . 1 1 137 137 GLN CB C 137 30.400 30.400 29.592 0.808 25155 12642 1 15 . 1 1 137 137 GLN H H 137 7.843 7.843 7.864 -0.021 25155 12643 1 15 . 1 1 138 138 LEU N N 138 118.160 118.160 117.494 0.666 25155 12644 1 15 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.360 0.601 25155 12645 1 15 . 1 1 138 138 LEU C C 138 175.700 175.700 173.985 1.715 25155 12646 1 15 . 1 1 138 138 LEU CA C 138 53.705 53.705 54.725 -1.020 25155 12647 1 15 . 1 1 138 138 LEU CB C 138 46.480 46.480 45.720 0.760 25155 12648 1 15 . 1 1 138 138 LEU H H 138 7.356 7.356 7.159 0.197 25155 12649 1 15 . 1 1 139 139 PHE N N 139 119.060 119.060 121.915 -2.855 25155 12650 1 15 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.690 0.654 25155 12651 1 15 . 1 1 139 139 PHE C C 139 178.850 178.850 177.499 1.351 25155 12652 1 15 . 1 1 139 139 PHE CA C 139 56.670 56.670 57.719 -1.049 25155 12653 1 15 . 1 1 139 139 PHE CB C 139 43.652 43.652 39.445 4.207 25155 12654 1 15 . 1 1 139 139 PHE H H 139 10.026 10.026 9.065 0.961 25155 12655 1 15 . 1 1 140 140 VAL N N 140 109.905 109.905 117.632 -7.727 25155 12656 1 15 . 1 1 140 140 VAL HA H 140 3.500 3.500 2.645 0.855 25155 12657 1 15 . 1 1 140 140 VAL C C 140 172.860 172.860 174.758 -1.898 25155 12658 1 15 . 1 1 140 140 VAL CA C 140 61.812 61.812 62.451 -0.639 25155 12659 1 15 . 1 1 140 140 VAL CB C 140 30.250 30.250 30.343 -0.094 25155 12660 1 15 . 1 1 140 140 VAL H H 140 7.550 7.550 8.374 -0.824 25155 12661 1 15 . 1 1 141 141 GLY N N 141 106.600 106.600 106.512 0.088 25155 12662 1 15 . 1 1 141 141 GLY C C 141 171.350 171.350 172.555 -1.205 25155 12663 1 15 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.322 1.138 25155 12664 1 15 . 1 1 141 141 GLY H H 141 7.052 7.052 7.205 -0.153 25155 12665 1 15 . 1 1 142 142 LEU N N 142 117.820 117.820 119.689 -1.869 25155 12666 1 15 . 1 1 142 142 LEU HA H 142 4.962 4.962 3.776 1.186 25155 12667 1 15 . 1 1 142 142 LEU CA C 142 55.600 55.600 54.176 1.424 25155 12668 1 15 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.395 -4.465 25155 12669 1 15 . 1 1 142 142 LEU H H 142 7.643 7.643 8.198 -0.555 25155 12670 1 15 . 1 1 143 143 ALA HA H 143 4.220 4.220 3.963 0.257 25155 12671 1 15 . 1 1 143 143 ALA C C 143 175.505 175.505 176.212 -0.707 25155 12672 1 15 . 1 1 143 143 ALA CA C 143 49.600 49.600 50.238 -0.638 25155 12673 1 15 . 1 1 143 143 ALA CB C 143 23.330 23.330 18.037 5.293 25155 12674 1 15 . 1 1 144 144 LEU N N 144 124.960 124.960 124.718 0.242 25155 12675 1 15 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.305 0.475 25155 12676 1 15 . 1 1 144 144 LEU C C 144 174.700 174.700 175.785 -1.085 25155 12677 1 15 . 1 1 144 144 LEU CA C 144 52.790 52.790 54.163 -1.373 25155 12678 1 15 . 1 1 144 144 LEU CB C 144 45.300 45.300 43.242 2.058 25155 12679 1 15 . 1 1 144 144 LEU H H 144 8.583 8.583 8.368 0.215 25155 12680 1 15 . 1 1 145 145 ASP N N 145 119.100 119.100 119.593 -0.493 25155 12681 1 15 . 1 1 145 145 ASP HA H 145 5.422 5.422 5.255 0.167 25155 12682 1 15 . 1 1 145 145 ASP C C 145 176.180 176.180 174.821 1.359 25155 12683 1 15 . 1 1 145 145 ASP CA C 145 53.600 53.600 52.649 0.951 25155 12684 1 15 . 1 1 145 145 ASP CB C 145 43.180 43.180 44.558 -1.378 25155 12685 1 15 . 1 1 147 147 THR HA H 147 4.093 4.093 4.411 -0.318 25155 12686 1 15 . 1 1 147 147 THR C C 147 175.858 175.858 174.771 1.087 25155 12687 1 15 . 1 1 147 147 THR CA C 147 66.400 66.400 62.148 4.252 25155 12688 1 15 . 1 1 147 147 THR CB C 147 69.400 69.400 70.336 -0.936 25155 12689 1 15 . 1 1 147 147 THR H H 147 8.745 8.745 8.397 0.348 25155 12690 1 15 . 1 1 148 148 ASN N N 148 115.408 115.408 119.076 -3.668 25155 12691 1 15 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.551 0.459 25155 12692 1 15 . 1 1 148 148 ASN C C 148 175.750 175.750 175.083 0.667 25155 12693 1 15 . 1 1 148 148 ASN CA C 148 53.400 53.400 55.166 -1.766 25155 12694 1 15 . 1 1 148 148 ASN CB C 148 41.900 41.900 39.292 2.608 25155 12695 1 15 . 1 1 148 148 ASN H H 148 8.975 8.975 8.483 0.492 25155 12696 1 15 . 1 1 149 149 GLN N N 149 117.900 117.900 116.496 1.404 25155 12697 1 15 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.608 0.328 25155 12698 1 15 . 1 1 149 149 GLN C C 149 178.280 178.280 174.548 3.732 25155 12699 1 15 . 1 1 149 149 GLN CA C 149 53.730 53.730 54.163 -0.433 25155 12700 1 15 . 1 1 149 149 GLN CB C 149 29.790 29.790 30.740 -0.950 25155 12701 1 15 . 1 1 149 149 GLN H H 149 7.430 7.430 8.493 -1.063 25155 12702 1 15 . 1 1 150 150 TYR N N 150 121.060 121.060 117.081 3.979 25155 12703 1 15 . 1 1 150 150 TYR HA H 150 4.671 4.671 4.910 -0.239 25155 12704 1 15 . 1 1 150 150 TYR C C 150 178.680 178.680 177.106 1.574 25155 12705 1 15 . 1 1 150 150 TYR CA C 150 57.930 57.930 58.782 -0.852 25155 12706 1 15 . 1 1 150 150 TYR CB C 150 38.860 38.860 39.846 -0.986 25155 12707 1 15 . 1 1 150 150 TYR H H 150 8.115 8.115 8.458 -0.343 25155 12708 1 15 . 1 1 151 151 ASP N N 151 121.175 121.175 120.418 0.757 25155 12709 1 15 . 1 1 151 151 ASP CA C 151 57.000 57.000 55.964 1.036 25155 12710 1 15 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.858 1.141 25155 12711 1 15 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.352 0.238 25155 12712 1 15 . 1 1 152 152 LEU C C 152 178.300 178.300 177.913 0.387 25155 12713 1 15 . 1 1 152 152 LEU CA C 152 54.788 54.788 55.446 -0.658 25155 12714 1 15 . 1 1 152 152 LEU CB C 152 42.200 42.200 41.828 0.372 25155 12715 1 15 . 1 1 153 153 SER N N 153 116.170 116.170 116.295 -0.125 25155 12716 1 15 . 1 1 153 153 SER HA H 153 3.911 3.911 4.052 -0.141 25155 12717 1 15 . 1 1 153 153 SER CA C 153 63.400 63.400 61.893 1.507 25155 12718 1 15 . 1 1 153 153 SER CB C 153 63.200 63.200 63.054 0.146 25155 12719 1 15 . 1 1 153 153 SER H H 153 7.378 7.378 7.990 -0.612 25155 12720 1 15 . 1 1 154 154 ASP N N 154 121.640 121.640 120.978 0.662 25155 12721 1 15 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.379 -0.139 25155 12722 1 15 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.212 2.088 25155 12723 1 15 . 1 1 154 154 ASP CB C 154 40.000 40.000 41.061 -1.061 25155 12724 1 15 . 1 1 155 155 GLU HA H 155 4.170 4.170 3.984 0.186 25155 12725 1 15 . 1 1 155 155 GLU C C 155 179.420 179.420 178.911 0.509 25155 12726 1 15 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.355 -0.155 25155 12727 1 15 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.676 -0.196 25155 12728 1 15 . 1 1 156 156 ARG N N 156 121.230 121.230 118.822 2.408 25155 12729 1 15 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.206 0.070 25155 12730 1 15 . 1 1 156 156 ARG C C 156 177.350 177.350 179.263 -1.913 25155 12731 1 15 . 1 1 156 156 ARG CA C 156 59.950 59.950 58.979 0.971 25155 12732 1 15 . 1 1 156 156 ARG CB C 156 31.100 31.100 29.793 1.307 25155 12733 1 15 . 1 1 157 157 ILE N N 157 118.190 118.190 119.938 -1.748 25155 12734 1 15 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.618 -0.188 25155 12735 1 15 . 1 1 157 157 ILE C C 157 178.480 178.480 177.784 0.696 25155 12736 1 15 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.242 1.318 25155 12737 1 15 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.822 0.658 25155 12738 1 15 . 1 1 157 157 ILE H H 157 8.705 8.705 7.331 1.374 25155 12739 1 15 . 1 1 158 158 GLN N N 158 119.975 119.975 120.666 -0.691 25155 12740 1 15 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.887 0.069 25155 12741 1 15 . 1 1 158 158 GLN C C 158 178.730 178.730 178.284 0.446 25155 12742 1 15 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.324 1.376 25155 12743 1 15 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.316 0.166 25155 12744 1 15 . 1 1 158 158 GLN H H 158 8.262 8.262 8.537 -0.275 25155 12745 1 15 . 1 1 159 159 SER N N 159 115.466 115.466 115.170 0.296 25155 12746 1 15 . 1 1 159 159 SER HA H 159 4.446 4.446 4.329 0.117 25155 12747 1 15 . 1 1 159 159 SER C C 159 177.320 177.320 176.859 0.461 25155 12748 1 15 . 1 1 159 159 SER CA C 159 63.500 63.500 61.120 2.380 25155 12749 1 15 . 1 1 159 159 SER CB C 159 63.818 63.818 63.277 0.541 25155 12750 1 15 . 1 1 159 159 SER H H 159 8.440 8.440 8.254 0.186 25155 12751 1 15 . 1 1 160 160 TRP N N 160 126.784 126.784 125.226 1.558 25155 12752 1 15 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.566 -0.112 25155 12753 1 15 . 1 1 160 160 TRP C C 160 177.934 177.934 177.590 0.344 25155 12754 1 15 . 1 1 160 160 TRP CA C 160 62.745 62.745 62.111 0.634 25155 12755 1 15 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.108 0.242 25155 12756 1 15 . 1 1 160 160 TRP H H 160 9.243 9.243 7.722 1.521 25155 12757 1 15 . 1 1 161 161 CYS N N 161 116.395 116.395 118.652 -2.257 25155 12758 1 15 . 1 1 161 161 CYS HA H 161 3.886 3.886 3.599 0.287 25155 12759 1 15 . 1 1 161 161 CYS C C 161 176.245 176.245 177.004 -0.759 25155 12760 1 15 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.698 0.602 25155 12761 1 15 . 1 1 161 161 CYS CB C 161 27.723 27.723 27.000 0.723 25155 12762 1 15 . 1 1 161 161 CYS H H 161 8.845 8.845 9.026 -0.181 25155 12763 1 15 . 1 1 162 162 GLU N N 162 118.030 118.030 119.377 -1.347 25155 12764 1 15 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.870 0.050 25155 12765 1 15 . 1 1 162 162 GLU C C 162 178.700 178.700 178.796 -0.096 25155 12766 1 15 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.513 0.287 25155 12767 1 15 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.248 0.252 25155 12768 1 15 . 1 1 163 163 GLN N N 163 120.650 120.650 119.658 0.992 25155 12769 1 15 . 1 1 163 163 GLN HA H 163 4.173 4.173 4.080 0.093 25155 12770 1 15 . 1 1 163 163 GLN C C 163 179.700 179.700 178.503 1.197 25155 12771 1 15 . 1 1 163 163 GLN CA C 163 59.688 59.688 58.982 0.706 25155 12772 1 15 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.876 0.024 25155 12773 1 15 . 1 1 163 163 GLN H H 163 8.148 8.148 7.704 0.444 25155 12774 1 15 . 1 1 164 164 ILE N N 164 114.836 114.836 117.483 -2.647 25155 12775 1 15 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.649 0.411 25155 12776 1 15 . 1 1 164 164 ILE C C 164 178.676 178.676 177.687 0.989 25155 12777 1 15 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.394 1.766 25155 12778 1 15 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.319 0.312 25155 12779 1 15 . 1 1 164 164 ILE H H 164 8.958 8.958 8.297 0.661 25155 12780 1 15 . 1 1 165 165 LEU N N 165 123.700 123.700 119.929 3.771 25155 12781 1 15 . 1 1 165 165 LEU HA H 165 4.100 4.100 4.013 0.087 25155 12782 1 15 . 1 1 165 165 LEU C C 165 180.548 180.548 178.425 2.123 25155 12783 1 15 . 1 1 165 165 LEU CA C 165 58.150 58.150 58.251 -0.101 25155 12784 1 15 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.426 -0.296 25155 12785 1 15 . 1 1 165 165 LEU H H 165 7.830 7.830 7.950 -0.120 25155 12786 1 15 . 1 1 166 166 ASN N N 166 120.160 120.160 118.323 1.837 25155 12787 1 15 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.365 0.205 25155 12788 1 15 . 1 1 166 166 ASN C C 166 175.690 175.690 177.396 -1.706 25155 12789 1 15 . 1 1 166 166 ASN CA C 166 55.946 55.946 56.994 -1.048 25155 12790 1 15 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.367 0.113 25155 12791 1 15 . 1 1 166 166 ASN H H 166 7.706 7.706 7.767 -0.061 25155 12792 1 15 . 1 1 167 167 GLU N N 167 121.286 121.286 120.881 0.405 25155 12793 1 15 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.108 -0.004 25155 12794 1 15 . 1 1 167 167 GLU C C 167 180.520 180.520 179.250 1.270 25155 12795 1 15 . 1 1 167 167 GLU CA C 167 59.920 59.920 59.329 0.591 25155 12796 1 15 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.703 1.222 25155 12797 1 15 . 1 1 168 168 MET N N 168 118.622 118.622 115.827 2.795 25155 12798 1 15 . 1 1 168 168 MET HA H 168 3.996 3.996 4.354 -0.358 25155 12799 1 15 . 1 1 168 168 MET C C 168 176.856 176.856 177.440 -0.584 25155 12800 1 15 . 1 1 168 168 MET CA C 168 59.500 59.500 58.208 1.292 25155 12801 1 15 . 1 1 168 168 MET CB C 168 33.700 33.700 32.845 0.855 25155 12802 1 15 . 1 1 168 168 MET H H 168 8.723 8.723 8.338 0.385 25155 12803 1 15 . 1 1 169 169 ALA N N 169 121.760 121.760 122.479 -0.719 25155 12804 1 15 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.347 -0.191 25155 12805 1 15 . 1 1 169 169 ALA C C 169 179.790 179.790 180.091 -0.301 25155 12806 1 15 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.130 0.670 25155 12807 1 15 . 1 1 169 169 ALA CB C 169 18.220 18.220 19.254 -1.034 25155 12808 1 15 . 1 1 169 169 ALA H H 169 7.494 7.494 7.564 -0.070 25155 12809 1 15 . 1 1 170 170 GLU N N 170 116.970 116.970 119.269 -2.299 25155 12810 1 15 . 1 1 170 170 GLU HA H 170 4.091 4.091 4.080 0.011 25155 12811 1 15 . 1 1 170 170 GLU C C 170 177.745 177.745 178.887 -1.142 25155 12812 1 15 . 1 1 170 170 GLU CA C 170 58.000 58.000 58.855 -0.855 25155 12813 1 15 . 1 1 170 170 GLU CB C 170 29.730 29.730 28.911 0.819 25155 12814 1 15 . 1 1 171 171 HIS N N 171 118.150 118.150 119.708 -1.558 25155 12815 1 15 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.248 0.222 25155 12816 1 15 . 1 1 171 171 HIS C C 171 175.848 175.848 176.063 -0.215 25155 12817 1 15 . 1 1 171 171 HIS CA C 171 57.600 57.600 58.575 -0.975 25155 12818 1 15 . 1 1 171 171 HIS CB C 171 30.800 30.800 29.631 1.169 25155 12819 1 15 . 1 1 171 171 HIS H H 171 7.717 7.717 7.760 -0.043 25155 12820 1 15 . 1 1 172 172 TYR N N 172 119.483 119.483 117.549 1.934 25155 12821 1 15 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.534 0.057 25155 12822 1 15 . 1 1 172 172 TYR C C 172 174.590 174.590 175.496 -0.906 25155 12823 1 15 . 1 1 172 172 TYR CA C 172 57.813 57.813 57.009 0.804 25155 12824 1 15 . 1 1 172 172 TYR CB C 172 38.900 38.900 37.974 0.926 25155 12825 1 15 . 1 1 172 172 TYR H H 172 7.778 7.778 7.819 -0.041 25155 12826 1 16 . 1 1 2 2 ASN N N 2 122.966 122.966 121.490 1.476 25155 12827 1 16 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.152 0.023 25155 12828 1 16 . 1 1 2 2 ASN C C 2 175.200 175.200 173.700 1.500 25155 12829 1 16 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.843 0.077 25155 12830 1 16 . 1 1 2 2 ASN CB C 2 40.000 40.000 41.543 -1.543 25155 12831 1 16 . 1 1 2 2 ASN H H 2 9.392 9.392 8.361 1.031 25155 12832 1 16 . 1 1 3 3 MET N N 3 120.660 120.660 120.981 -0.321 25155 12833 1 16 . 1 1 3 3 MET HA H 3 5.565 5.565 5.140 0.425 25155 12834 1 16 . 1 1 3 3 MET C C 3 174.200 174.200 175.501 -1.301 25155 12835 1 16 . 1 1 3 3 MET CA C 3 54.550 54.550 54.156 0.394 25155 12836 1 16 . 1 1 3 3 MET CB C 3 34.100 34.100 34.775 -0.675 25155 12837 1 16 . 1 1 3 3 MET H H 3 8.745 8.745 8.797 -0.052 25155 12838 1 16 . 1 1 4 4 GLY N N 4 115.792 115.792 110.353 5.439 25155 12839 1 16 . 1 1 4 4 GLY C C 4 170.444 170.444 172.106 -1.662 25155 12840 1 16 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.469 -0.582 25155 12841 1 16 . 1 1 4 4 GLY H H 4 8.989 8.989 8.992 -0.003 25155 12842 1 16 . 1 1 5 5 LEU N N 5 131.175 131.175 124.614 6.561 25155 12843 1 16 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.327 0.995 25155 12844 1 16 . 1 1 5 5 LEU C C 5 175.700 175.700 174.743 0.957 25155 12845 1 16 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.757 -0.437 25155 12846 1 16 . 1 1 5 5 LEU CB C 5 44.700 44.700 43.828 0.872 25155 12847 1 16 . 1 1 5 5 LEU H H 5 8.917 8.917 8.083 0.834 25155 12848 1 16 . 1 1 6 6 PHE N N 6 125.990 125.990 124.835 1.155 25155 12849 1 16 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.563 0.175 25155 12850 1 16 . 1 1 6 6 PHE C C 6 174.358 174.358 173.409 0.949 25155 12851 1 16 . 1 1 6 6 PHE CA C 6 55.480 55.480 54.825 0.655 25155 12852 1 16 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.627 -0.577 25155 12853 1 16 . 1 1 6 6 PHE H H 6 9.225 9.225 9.336 -0.111 25155 12854 1 16 . 1 1 7 7 TYR N N 7 118.040 118.040 117.437 0.603 25155 12855 1 16 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.540 0.389 25155 12856 1 16 . 1 1 7 7 TYR C C 7 171.690 171.690 174.158 -2.468 25155 12857 1 16 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.406 -0.946 25155 12858 1 16 . 1 1 7 7 TYR CB C 7 40.800 40.800 40.728 0.072 25155 12859 1 16 . 1 1 7 7 TYR H H 7 8.235 8.235 8.073 0.162 25155 12860 1 16 . 1 1 8 8 GLY N N 8 106.640 106.640 107.501 -0.861 25155 12861 1 16 . 1 1 8 8 GLY C C 8 171.682 171.682 173.509 -1.827 25155 12862 1 16 . 1 1 8 8 GLY CA C 8 44.050 44.050 43.950 0.100 25155 12863 1 16 . 1 1 8 8 GLY H H 8 6.996 6.996 8.738 -1.742 25155 12864 1 16 . 1 1 9 9 SER N N 9 118.164 118.164 117.421 0.743 25155 12865 1 16 . 1 1 9 9 SER C C 9 174.560 174.560 173.732 0.828 25155 12866 1 16 . 1 1 9 9 SER CA C 9 57.140 57.140 58.673 -1.533 25155 12867 1 16 . 1 1 9 9 SER H H 9 9.680 9.680 9.149 0.531 25155 12868 1 16 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.752 -0.122 25155 12869 1 16 . 1 1 17 17 ALA C C 17 177.740 177.740 178.664 -0.924 25155 12870 1 16 . 1 1 17 17 ALA CA C 17 54.900 54.900 55.080 -0.180 25155 12871 1 16 . 1 1 17 17 ALA CB C 17 17.790 17.790 17.880 -0.090 25155 12872 1 16 . 1 1 17 17 ALA H H 17 8.055 8.055 7.363 0.692 25155 12873 1 16 . 1 1 18 18 ALA N N 18 120.026 120.026 121.145 -1.119 25155 12874 1 16 . 1 1 18 18 ALA HA H 18 3.713 3.713 3.921 -0.208 25155 12875 1 16 . 1 1 18 18 ALA C C 18 179.040 179.040 179.615 -0.575 25155 12876 1 16 . 1 1 18 18 ALA CA C 18 54.860 54.860 55.089 -0.229 25155 12877 1 16 . 1 1 18 18 ALA CB C 18 18.200 18.200 18.119 0.081 25155 12878 1 16 . 1 1 18 18 ALA H H 18 7.015 7.015 8.095 -1.080 25155 12879 1 16 . 1 1 19 19 GLU N N 19 116.656 116.656 118.539 -1.883 25155 12880 1 16 . 1 1 19 19 GLU HA H 19 3.580 3.580 3.927 -0.347 25155 12881 1 16 . 1 1 19 19 GLU C C 19 178.487 178.487 179.480 -0.993 25155 12882 1 16 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.735 -0.065 25155 12883 1 16 . 1 1 19 19 GLU CB C 19 29.400 29.400 29.474 -0.074 25155 12884 1 16 . 1 1 20 20 LYS N N 20 120.100 120.100 120.225 -0.125 25155 12885 1 16 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.022 0.324 25155 12886 1 16 . 1 1 20 20 LYS C C 20 175.330 175.330 179.003 -3.673 25155 12887 1 16 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.466 -2.366 25155 12888 1 16 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.475 0.525 25155 12889 1 16 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.711 -0.246 25155 12890 1 16 . 1 1 21 21 ILE C C 21 177.680 177.680 178.131 -0.451 25155 12891 1 16 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.445 0.195 25155 12892 1 16 . 1 1 21 21 ILE CB C 21 38.030 38.030 37.999 0.031 25155 12893 1 16 . 1 1 21 21 ILE H H 21 8.220 8.220 8.513 -0.293 25155 12894 1 16 . 1 1 22 22 ARG N N 22 119.433 119.433 118.459 0.974 25155 12895 1 16 . 1 1 22 22 ARG HA H 22 3.550 3.550 4.025 -0.475 25155 12896 1 16 . 1 1 22 22 ARG C C 22 177.268 177.268 178.265 -0.997 25155 12897 1 16 . 1 1 22 22 ARG CA C 22 59.760 59.760 58.693 1.067 25155 12898 1 16 . 1 1 22 22 ARG CB C 22 28.900 28.900 29.029 -0.129 25155 12899 1 16 . 1 1 23 23 ASP N N 23 118.945 118.945 119.972 -1.027 25155 12900 1 16 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.424 -0.082 25155 12901 1 16 . 1 1 23 23 ASP C C 23 178.470 178.470 178.563 -0.093 25155 12902 1 16 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.160 0.291 25155 12903 1 16 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.916 -0.546 25155 12904 1 16 . 1 1 24 24 ILE N N 24 121.200 121.200 119.139 2.061 25155 12905 1 16 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.819 -0.085 25155 12906 1 16 . 1 1 24 24 ILE C C 24 178.297 178.297 177.900 0.397 25155 12907 1 16 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.473 0.027 25155 12908 1 16 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.550 0.190 25155 12909 1 16 . 1 1 24 24 ILE H H 24 8.160 8.160 7.982 0.178 25155 12910 1 16 . 1 1 25 25 ILE N N 25 121.166 121.166 117.706 3.460 25155 12911 1 16 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.821 -0.178 25155 12912 1 16 . 1 1 25 25 ILE C C 25 176.825 176.825 176.702 0.123 25155 12913 1 16 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.261 2.628 25155 12914 1 16 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.716 -0.966 25155 12915 1 16 . 1 1 25 25 ILE H H 25 8.480 8.480 8.017 0.463 25155 12916 1 16 . 1 1 26 26 GLY N N 26 109.050 109.050 104.729 4.321 25155 12917 1 16 . 1 1 26 26 GLY C C 26 173.800 173.800 172.568 1.232 25155 12918 1 16 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.477 -0.077 25155 12919 1 16 . 1 1 26 26 GLY H H 26 7.945 7.945 7.682 0.263 25155 12920 1 16 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.411 -0.048 25155 12921 1 16 . 1 1 27 27 PRO C C 27 177.157 177.157 176.794 0.363 25155 12922 1 16 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.937 0.593 25155 12923 1 16 . 1 1 27 27 PRO CB C 27 32.000 32.000 32.082 -0.082 25155 12924 1 16 . 1 1 28 28 GLU N N 28 116.510 116.510 116.751 -0.241 25155 12925 1 16 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.204 0.056 25155 12926 1 16 . 1 1 28 28 GLU C C 28 177.000 177.000 177.002 -0.002 25155 12927 1 16 . 1 1 28 28 GLU CA C 28 57.680 57.680 57.860 -0.180 25155 12928 1 16 . 1 1 28 28 GLU CB C 28 28.620 28.620 29.206 -0.586 25155 12929 1 16 . 1 1 29 29 LEU N N 29 120.334 120.334 113.671 6.663 25155 12930 1 16 . 1 1 29 29 LEU HA H 29 4.650 4.650 4.960 -0.310 25155 12931 1 16 . 1 1 29 29 LEU C C 29 175.676 175.676 174.948 0.728 25155 12932 1 16 . 1 1 29 29 LEU CA C 29 55.924 55.924 54.836 1.088 25155 12933 1 16 . 1 1 29 29 LEU CB C 29 44.880 44.880 44.359 0.521 25155 12934 1 16 . 1 1 29 29 LEU H H 29 7.924 7.924 7.487 0.437 25155 12935 1 16 . 1 1 30 30 VAL N N 30 118.900 118.900 119.873 -0.973 25155 12936 1 16 . 1 1 30 30 VAL HA H 30 4.639 4.639 4.972 -0.333 25155 12937 1 16 . 1 1 30 30 VAL C C 30 174.368 174.368 175.495 -1.127 25155 12938 1 16 . 1 1 30 30 VAL CA C 30 61.110 61.110 60.237 0.873 25155 12939 1 16 . 1 1 30 30 VAL CB C 30 34.500 34.500 35.072 -0.572 25155 12940 1 16 . 1 1 30 30 VAL H H 30 7.486 7.486 7.324 0.162 25155 12941 1 16 . 1 1 31 31 THR N N 31 124.000 124.000 120.004 3.996 25155 12942 1 16 . 1 1 31 31 THR HA H 31 4.331 4.331 4.645 -0.314 25155 12943 1 16 . 1 1 31 31 THR C C 31 172.670 172.670 173.153 -0.483 25155 12944 1 16 . 1 1 31 31 THR CA C 31 61.784 61.784 60.883 0.901 25155 12945 1 16 . 1 1 31 31 THR CB C 31 70.483 70.483 71.168 -0.685 25155 12946 1 16 . 1 1 31 31 THR H H 31 7.947 7.947 8.855 -0.908 25155 12947 1 16 . 1 1 32 32 LEU N N 32 127.408 127.408 126.058 1.350 25155 12948 1 16 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.416 0.221 25155 12949 1 16 . 1 1 32 32 LEU C C 32 176.425 176.425 176.420 0.005 25155 12950 1 16 . 1 1 32 32 LEU CA C 32 54.760 54.760 55.034 -0.274 25155 12951 1 16 . 1 1 32 32 LEU CB C 32 43.809 43.809 43.095 0.714 25155 12952 1 16 . 1 1 32 32 LEU H H 32 8.614 8.614 8.670 -0.056 25155 12953 1 16 . 1 1 33 33 HIS N N 33 120.230 120.230 122.478 -2.248 25155 12954 1 16 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.709 -0.289 25155 12955 1 16 . 1 1 33 33 HIS C C 33 171.914 171.914 174.019 -2.105 25155 12956 1 16 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.315 0.985 25155 12957 1 16 . 1 1 33 33 HIS CB C 33 32.050 32.050 31.479 0.571 25155 12958 1 16 . 1 1 33 33 HIS H H 33 9.130 9.130 8.812 0.318 25155 12959 1 16 . 1 1 34 34 ASN N N 34 123.987 123.987 120.464 3.523 25155 12960 1 16 . 1 1 34 34 ASN HA H 34 3.600 3.600 3.816 -0.216 25155 12961 1 16 . 1 1 34 34 ASN C C 34 177.930 177.930 175.588 2.342 25155 12962 1 16 . 1 1 34 34 ASN CA C 34 51.730 51.730 52.871 -1.141 25155 12963 1 16 . 1 1 34 34 ASN CB C 34 38.747 38.747 38.152 0.595 25155 12964 1 16 . 1 1 34 34 ASN H H 34 8.759 8.759 8.438 0.321 25155 12965 1 16 . 1 1 35 35 LEU N N 35 128.751 128.751 126.127 2.624 25155 12966 1 16 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.099 0.191 25155 12967 1 16 . 1 1 35 35 LEU C C 35 177.363 177.363 178.279 -0.916 25155 12968 1 16 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.801 -0.251 25155 12969 1 16 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.980 0.782 25155 12970 1 16 . 1 1 35 35 LEU H H 35 8.758 8.758 8.402 0.356 25155 12971 1 16 . 1 1 36 36 LYS N N 36 120.870 120.870 118.403 2.467 25155 12972 1 16 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.087 -0.154 25155 12973 1 16 . 1 1 36 36 LYS C C 36 176.540 176.540 177.198 -0.658 25155 12974 1 16 . 1 1 36 36 LYS CA C 36 59.260 59.260 58.054 1.206 25155 12975 1 16 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.059 0.741 25155 12976 1 16 . 1 1 37 37 ASP N N 37 115.288 115.288 116.286 -0.998 25155 12977 1 16 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.639 0.108 25155 12978 1 16 . 1 1 37 37 ASP C C 37 175.500 175.500 176.123 -0.623 25155 12979 1 16 . 1 1 37 37 ASP CA C 37 54.805 54.805 55.103 -0.298 25155 12980 1 16 . 1 1 37 37 ASP CB C 37 44.650 44.650 42.539 2.111 25155 12981 1 16 . 1 1 38 38 ASP N N 38 121.550 121.550 118.010 3.540 25155 12982 1 16 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.903 -0.038 25155 12983 1 16 . 1 1 38 38 ASP C C 38 174.895 174.895 174.744 0.151 25155 12984 1 16 . 1 1 38 38 ASP CA C 38 52.840 52.840 53.147 -0.307 25155 12985 1 16 . 1 1 38 38 ASP CB C 38 42.240 42.240 44.183 -1.943 25155 12986 1 16 . 1 1 39 39 SER N N 39 115.170 115.170 117.534 -2.364 25155 12987 1 16 . 1 1 39 39 SER HA H 39 4.600 4.600 4.746 -0.146 25155 12988 1 16 . 1 1 39 39 SER C C 39 174.930 174.930 174.325 0.605 25155 12989 1 16 . 1 1 39 39 SER CA C 39 54.786 54.786 57.173 -2.388 25155 12990 1 16 . 1 1 39 39 SER CB C 39 64.840 64.840 63.259 1.581 25155 12991 1 16 . 1 1 39 39 SER H H 39 8.330 8.330 8.683 -0.353 25155 12992 1 16 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.438 -0.438 25155 12993 1 16 . 1 1 40 40 PRO C C 40 176.620 176.620 178.303 -1.683 25155 12994 1 16 . 1 1 40 40 PRO CA C 40 63.870 63.870 64.911 -1.041 25155 12995 1 16 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.904 -0.544 25155 12996 1 16 . 1 1 41 41 LYS N N 41 120.913 120.913 118.255 2.658 25155 12997 1 16 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.084 -0.188 25155 12998 1 16 . 1 1 41 41 LYS C C 41 179.580 179.580 178.580 1.000 25155 12999 1 16 . 1 1 41 41 LYS CA C 41 58.000 58.000 58.896 -0.896 25155 13000 1 16 . 1 1 41 41 LYS CB C 41 32.100 32.100 30.989 1.111 25155 13001 1 16 . 1 1 42 42 LEU N N 42 118.206 118.206 120.188 -1.982 25155 13002 1 16 . 1 1 42 42 LEU HA H 42 4.025 4.025 3.759 0.266 25155 13003 1 16 . 1 1 42 42 LEU C C 42 178.630 178.630 177.975 0.655 25155 13004 1 16 . 1 1 42 42 LEU CA C 42 57.030 57.030 57.241 -0.211 25155 13005 1 16 . 1 1 42 42 LEU CB C 42 41.820 41.820 40.834 0.986 25155 13006 1 16 . 1 1 42 42 LEU H H 42 7.598 7.598 7.517 0.081 25155 13007 1 16 . 1 1 43 43 MET N N 43 118.913 118.913 116.202 2.711 25155 13008 1 16 . 1 1 43 43 MET HA H 43 3.760 3.760 4.011 -0.251 25155 13009 1 16 . 1 1 43 43 MET C C 43 177.710 177.710 177.156 0.554 25155 13010 1 16 . 1 1 43 43 MET CA C 43 59.864 59.864 58.153 1.711 25155 13011 1 16 . 1 1 43 43 MET CB C 43 32.680 32.680 32.029 0.651 25155 13012 1 16 . 1 1 43 43 MET H H 43 8.180 8.180 8.024 0.156 25155 13013 1 16 . 1 1 44 44 GLU N N 44 110.906 110.906 117.053 -6.147 25155 13014 1 16 . 1 1 44 44 GLU HA H 44 3.732 3.732 3.984 -0.252 25155 13015 1 16 . 1 1 44 44 GLU C C 44 178.120 178.120 179.509 -1.389 25155 13016 1 16 . 1 1 44 44 GLU CA C 44 59.450 59.450 58.744 0.706 25155 13017 1 16 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.493 0.307 25155 13018 1 16 . 1 1 45 45 GLN N N 45 115.770 115.770 118.411 -2.641 25155 13019 1 16 . 1 1 45 45 GLN HA H 45 4.190 4.190 3.978 0.212 25155 13020 1 16 . 1 1 45 45 GLN C C 45 175.480 175.480 176.992 -1.512 25155 13021 1 16 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.583 -1.483 25155 13022 1 16 . 1 1 45 45 GLN CB C 45 28.490 28.490 28.931 -0.441 25155 13023 1 16 . 1 1 45 45 GLN H H 45 7.517 7.517 7.163 0.354 25155 13024 1 16 . 1 1 46 46 TYR N N 46 117.840 117.840 118.495 -0.655 25155 13025 1 16 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.379 0.281 25155 13026 1 16 . 1 1 46 46 TYR C C 46 175.480 175.480 176.359 -0.879 25155 13027 1 16 . 1 1 46 46 TYR CA C 46 58.827 58.827 57.786 1.041 25155 13028 1 16 . 1 1 46 46 TYR CB C 46 41.720 41.720 37.951 3.769 25155 13029 1 16 . 1 1 46 46 TYR H H 46 6.955 6.955 7.012 -0.057 25155 13030 1 16 . 1 1 47 47 ASP N N 47 121.540 121.540 123.410 -1.870 25155 13031 1 16 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.668 0.028 25155 13032 1 16 . 1 1 47 47 ASP C C 47 175.677 175.677 175.601 0.076 25155 13033 1 16 . 1 1 47 47 ASP CA C 47 56.812 56.812 56.532 0.280 25155 13034 1 16 . 1 1 47 47 ASP CB C 47 42.978 42.978 41.695 1.283 25155 13035 1 16 . 1 1 48 48 VAL N N 48 118.666 118.666 116.945 1.721 25155 13036 1 16 . 1 1 48 48 VAL HA H 48 5.057 5.057 5.051 0.006 25155 13037 1 16 . 1 1 48 48 VAL C C 48 174.180 174.180 174.303 -0.123 25155 13038 1 16 . 1 1 48 48 VAL CA C 48 60.000 60.000 60.295 -0.295 25155 13039 1 16 . 1 1 48 48 VAL CB C 48 36.200 36.200 33.885 2.315 25155 13040 1 16 . 1 1 48 48 VAL H H 48 7.631 7.631 8.041 -0.410 25155 13041 1 16 . 1 1 49 49 LEU N N 49 128.300 128.300 128.068 0.232 25155 13042 1 16 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.104 0.496 25155 13043 1 16 . 1 1 49 49 LEU C C 49 174.810 174.810 174.897 -0.087 25155 13044 1 16 . 1 1 49 49 LEU CA C 49 52.230 52.230 54.191 -1.961 25155 13045 1 16 . 1 1 49 49 LEU CB C 49 45.400 45.400 45.574 -0.174 25155 13046 1 16 . 1 1 49 49 LEU H H 49 9.469 9.469 8.952 0.517 25155 13047 1 16 . 1 1 50 50 ILE N N 50 124.400 124.400 127.493 -3.093 25155 13048 1 16 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.621 1.029 25155 13049 1 16 . 1 1 50 50 ILE C C 50 175.286 175.286 174.338 0.948 25155 13050 1 16 . 1 1 50 50 ILE CA C 50 59.900 59.900 61.212 -1.312 25155 13051 1 16 . 1 1 50 50 ILE CB C 50 40.200 40.200 39.955 0.245 25155 13052 1 16 . 1 1 50 50 ILE H H 50 9.213 9.213 9.310 -0.097 25155 13053 1 16 . 1 1 51 51 LEU N N 51 127.410 127.410 127.626 -0.216 25155 13054 1 16 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.462 1.608 25155 13055 1 16 . 1 1 51 51 LEU C C 51 174.540 174.540 175.428 -0.888 25155 13056 1 16 . 1 1 51 51 LEU CA C 51 52.950 52.950 53.165 -0.215 25155 13057 1 16 . 1 1 51 51 LEU CB C 51 43.190 43.190 44.149 -0.959 25155 13058 1 16 . 1 1 51 51 LEU H H 51 9.256 9.256 8.662 0.594 25155 13059 1 16 . 1 1 52 52 GLY N N 52 108.290 108.290 110.563 -2.273 25155 13060 1 16 . 1 1 52 52 GLY C C 52 174.330 174.330 171.367 2.963 25155 13061 1 16 . 1 1 52 52 GLY CA C 52 44.040 44.040 43.403 0.637 25155 13062 1 16 . 1 1 52 52 GLY H H 52 8.949 8.949 8.348 0.601 25155 13063 1 16 . 1 1 53 53 ILE N N 53 124.912 124.912 122.093 2.819 25155 13064 1 16 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.366 -0.191 25155 13065 1 16 . 1 1 53 53 ILE C C 53 174.470 174.470 172.421 2.049 25155 13066 1 16 . 1 1 53 53 ILE CA C 53 55.850 55.850 57.812 -1.962 25155 13067 1 16 . 1 1 53 53 ILE CB C 53 42.800 42.800 41.996 0.804 25155 13068 1 16 . 1 1 53 53 ILE H H 53 8.612 8.612 7.268 1.344 25155 13069 1 16 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.575 0.237 25155 13070 1 16 . 1 1 54 54 PRO C C 54 174.565 174.565 175.346 -0.781 25155 13071 1 16 . 1 1 54 54 PRO CA C 54 61.850 61.850 61.700 0.150 25155 13072 1 16 . 1 1 54 54 PRO CB C 54 32.400 32.400 31.681 0.719 25155 13073 1 16 . 1 1 55 55 THR N N 55 116.040 116.040 119.235 -3.195 25155 13074 1 16 . 1 1 55 55 THR HA H 55 4.522 4.522 4.325 0.197 25155 13075 1 16 . 1 1 55 55 THR C C 55 173.990 173.990 172.781 1.209 25155 13076 1 16 . 1 1 55 55 THR CA C 55 62.845 62.845 61.418 1.427 25155 13077 1 16 . 1 1 55 55 THR CB C 55 70.795 70.795 70.852 -0.057 25155 13078 1 16 . 1 1 55 55 THR H H 55 7.663 7.663 8.217 -0.554 25155 13079 1 16 . 1 1 56 56 TRP N N 56 130.540 130.540 124.372 6.168 25155 13080 1 16 . 1 1 56 56 TRP CA C 56 54.800 54.800 56.567 -1.767 25155 13081 1 16 . 1 1 56 56 TRP H H 56 9.075 9.075 8.107 0.968 25155 13082 1 16 . 1 1 58 58 PHE HA H 58 4.540 4.540 4.819 -0.279 25155 13083 1 16 . 1 1 58 58 PHE C C 58 177.070 177.070 175.237 1.833 25155 13084 1 16 . 1 1 58 58 PHE CA C 58 55.460 55.460 57.241 -1.781 25155 13085 1 16 . 1 1 58 58 PHE CB C 58 41.200 41.200 38.510 2.690 25155 13086 1 16 . 1 1 59 59 GLY N N 59 109.796 109.796 107.591 2.205 25155 13087 1 16 . 1 1 59 59 GLY CA C 59 45.763 45.763 45.024 0.739 25155 13088 1 16 . 1 1 59 59 GLY H H 59 8.392 8.392 7.211 1.181 25155 13089 1 16 . 1 1 60 60 GLU C C 60 175.660 175.660 175.048 0.612 25155 13090 1 16 . 1 1 61 61 ILE N N 61 122.380 122.380 122.381 -0.001 25155 13091 1 16 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.477 0.963 25155 13092 1 16 . 1 1 61 61 ILE CA C 61 62.100 62.100 62.387 -0.287 25155 13093 1 16 . 1 1 61 61 ILE CB C 61 38.750 38.750 37.816 0.935 25155 13094 1 16 . 1 1 61 61 ILE H H 61 8.436 8.436 8.343 0.093 25155 13095 1 16 . 1 1 62 62 GLN CB C 62 30.570 30.570 29.149 1.421 25155 13096 1 16 . 1 1 63 63 GLU HA H 63 4.030 4.030 3.968 0.062 25155 13097 1 16 . 1 1 63 63 GLU C C 63 177.134 177.134 177.925 -0.791 25155 13098 1 16 . 1 1 63 63 GLU CA C 63 60.520 60.520 59.856 0.664 25155 13099 1 16 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.743 -0.093 25155 13100 1 16 . 1 1 64 64 ASP N N 64 119.630 119.630 119.035 0.595 25155 13101 1 16 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.438 0.154 25155 13102 1 16 . 1 1 64 64 ASP C C 64 178.680 178.680 177.503 1.177 25155 13103 1 16 . 1 1 64 64 ASP CA C 64 57.823 57.823 56.795 1.028 25155 13104 1 16 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.745 0.355 25155 13105 1 16 . 1 1 65 65 TRP N N 65 120.535 120.535 119.806 0.729 25155 13106 1 16 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.647 -0.322 25155 13107 1 16 . 1 1 65 65 TRP C C 65 178.684 178.684 177.814 0.870 25155 13108 1 16 . 1 1 65 65 TRP CA C 65 60.500 60.500 59.511 0.989 25155 13109 1 16 . 1 1 65 65 TRP CB C 65 30.100 30.100 31.459 -1.359 25155 13110 1 16 . 1 1 65 65 TRP H H 65 7.416 7.416 7.610 -0.194 25155 13111 1 16 . 1 1 66 66 GLU N N 66 120.760 120.760 120.819 -0.059 25155 13112 1 16 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.244 -0.424 25155 13113 1 16 . 1 1 66 66 GLU C C 66 178.860 178.860 178.888 -0.028 25155 13114 1 16 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.861 0.239 25155 13115 1 16 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.524 -0.514 25155 13116 1 16 . 1 1 67 67 ALA N N 67 118.972 118.972 121.926 -2.954 25155 13117 1 16 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.206 0.041 25155 13118 1 16 . 1 1 67 67 ALA C C 67 179.610 179.610 178.947 0.663 25155 13119 1 16 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.901 -0.301 25155 13120 1 16 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.845 -0.057 25155 13121 1 16 . 1 1 67 67 ALA H H 67 7.690 7.690 8.467 -0.777 25155 13122 1 16 . 1 1 68 68 VAL N N 68 107.530 107.530 111.310 -3.780 25155 13123 1 16 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.246 0.464 25155 13124 1 16 . 1 1 68 68 VAL C C 68 176.800 176.800 176.666 0.134 25155 13125 1 16 . 1 1 68 68 VAL CA C 68 60.060 60.060 63.034 -2.974 25155 13126 1 16 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.497 0.103 25155 13127 1 16 . 1 1 68 68 VAL H H 68 7.240 7.240 7.501 -0.261 25155 13128 1 16 . 1 1 69 69 TRP N N 69 126.960 126.960 124.525 2.435 25155 13129 1 16 . 1 1 69 69 TRP HA H 69 4.182 4.182 3.955 0.227 25155 13130 1 16 . 1 1 69 69 TRP C C 69 178.640 178.640 177.107 1.533 25155 13131 1 16 . 1 1 69 69 TRP CA C 69 61.300 61.300 62.785 -1.486 25155 13132 1 16 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.418 2.152 25155 13133 1 16 . 1 1 69 69 TRP H H 69 7.810 7.810 8.262 -0.452 25155 13134 1 16 . 1 1 70 70 ASP N N 70 114.644 114.644 116.810 -2.166 25155 13135 1 16 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.170 0.349 25155 13136 1 16 . 1 1 70 70 ASP C C 70 178.685 178.685 177.972 0.713 25155 13137 1 16 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.589 -0.589 25155 13138 1 16 . 1 1 70 70 ASP CB C 70 39.810 39.810 40.996 -1.186 25155 13139 1 16 . 1 1 71 71 GLN N N 71 120.100 120.100 117.321 2.779 25155 13140 1 16 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.162 0.028 25155 13141 1 16 . 1 1 71 71 GLN C C 71 178.870 178.870 178.111 0.759 25155 13142 1 16 . 1 1 71 71 GLN CA C 71 57.617 57.617 57.584 0.033 25155 13143 1 16 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.466 -0.646 25155 13144 1 16 . 1 1 71 71 GLN H H 71 7.980 7.980 7.692 0.288 25155 13145 1 16 . 1 1 72 72 LEU N N 72 117.535 117.535 119.521 -1.986 25155 13146 1 16 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.928 -0.131 25155 13147 1 16 . 1 1 72 72 LEU C C 72 178.308 178.308 178.395 -0.087 25155 13148 1 16 . 1 1 72 72 LEU CA C 72 57.340 57.340 57.499 -0.159 25155 13149 1 16 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.484 0.216 25155 13150 1 16 . 1 1 72 72 LEU H H 72 7.435 7.435 7.972 -0.537 25155 13151 1 16 . 1 1 73 73 ASP N N 73 115.534 115.534 117.085 -1.551 25155 13152 1 16 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.358 -0.208 25155 13153 1 16 . 1 1 73 73 ASP C C 73 177.553 177.553 177.107 0.446 25155 13154 1 16 . 1 1 73 73 ASP CA C 73 57.350 57.350 56.309 1.041 25155 13155 1 16 . 1 1 73 73 ASP CB C 73 40.040 40.040 41.311 -1.271 25155 13156 1 16 . 1 1 74 74 ASP N N 74 117.300 117.300 119.880 -2.580 25155 13157 1 16 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.552 0.154 25155 13158 1 16 . 1 1 74 74 ASP C C 74 176.424 176.424 177.231 -0.807 25155 13159 1 16 . 1 1 74 74 ASP CA C 74 54.170 54.170 55.334 -1.164 25155 13160 1 16 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.540 0.280 25155 13161 1 16 . 1 1 75 75 LEU N N 75 118.500 118.500 120.709 -2.209 25155 13162 1 16 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.136 0.159 25155 13163 1 16 . 1 1 75 75 LEU C C 75 176.800 176.800 176.333 0.467 25155 13164 1 16 . 1 1 75 75 LEU CA C 75 54.400 54.400 55.286 -0.886 25155 13165 1 16 . 1 1 75 75 LEU CB C 75 43.280 43.280 41.911 1.369 25155 13166 1 16 . 1 1 75 75 LEU H H 75 6.966 6.966 8.029 -1.063 25155 13167 1 16 . 1 1 76 76 ASN N N 76 123.040 123.040 120.135 2.905 25155 13168 1 16 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.693 0.169 25155 13169 1 16 . 1 1 76 76 ASN C C 76 174.927 174.927 174.207 0.720 25155 13170 1 16 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.608 -1.727 25155 13171 1 16 . 1 1 76 76 ASN CB C 76 37.510 37.510 39.072 -1.562 25155 13172 1 16 . 1 1 76 76 ASN H H 76 9.882 9.882 9.075 0.807 25155 13173 1 16 . 1 1 77 77 LEU N N 77 123.614 123.614 123.911 -0.297 25155 13174 1 16 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.598 -0.228 25155 13175 1 16 . 1 1 77 77 LEU C C 77 175.110 175.110 176.168 -1.058 25155 13176 1 16 . 1 1 77 77 LEU CA C 77 52.200 52.200 54.124 -1.924 25155 13177 1 16 . 1 1 77 77 LEU CB C 77 42.786 42.786 43.186 -0.400 25155 13178 1 16 . 1 1 77 77 LEU H H 77 8.700 8.700 8.543 0.158 25155 13179 1 16 . 1 1 78 78 GLU N N 78 120.822 120.822 121.324 -0.502 25155 13180 1 16 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.334 -0.434 25155 13181 1 16 . 1 1 78 78 GLU C C 78 178.670 178.670 178.012 0.658 25155 13182 1 16 . 1 1 78 78 GLU CA C 78 58.700 58.700 58.026 0.674 25155 13183 1 16 . 1 1 78 78 GLU CB C 78 29.467 29.467 29.533 -0.066 25155 13184 1 16 . 1 1 79 79 GLY N N 79 113.160 113.160 113.641 -0.481 25155 13185 1 16 . 1 1 79 79 GLY C C 79 174.523 174.523 173.687 0.836 25155 13186 1 16 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.416 0.004 25155 13187 1 16 . 1 1 79 79 GLY H H 79 8.450 8.450 8.886 -0.436 25155 13188 1 16 . 1 1 80 80 LYS N N 80 120.283 120.283 120.134 0.149 25155 13189 1 16 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.365 -0.007 25155 13190 1 16 . 1 1 80 80 LYS C C 80 175.304 175.304 176.087 -0.783 25155 13191 1 16 . 1 1 80 80 LYS CA C 80 56.890 56.890 56.196 0.694 25155 13192 1 16 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.662 -0.542 25155 13193 1 16 . 1 1 81 81 ILE N N 81 122.288 122.288 122.186 0.102 25155 13194 1 16 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.393 0.413 25155 13195 1 16 . 1 1 81 81 ILE C C 81 174.750 174.750 175.342 -0.592 25155 13196 1 16 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.546 -1.726 25155 13197 1 16 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.303 0.547 25155 13198 1 16 . 1 1 81 81 ILE H H 81 7.405 7.405 8.206 -0.801 25155 13199 1 16 . 1 1 82 82 VAL N N 82 127.793 127.793 126.238 1.555 25155 13200 1 16 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.171 0.109 25155 13201 1 16 . 1 1 82 82 VAL C C 82 172.680 172.680 174.400 -1.720 25155 13202 1 16 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.160 -0.060 25155 13203 1 16 . 1 1 82 82 VAL CB C 82 35.280 35.280 35.420 -0.140 25155 13204 1 16 . 1 1 82 82 VAL H H 82 8.800 8.800 9.098 -0.298 25155 13205 1 16 . 1 1 83 83 ALA N N 83 130.911 130.911 130.033 0.878 25155 13206 1 16 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.645 -0.256 25155 13207 1 16 . 1 1 83 83 ALA C C 83 175.870 175.870 176.266 -0.396 25155 13208 1 16 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.614 0.386 25155 13209 1 16 . 1 1 83 83 ALA CB C 83 23.722 23.722 22.079 1.643 25155 13210 1 16 . 1 1 83 83 ALA H H 83 9.252 9.252 9.072 0.180 25155 13211 1 16 . 1 1 84 84 LEU N N 84 124.269 124.269 123.086 1.183 25155 13212 1 16 . 1 1 84 84 LEU HA H 84 5.508 5.508 4.970 0.538 25155 13213 1 16 . 1 1 84 84 LEU C C 84 175.490 175.490 175.614 -0.124 25155 13214 1 16 . 1 1 84 84 LEU CA C 84 53.670 53.670 54.151 -0.482 25155 13215 1 16 . 1 1 84 84 LEU CB C 84 45.000 45.000 45.057 -0.057 25155 13216 1 16 . 1 1 84 84 LEU H H 84 10.378 10.378 8.500 1.878 25155 13217 1 16 . 1 1 85 85 TYR N N 85 115.826 115.826 119.616 -3.790 25155 13218 1 16 . 1 1 85 85 TYR HA H 85 4.950 4.950 5.223 -0.273 25155 13219 1 16 . 1 1 85 85 TYR C C 85 172.661 172.661 173.439 -0.778 25155 13220 1 16 . 1 1 85 85 TYR CA C 85 55.853 55.853 55.358 0.495 25155 13221 1 16 . 1 1 85 85 TYR CB C 85 43.200 43.200 41.223 1.977 25155 13222 1 16 . 1 1 85 85 TYR H H 85 9.200 9.200 8.577 0.623 25155 13223 1 16 . 1 1 86 86 GLY N N 86 106.802 106.802 105.066 1.736 25155 13224 1 16 . 1 1 86 86 GLY C C 86 170.348 170.348 170.874 -0.526 25155 13225 1 16 . 1 1 86 86 GLY CA C 86 44.687 44.687 44.602 0.085 25155 13226 1 16 . 1 1 86 86 GLY H H 86 8.752 8.752 8.349 0.403 25155 13227 1 16 . 1 1 87 87 LEU N N 87 120.860 120.860 120.472 0.388 25155 13228 1 16 . 1 1 87 87 LEU HA H 87 5.476 5.476 5.188 0.288 25155 13229 1 16 . 1 1 87 87 LEU C C 87 177.720 177.720 174.697 3.023 25155 13230 1 16 . 1 1 87 87 LEU CA C 87 52.630 52.630 52.405 0.225 25155 13231 1 16 . 1 1 87 87 LEU CB C 87 45.900 45.900 45.276 0.624 25155 13232 1 16 . 1 1 87 87 LEU H H 87 6.320 6.320 7.478 -1.158 25155 13233 1 16 . 1 1 88 88 GLY N N 88 109.910 109.910 110.203 -0.293 25155 13234 1 16 . 1 1 88 88 GLY C C 88 171.386 171.386 171.593 -0.207 25155 13235 1 16 . 1 1 88 88 GLY CA C 88 45.710 45.710 45.293 0.417 25155 13236 1 16 . 1 1 88 88 GLY H H 88 8.320 8.320 8.590 -0.270 25155 13237 1 16 . 1 1 89 89 ASP N N 89 121.580 121.580 118.992 2.588 25155 13238 1 16 . 1 1 89 89 ASP HA H 89 5.190 5.190 5.292 -0.102 25155 13239 1 16 . 1 1 89 89 ASP C C 89 176.608 176.608 177.061 -0.453 25155 13240 1 16 . 1 1 89 89 ASP CA C 89 52.200 52.200 52.933 -0.733 25155 13241 1 16 . 1 1 89 89 ASP CB C 89 41.900 41.900 43.002 -1.102 25155 13242 1 16 . 1 1 90 90 GLN N N 90 123.900 123.900 125.616 -1.716 25155 13243 1 16 . 1 1 90 90 GLN HA H 90 3.645 3.645 3.979 -0.334 25155 13244 1 16 . 1 1 90 90 GLN C C 90 173.523 173.523 176.734 -3.211 25155 13245 1 16 . 1 1 90 90 GLN CA C 90 58.706 58.706 57.795 0.911 25155 13246 1 16 . 1 1 90 90 GLN CB C 90 28.800 28.800 28.755 0.045 25155 13247 1 16 . 1 1 90 90 GLN H H 90 8.726 8.726 9.499 -0.773 25155 13248 1 16 . 1 1 91 91 LEU N N 91 117.080 117.080 119.613 -2.533 25155 13249 1 16 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.059 0.411 25155 13250 1 16 . 1 1 91 91 LEU C C 91 179.840 179.840 177.826 2.014 25155 13251 1 16 . 1 1 91 91 LEU CA C 91 55.800 55.800 55.194 0.606 25155 13252 1 16 . 1 1 91 91 LEU CB C 91 41.640 41.640 41.227 0.413 25155 13253 1 16 . 1 1 91 91 LEU H H 91 7.092 7.092 8.585 -1.493 25155 13254 1 16 . 1 1 92 92 GLY N N 92 110.460 110.460 105.856 4.604 25155 13255 1 16 . 1 1 92 92 GLY C C 92 174.824 174.824 174.133 0.691 25155 13256 1 16 . 1 1 92 92 GLY CA C 92 46.390 46.390 44.815 1.575 25155 13257 1 16 . 1 1 92 92 GLY H H 92 9.243 9.243 7.867 1.376 25155 13258 1 16 . 1 1 93 93 TYR N N 93 118.140 118.140 116.323 1.817 25155 13259 1 16 . 1 1 93 93 TYR HA H 93 5.173 5.173 3.849 1.324 25155 13260 1 16 . 1 1 93 93 TYR C C 93 177.805 177.805 176.113 1.692 25155 13261 1 16 . 1 1 93 93 TYR CA C 93 57.430 57.430 58.522 -1.092 25155 13262 1 16 . 1 1 93 93 TYR CB C 93 39.300 39.300 34.936 4.364 25155 13263 1 16 . 1 1 93 93 TYR H H 93 7.252 7.252 6.970 0.282 25155 13264 1 16 . 1 1 94 94 GLY N N 94 112.455 112.455 103.333 9.122 25155 13265 1 16 . 1 1 94 94 GLY C C 94 177.740 177.740 175.416 2.324 25155 13266 1 16 . 1 1 94 94 GLY CA C 94 49.880 49.880 45.887 3.993 25155 13267 1 16 . 1 1 94 94 GLY H H 94 8.154 8.154 8.678 -0.524 25155 13268 1 16 . 1 1 95 95 GLU N N 95 123.040 123.040 120.408 2.632 25155 13269 1 16 . 1 1 95 95 GLU HA H 95 4.000 4.000 4.448 -0.448 25155 13270 1 16 . 1 1 95 95 GLU C C 95 175.145 175.145 177.607 -2.462 25155 13271 1 16 . 1 1 95 95 GLU CA C 95 57.950 57.950 58.089 -0.139 25155 13272 1 16 . 1 1 95 95 GLU CB C 95 27.400 27.400 30.249 -2.849 25155 13273 1 16 . 1 1 96 96 TRP N N 96 118.000 118.000 117.825 0.175 25155 13274 1 16 . 1 1 96 96 TRP HA H 96 5.213 5.213 4.869 0.344 25155 13275 1 16 . 1 1 96 96 TRP C C 96 176.616 176.616 176.032 0.584 25155 13276 1 16 . 1 1 96 96 TRP CA C 96 57.120 57.120 56.021 1.099 25155 13277 1 16 . 1 1 96 96 TRP CB C 96 29.970 29.970 30.046 -0.076 25155 13278 1 16 . 1 1 96 96 TRP H H 96 7.785 7.785 7.703 0.082 25155 13279 1 16 . 1 1 97 97 PHE N N 97 123.268 123.268 121.802 1.466 25155 13280 1 16 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.384 0.276 25155 13281 1 16 . 1 1 97 97 PHE CA C 97 58.742 58.742 59.199 -0.457 25155 13282 1 16 . 1 1 97 97 PHE CB C 97 40.835 40.835 39.861 0.974 25155 13283 1 16 . 1 1 97 97 PHE H H 97 7.054 7.054 8.115 -1.061 25155 13284 1 16 . 1 1 98 98 LEU HA H 98 3.440 3.440 3.507 -0.067 25155 13285 1 16 . 1 1 98 98 LEU C C 98 176.613 176.613 176.884 -0.271 25155 13286 1 16 . 1 1 98 98 LEU CA C 98 56.000 56.000 55.124 0.876 25155 13287 1 16 . 1 1 98 98 LEU CB C 98 38.600 38.600 39.299 -0.699 25155 13288 1 16 . 1 1 98 98 LEU H H 98 8.584 8.584 8.242 0.342 25155 13289 1 16 . 1 1 99 99 ASP N N 99 123.268 123.268 120.119 3.149 25155 13290 1 16 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.333 -0.368 25155 13291 1 16 . 1 1 99 99 ASP C C 99 178.876 178.876 176.970 1.906 25155 13292 1 16 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.466 1.794 25155 13293 1 16 . 1 1 99 99 ASP CB C 99 40.350 40.350 41.169 -0.819 25155 13294 1 16 . 1 1 100 100 ALA N N 100 119.124 119.124 121.459 -2.335 25155 13295 1 16 . 1 1 100 100 ALA HA H 100 3.822 3.822 4.059 -0.237 25155 13296 1 16 . 1 1 100 100 ALA C C 100 178.490 178.490 179.292 -0.802 25155 13297 1 16 . 1 1 100 100 ALA CA C 100 55.100 55.100 54.697 0.403 25155 13298 1 16 . 1 1 100 100 ALA CB C 100 19.700 19.700 18.066 1.634 25155 13299 1 16 . 1 1 100 100 ALA H H 100 8.400 8.400 7.793 0.607 25155 13300 1 16 . 1 1 101 101 LEU N N 101 118.687 118.687 120.339 -1.652 25155 13301 1 16 . 1 1 101 101 LEU HA H 101 3.674 3.674 3.960 -0.286 25155 13302 1 16 . 1 1 101 101 LEU C C 101 179.050 179.050 178.713 0.337 25155 13303 1 16 . 1 1 101 101 LEU CA C 101 57.800 57.800 57.170 0.630 25155 13304 1 16 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.602 1.048 25155 13305 1 16 . 1 1 101 101 LEU H H 101 6.518 6.518 7.284 -0.766 25155 13306 1 16 . 1 1 102 102 GLY N N 102 104.410 104.410 106.640 -2.230 25155 13307 1 16 . 1 1 102 102 GLY C C 102 176.056 176.056 176.084 -0.028 25155 13308 1 16 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.291 0.459 25155 13309 1 16 . 1 1 102 102 GLY H H 102 7.712 7.712 8.063 -0.352 25155 13310 1 16 . 1 1 103 103 MET N N 103 120.550 120.550 121.638 -1.088 25155 13311 1 16 . 1 1 103 103 MET HA H 103 4.256 4.256 4.410 -0.154 25155 13312 1 16 . 1 1 103 103 MET C C 103 179.650 179.650 178.472 1.178 25155 13313 1 16 . 1 1 103 103 MET CA C 103 59.450 59.450 59.469 -0.019 25155 13314 1 16 . 1 1 103 103 MET CB C 103 32.300 32.300 32.777 -0.477 25155 13315 1 16 . 1 1 103 103 MET H H 103 8.485 8.485 8.334 0.151 25155 13316 1 16 . 1 1 104 104 LEU N N 104 123.480 123.480 120.802 2.678 25155 13317 1 16 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.376 -0.315 25155 13318 1 16 . 1 1 104 104 LEU C C 104 177.750 177.750 179.032 -1.282 25155 13319 1 16 . 1 1 104 104 LEU CA C 104 58.100 58.100 57.818 0.282 25155 13320 1 16 . 1 1 104 104 LEU CB C 104 41.450 41.450 41.167 0.283 25155 13321 1 16 . 1 1 104 104 LEU H H 104 8.392 8.392 8.188 0.204 25155 13322 1 16 . 1 1 105 105 HIS N N 105 119.570 119.570 120.021 -0.451 25155 13323 1 16 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.131 -0.279 25155 13324 1 16 . 1 1 105 105 HIS C C 105 177.550 177.550 176.962 0.588 25155 13325 1 16 . 1 1 105 105 HIS CA C 105 61.000 61.000 59.981 1.019 25155 13326 1 16 . 1 1 105 105 HIS CB C 105 28.820 28.820 29.617 -0.797 25155 13327 1 16 . 1 1 105 105 HIS H H 105 8.247 8.247 8.548 -0.301 25155 13328 1 16 . 1 1 106 106 ASP N N 106 119.780 119.780 119.682 0.098 25155 13329 1 16 . 1 1 106 106 ASP HA H 106 4.333 4.333 4.004 0.329 25155 13330 1 16 . 1 1 106 106 ASP C C 106 179.410 179.410 178.433 0.977 25155 13331 1 16 . 1 1 106 106 ASP CA C 106 57.800 57.800 56.862 0.938 25155 13332 1 16 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.082 -0.482 25155 13333 1 16 . 1 1 107 107 LYS N N 107 121.660 121.660 118.330 3.330 25155 13334 1 16 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.002 0.098 25155 13335 1 16 . 1 1 107 107 LYS C C 107 178.316 178.316 177.752 0.564 25155 13336 1 16 . 1 1 107 107 LYS CA C 107 58.750 58.750 58.150 0.600 25155 13337 1 16 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.370 -0.520 25155 13338 1 16 . 1 1 108 108 LEU N N 108 116.050 116.050 116.565 -0.515 25155 13339 1 16 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.495 -0.485 25155 13340 1 16 . 1 1 108 108 LEU C C 108 179.050 179.050 178.824 0.226 25155 13341 1 16 . 1 1 108 108 LEU CA C 108 56.240 56.240 55.703 0.537 25155 13342 1 16 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.561 -0.761 25155 13343 1 16 . 1 1 108 108 LEU H H 108 8.072 8.072 7.930 0.142 25155 13344 1 16 . 1 1 109 109 SER N N 109 116.280 116.280 117.457 -1.177 25155 13345 1 16 . 1 1 109 109 SER HA H 109 4.300 4.300 4.472 -0.172 25155 13346 1 16 . 1 1 109 109 SER C C 109 175.848 175.848 176.566 -0.718 25155 13347 1 16 . 1 1 109 109 SER CA C 109 62.410 62.410 62.211 0.199 25155 13348 1 16 . 1 1 109 109 SER CB C 109 62.850 62.850 62.854 -0.004 25155 13349 1 16 . 1 1 109 109 SER H H 109 8.366 8.366 8.469 -0.103 25155 13350 1 16 . 1 1 110 110 THR N N 110 110.416 110.416 112.914 -2.498 25155 13351 1 16 . 1 1 110 110 THR HA H 110 4.614 4.614 4.343 0.271 25155 13352 1 16 . 1 1 110 110 THR C C 110 175.675 175.675 175.509 0.166 25155 13353 1 16 . 1 1 110 110 THR CA C 110 62.030 62.030 64.270 -2.240 25155 13354 1 16 . 1 1 110 110 THR CB C 110 68.810 68.810 68.702 0.108 25155 13355 1 16 . 1 1 110 110 THR H H 110 7.185 7.185 8.048 -0.863 25155 13356 1 16 . 1 1 111 111 LYS N N 111 120.090 120.090 120.392 -0.302 25155 13357 1 16 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.439 0.074 25155 13358 1 16 . 1 1 111 111 LYS C C 111 176.814 176.814 176.649 0.165 25155 13359 1 16 . 1 1 111 111 LYS CA C 111 55.730 55.730 55.653 0.077 25155 13360 1 16 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.471 -1.541 25155 13361 1 16 . 1 1 112 112 GLY N N 112 107.540 107.540 108.064 -0.524 25155 13362 1 16 . 1 1 112 112 GLY C C 112 176.223 176.223 174.251 1.972 25155 13363 1 16 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.465 1.461 25155 13364 1 16 . 1 1 112 112 GLY H H 112 8.315 8.315 7.624 0.691 25155 13365 1 16 . 1 1 113 113 VAL N N 113 113.536 113.536 114.751 -1.215 25155 13366 1 16 . 1 1 113 113 VAL HA H 113 4.494 4.494 4.308 0.186 25155 13367 1 16 . 1 1 113 113 VAL C C 113 174.560 174.560 174.762 -0.202 25155 13368 1 16 . 1 1 113 113 VAL CA C 113 59.550 59.550 60.962 -1.412 25155 13369 1 16 . 1 1 113 113 VAL CB C 113 32.800 32.800 32.319 0.481 25155 13370 1 16 . 1 1 113 113 VAL H H 113 6.835 6.835 7.042 -0.207 25155 13371 1 16 . 1 1 114 114 LYS N N 114 122.920 122.920 121.031 1.889 25155 13372 1 16 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.398 0.096 25155 13373 1 16 . 1 1 114 114 LYS C C 114 174.925 174.925 174.660 0.265 25155 13374 1 16 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.160 0.120 25155 13375 1 16 . 1 1 114 114 LYS CB C 114 33.630 33.630 34.603 -0.973 25155 13376 1 16 . 1 1 115 115 PHE N N 115 123.140 123.140 123.090 0.050 25155 13377 1 16 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.487 0.213 25155 13378 1 16 . 1 1 115 115 PHE C C 115 177.580 177.580 176.472 1.108 25155 13379 1 16 . 1 1 115 115 PHE CA C 115 58.677 58.677 57.000 1.677 25155 13380 1 16 . 1 1 115 115 PHE CB C 115 41.120 41.120 40.339 0.781 25155 13381 1 16 . 1 1 115 115 PHE H H 115 8.506 8.506 8.528 -0.022 25155 13382 1 16 . 1 1 116 116 VAL N N 116 115.737 115.737 115.350 0.387 25155 13383 1 16 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.317 0.161 25155 13384 1 16 . 1 1 116 116 VAL C C 116 175.300 175.300 175.702 -0.402 25155 13385 1 16 . 1 1 116 116 VAL CA C 116 58.877 58.877 60.011 -1.134 25155 13386 1 16 . 1 1 116 116 VAL CB C 116 34.120 34.120 34.627 -0.507 25155 13387 1 16 . 1 1 116 116 VAL H H 116 8.860 8.860 8.969 -0.109 25155 13388 1 16 . 1 1 117 117 GLY N N 117 108.137 108.137 109.463 -1.326 25155 13389 1 16 . 1 1 117 117 GLY C C 117 176.110 176.110 175.148 0.962 25155 13390 1 16 . 1 1 117 117 GLY CA C 117 47.500 47.500 45.605 1.895 25155 13391 1 16 . 1 1 117 117 GLY H H 117 9.838 9.838 9.524 0.314 25155 13392 1 16 . 1 1 118 118 TYR N N 118 120.380 120.380 120.344 0.036 25155 13393 1 16 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.748 0.222 25155 13394 1 16 . 1 1 118 118 TYR C C 118 177.630 177.630 175.859 1.771 25155 13395 1 16 . 1 1 118 118 TYR CA C 118 55.800 55.800 58.033 -2.233 25155 13396 1 16 . 1 1 118 118 TYR CB C 118 35.970 35.970 38.946 -2.976 25155 13397 1 16 . 1 1 118 118 TYR H H 118 8.652 8.652 7.803 0.849 25155 13398 1 16 . 1 1 119 119 TRP N N 119 126.040 126.040 122.963 3.077 25155 13399 1 16 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.194 0.827 25155 13400 1 16 . 1 1 119 119 TRP C C 119 173.000 173.000 173.827 -0.827 25155 13401 1 16 . 1 1 119 119 TRP CA C 119 53.820 53.820 53.862 -0.042 25155 13402 1 16 . 1 1 119 119 TRP CB C 119 36.050 36.050 33.635 2.415 25155 13403 1 16 . 1 1 119 119 TRP H H 119 8.070 8.070 8.690 -0.620 25155 13404 1 16 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.524 0.260 25155 13405 1 16 . 1 1 120 120 PRO C C 120 176.870 176.870 176.528 0.342 25155 13406 1 16 . 1 1 120 120 PRO CA C 120 63.780 63.780 62.909 0.871 25155 13407 1 16 . 1 1 120 120 PRO CB C 120 31.990 31.990 32.456 -0.466 25155 13408 1 16 . 1 1 121 121 THR N N 121 109.310 109.310 111.979 -2.669 25155 13409 1 16 . 1 1 121 121 THR HA H 121 4.073 4.073 4.288 -0.215 25155 13410 1 16 . 1 1 121 121 THR C C 121 176.324 176.324 175.226 1.098 25155 13411 1 16 . 1 1 121 121 THR CA C 121 61.250 61.250 62.571 -1.321 25155 13412 1 16 . 1 1 121 121 THR CB C 121 69.730 69.730 69.129 0.601 25155 13413 1 16 . 1 1 121 121 THR H H 121 7.370 7.370 8.461 -1.091 25155 13414 1 16 . 1 1 122 122 GLU N N 122 123.937 123.937 121.250 2.687 25155 13415 1 16 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.084 0.140 25155 13416 1 16 . 1 1 122 122 GLU C C 122 177.737 177.737 177.684 0.053 25155 13417 1 16 . 1 1 122 122 GLU CA C 122 58.200 58.200 57.822 0.378 25155 13418 1 16 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.633 0.167 25155 13419 1 16 . 1 1 123 123 GLY N N 123 114.563 114.563 111.678 2.885 25155 13420 1 16 . 1 1 123 123 GLY C C 123 173.783 173.783 173.331 0.452 25155 13421 1 16 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.155 0.225 25155 13422 1 16 . 1 1 123 123 GLY H H 123 9.144 9.144 8.904 0.240 25155 13423 1 16 . 1 1 124 124 TYR N N 124 118.800 118.800 121.882 -3.082 25155 13424 1 16 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.414 0.804 25155 13425 1 16 . 1 1 124 124 TYR C C 124 175.673 175.673 174.191 1.482 25155 13426 1 16 . 1 1 124 124 TYR CA C 124 56.950 56.950 56.962 -0.013 25155 13427 1 16 . 1 1 124 124 TYR CB C 124 41.100 41.100 39.888 1.212 25155 13428 1 16 . 1 1 124 124 TYR H H 124 7.895 7.895 7.871 0.024 25155 13429 1 16 . 1 1 125 125 GLU N N 125 124.790 124.790 123.243 1.547 25155 13430 1 16 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.505 0.180 25155 13431 1 16 . 1 1 125 125 GLU C C 125 172.877 172.877 174.752 -1.875 25155 13432 1 16 . 1 1 125 125 GLU CA C 125 55.700 55.700 54.888 0.812 25155 13433 1 16 . 1 1 125 125 GLU CB C 125 31.340 31.340 31.077 0.263 25155 13434 1 16 . 1 1 126 126 PHE N N 126 118.670 118.670 121.648 -2.978 25155 13435 1 16 . 1 1 126 126 PHE HA H 126 4.841 4.841 4.869 -0.028 25155 13436 1 16 . 1 1 126 126 PHE C C 126 173.800 173.800 175.818 -2.018 25155 13437 1 16 . 1 1 126 126 PHE CA C 126 56.950 56.950 57.801 -0.851 25155 13438 1 16 . 1 1 126 126 PHE CB C 126 40.300 40.300 41.993 -1.693 25155 13439 1 16 . 1 1 126 126 PHE H H 126 7.645 7.645 8.601 -0.956 25155 13440 1 16 . 1 1 127 127 THR N N 127 107.038 107.038 117.812 -10.774 25155 13441 1 16 . 1 1 127 127 THR HA H 127 4.370 4.370 4.462 -0.092 25155 13442 1 16 . 1 1 127 127 THR C C 127 175.100 175.100 174.980 0.120 25155 13443 1 16 . 1 1 127 127 THR CA C 127 61.080 61.080 62.317 -1.237 25155 13444 1 16 . 1 1 127 127 THR CB C 127 70.500 70.500 70.008 0.492 25155 13445 1 16 . 1 1 127 127 THR H H 127 7.306 7.306 8.776 -1.470 25155 13446 1 16 . 1 1 128 128 SER N N 128 118.150 118.150 118.967 -0.817 25155 13447 1 16 . 1 1 128 128 SER HA H 128 4.650 4.650 4.933 -0.283 25155 13448 1 16 . 1 1 128 128 SER C C 128 175.760 175.760 173.321 2.439 25155 13449 1 16 . 1 1 128 128 SER CA C 128 55.813 55.813 55.865 -0.052 25155 13450 1 16 . 1 1 128 128 SER CB C 128 65.300 65.300 64.490 0.810 25155 13451 1 16 . 1 1 128 128 SER H H 128 7.354 7.354 8.039 -0.685 25155 13452 1 16 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.545 0.219 25155 13453 1 16 . 1 1 129 129 PRO C C 129 178.860 178.860 177.814 1.046 25155 13454 1 16 . 1 1 129 129 PRO CA C 129 62.728 62.728 63.580 -0.851 25155 13455 1 16 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.371 0.029 25155 13456 1 16 . 1 1 130 130 LYS N N 130 122.158 122.158 120.489 1.669 25155 13457 1 16 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.141 0.069 25155 13458 1 16 . 1 1 130 130 LYS C C 130 176.890 176.890 175.403 1.487 25155 13459 1 16 . 1 1 130 130 LYS CA C 130 61.375 61.375 60.766 0.609 25155 13460 1 16 . 1 1 130 130 LYS CB C 130 30.350 30.350 31.158 -0.808 25155 13461 1 16 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.465 0.068 25155 13462 1 16 . 1 1 131 131 PRO C C 131 173.810 173.810 176.071 -2.261 25155 13463 1 16 . 1 1 131 131 PRO CA C 131 64.510 64.510 63.634 0.876 25155 13464 1 16 . 1 1 131 131 PRO CB C 131 31.745 31.745 31.540 0.205 25155 13465 1 16 . 1 1 132 132 VAL N N 132 114.480 114.480 112.555 1.925 25155 13466 1 16 . 1 1 132 132 VAL HA H 132 5.158 5.158 4.908 0.250 25155 13467 1 16 . 1 1 132 132 VAL C C 132 175.137 175.137 173.883 1.254 25155 13468 1 16 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.086 0.714 25155 13469 1 16 . 1 1 132 132 VAL CB C 132 34.780 34.780 35.540 -0.760 25155 13470 1 16 . 1 1 132 132 VAL H H 132 6.716 6.716 7.523 -0.807 25155 13471 1 16 . 1 1 133 133 ILE N N 133 120.670 120.670 114.014 6.656 25155 13472 1 16 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.454 -0.062 25155 13473 1 16 . 1 1 133 133 ILE C C 133 175.485 175.485 175.007 0.478 25155 13474 1 16 . 1 1 133 133 ILE CA C 133 60.000 60.000 59.424 0.576 25155 13475 1 16 . 1 1 133 133 ILE CB C 133 42.020 42.020 40.251 1.769 25155 13476 1 16 . 1 1 133 133 ILE H H 133 8.740 8.740 8.342 0.398 25155 13477 1 16 . 1 1 134 134 ALA N N 134 122.454 122.454 123.492 -1.038 25155 13478 1 16 . 1 1 134 134 ALA HA H 134 3.953 3.953 3.930 0.023 25155 13479 1 16 . 1 1 134 134 ALA C C 134 178.387 178.387 177.508 0.879 25155 13480 1 16 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.439 -0.389 25155 13481 1 16 . 1 1 134 134 ALA CB C 134 16.982 16.982 18.066 -1.084 25155 13482 1 16 . 1 1 134 134 ALA H H 134 8.490 8.490 8.532 -0.042 25155 13483 1 16 . 1 1 135 135 ASP N N 135 117.310 117.310 122.941 -5.631 25155 13484 1 16 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.483 -0.239 25155 13485 1 16 . 1 1 135 135 ASP C C 135 176.390 176.390 176.400 -0.010 25155 13486 1 16 . 1 1 135 135 ASP CA C 135 55.120 55.120 52.855 2.265 25155 13487 1 16 . 1 1 135 135 ASP CB C 135 39.865 39.865 39.168 0.697 25155 13488 1 16 . 1 1 136 136 GLY N N 136 104.336 104.336 108.904 -4.568 25155 13489 1 16 . 1 1 136 136 GLY C C 136 174.940 174.940 174.844 0.096 25155 13490 1 16 . 1 1 136 136 GLY CA C 136 45.150 45.150 45.726 -0.576 25155 13491 1 16 . 1 1 136 136 GLY H H 136 7.592 7.592 8.051 -0.459 25155 13492 1 16 . 1 1 137 137 GLN N N 137 118.675 118.675 119.659 -0.984 25155 13493 1 16 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.309 -0.247 25155 13494 1 16 . 1 1 137 137 GLN C C 137 176.420 176.420 174.520 1.900 25155 13495 1 16 . 1 1 137 137 GLN CA C 137 57.760 57.760 57.173 0.587 25155 13496 1 16 . 1 1 137 137 GLN CB C 137 30.400 30.400 30.272 0.128 25155 13497 1 16 . 1 1 137 137 GLN H H 137 7.843 7.843 7.770 0.073 25155 13498 1 16 . 1 1 138 138 LEU N N 138 118.160 118.160 118.464 -0.304 25155 13499 1 16 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.609 0.352 25155 13500 1 16 . 1 1 138 138 LEU C C 138 175.700 175.700 174.771 0.929 25155 13501 1 16 . 1 1 138 138 LEU CA C 138 53.705 53.705 53.025 0.680 25155 13502 1 16 . 1 1 138 138 LEU CB C 138 46.480 46.480 45.696 0.784 25155 13503 1 16 . 1 1 138 138 LEU H H 138 7.356 7.356 7.142 0.214 25155 13504 1 16 . 1 1 139 139 PHE N N 139 119.060 119.060 121.160 -2.100 25155 13505 1 16 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.664 0.680 25155 13506 1 16 . 1 1 139 139 PHE C C 139 178.850 178.850 177.149 1.701 25155 13507 1 16 . 1 1 139 139 PHE CA C 139 56.670 56.670 58.828 -2.158 25155 13508 1 16 . 1 1 139 139 PHE CB C 139 43.652 43.652 39.681 3.971 25155 13509 1 16 . 1 1 139 139 PHE H H 139 10.026 10.026 9.246 0.780 25155 13510 1 16 . 1 1 140 140 VAL N N 140 109.905 109.905 123.603 -13.698 25155 13511 1 16 . 1 1 140 140 VAL HA H 140 3.500 3.500 3.438 0.062 25155 13512 1 16 . 1 1 140 140 VAL C C 140 172.860 172.860 174.777 -1.917 25155 13513 1 16 . 1 1 140 140 VAL CA C 140 61.812 61.812 61.877 -0.065 25155 13514 1 16 . 1 1 140 140 VAL CB C 140 30.250 30.250 31.062 -0.812 25155 13515 1 16 . 1 1 140 140 VAL H H 140 7.550 7.550 8.311 -0.761 25155 13516 1 16 . 1 1 141 141 GLY N N 141 106.600 106.600 104.865 1.735 25155 13517 1 16 . 1 1 141 141 GLY C C 141 171.350 171.350 172.547 -1.197 25155 13518 1 16 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.112 1.348 25155 13519 1 16 . 1 1 141 141 GLY H H 141 7.052 7.052 7.422 -0.370 25155 13520 1 16 . 1 1 142 142 LEU N N 142 117.820 117.820 119.463 -1.643 25155 13521 1 16 . 1 1 142 142 LEU HA H 142 4.962 4.962 3.775 1.187 25155 13522 1 16 . 1 1 142 142 LEU CA C 142 55.600 55.600 54.175 1.425 25155 13523 1 16 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.194 -4.264 25155 13524 1 16 . 1 1 142 142 LEU H H 142 7.643 7.643 8.126 -0.483 25155 13525 1 16 . 1 1 143 143 ALA HA H 143 4.220 4.220 4.488 -0.268 25155 13526 1 16 . 1 1 143 143 ALA C C 143 175.505 175.505 175.941 -0.436 25155 13527 1 16 . 1 1 143 143 ALA CA C 143 49.600 49.600 50.139 -0.539 25155 13528 1 16 . 1 1 143 143 ALA CB C 143 23.330 23.330 19.579 3.751 25155 13529 1 16 . 1 1 144 144 LEU N N 144 124.960 124.960 124.136 0.824 25155 13530 1 16 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.496 0.284 25155 13531 1 16 . 1 1 144 144 LEU C C 144 174.700 174.700 174.799 -0.099 25155 13532 1 16 . 1 1 144 144 LEU CA C 144 52.790 52.790 54.071 -1.281 25155 13533 1 16 . 1 1 144 144 LEU CB C 144 45.300 45.300 44.369 0.931 25155 13534 1 16 . 1 1 144 144 LEU H H 144 8.583 8.583 8.387 0.196 25155 13535 1 16 . 1 1 145 145 ASP N N 145 119.100 119.100 120.344 -1.244 25155 13536 1 16 . 1 1 145 145 ASP HA H 145 5.422 5.422 5.376 0.046 25155 13537 1 16 . 1 1 145 145 ASP C C 145 176.180 176.180 176.538 -0.358 25155 13538 1 16 . 1 1 145 145 ASP CA C 145 53.600 53.600 53.322 0.278 25155 13539 1 16 . 1 1 145 145 ASP CB C 145 43.180 43.180 43.454 -0.274 25155 13540 1 16 . 1 1 147 147 THR HA H 147 4.093 4.093 4.196 -0.103 25155 13541 1 16 . 1 1 147 147 THR C C 147 175.858 175.858 175.862 -0.004 25155 13542 1 16 . 1 1 147 147 THR CA C 147 66.400 66.400 65.618 0.782 25155 13543 1 16 . 1 1 147 147 THR CB C 147 69.400 69.400 68.984 0.416 25155 13544 1 16 . 1 1 147 147 THR H H 147 8.745 8.745 7.988 0.757 25155 13545 1 16 . 1 1 148 148 ASN N N 148 115.408 115.408 117.532 -2.124 25155 13546 1 16 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.896 0.114 25155 13547 1 16 . 1 1 148 148 ASN C C 148 175.750 175.750 174.908 0.842 25155 13548 1 16 . 1 1 148 148 ASN CA C 148 53.400 53.400 54.252 -0.852 25155 13549 1 16 . 1 1 148 148 ASN CB C 148 41.900 41.900 40.287 1.613 25155 13550 1 16 . 1 1 148 148 ASN H H 148 8.975 8.975 9.015 -0.040 25155 13551 1 16 . 1 1 149 149 GLN N N 149 117.900 117.900 118.267 -0.367 25155 13552 1 16 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.562 0.374 25155 13553 1 16 . 1 1 149 149 GLN C C 149 178.280 178.280 175.817 2.463 25155 13554 1 16 . 1 1 149 149 GLN CA C 149 53.730 53.730 55.123 -1.393 25155 13555 1 16 . 1 1 149 149 GLN CB C 149 29.790 29.790 28.643 1.147 25155 13556 1 16 . 1 1 149 149 GLN H H 149 7.430 7.430 7.702 -0.272 25155 13557 1 16 . 1 1 150 150 TYR N N 150 121.060 121.060 120.709 0.351 25155 13558 1 16 . 1 1 150 150 TYR HA H 150 4.671 4.671 4.327 0.344 25155 13559 1 16 . 1 1 150 150 TYR C C 150 178.680 178.680 176.961 1.719 25155 13560 1 16 . 1 1 150 150 TYR CA C 150 57.930 57.930 60.404 -2.474 25155 13561 1 16 . 1 1 150 150 TYR CB C 150 38.860 38.860 37.206 1.654 25155 13562 1 16 . 1 1 150 150 TYR H H 150 8.115 8.115 7.994 0.121 25155 13563 1 16 . 1 1 151 151 ASP N N 151 121.175 121.175 120.967 0.208 25155 13564 1 16 . 1 1 151 151 ASP CA C 151 57.000 57.000 56.307 0.693 25155 13565 1 16 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.262 1.738 25155 13566 1 16 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.309 0.281 25155 13567 1 16 . 1 1 152 152 LEU C C 152 178.300 178.300 178.124 0.176 25155 13568 1 16 . 1 1 152 152 LEU CA C 152 54.788 54.788 55.867 -1.079 25155 13569 1 16 . 1 1 152 152 LEU CB C 152 42.200 42.200 42.090 0.110 25155 13570 1 16 . 1 1 153 153 SER N N 153 116.170 116.170 116.619 -0.449 25155 13571 1 16 . 1 1 153 153 SER HA H 153 3.911 3.911 4.039 -0.128 25155 13572 1 16 . 1 1 153 153 SER CA C 153 63.400 63.400 62.370 1.030 25155 13573 1 16 . 1 1 153 153 SER CB C 153 63.200 63.200 62.936 0.264 25155 13574 1 16 . 1 1 153 153 SER H H 153 7.378 7.378 7.934 -0.556 25155 13575 1 16 . 1 1 154 154 ASP N N 154 121.640 121.640 120.953 0.687 25155 13576 1 16 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.319 -0.079 25155 13577 1 16 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.809 1.491 25155 13578 1 16 . 1 1 154 154 ASP CB C 154 40.000 40.000 40.731 -0.731 25155 13579 1 16 . 1 1 155 155 GLU HA H 155 4.170 4.170 4.081 0.089 25155 13580 1 16 . 1 1 155 155 GLU C C 155 179.420 179.420 179.327 0.093 25155 13581 1 16 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.275 -0.075 25155 13582 1 16 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.375 0.105 25155 13583 1 16 . 1 1 156 156 ARG N N 156 121.230 121.230 119.808 1.422 25155 13584 1 16 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.266 0.010 25155 13585 1 16 . 1 1 156 156 ARG C C 156 177.350 177.350 179.064 -1.714 25155 13586 1 16 . 1 1 156 156 ARG CA C 156 59.950 59.950 59.571 0.379 25155 13587 1 16 . 1 1 156 156 ARG CB C 156 31.100 31.100 30.237 0.863 25155 13588 1 16 . 1 1 157 157 ILE N N 157 118.190 118.190 119.870 -1.680 25155 13589 1 16 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.605 -0.175 25155 13590 1 16 . 1 1 157 157 ILE C C 157 178.480 178.480 177.831 0.649 25155 13591 1 16 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.633 0.927 25155 13592 1 16 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.743 0.737 25155 13593 1 16 . 1 1 157 157 ILE H H 157 8.705 8.705 8.496 0.209 25155 13594 1 16 . 1 1 158 158 GLN N N 158 119.975 119.975 120.632 -0.657 25155 13595 1 16 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.891 0.065 25155 13596 1 16 . 1 1 158 158 GLN C C 158 178.730 178.730 178.247 0.483 25155 13597 1 16 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.232 1.468 25155 13598 1 16 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.271 0.211 25155 13599 1 16 . 1 1 158 158 GLN H H 158 8.262 8.262 8.415 -0.153 25155 13600 1 16 . 1 1 159 159 SER N N 159 115.466 115.466 115.612 -0.146 25155 13601 1 16 . 1 1 159 159 SER HA H 159 4.446 4.446 4.348 0.098 25155 13602 1 16 . 1 1 159 159 SER C C 159 177.320 177.320 176.950 0.370 25155 13603 1 16 . 1 1 159 159 SER CA C 159 63.500 63.500 60.970 2.530 25155 13604 1 16 . 1 1 159 159 SER CB C 159 63.818 63.818 63.412 0.406 25155 13605 1 16 . 1 1 159 159 SER H H 159 8.440 8.440 8.471 -0.031 25155 13606 1 16 . 1 1 160 160 TRP N N 160 126.784 126.784 125.467 1.317 25155 13607 1 16 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.560 -0.106 25155 13608 1 16 . 1 1 160 160 TRP C C 160 177.934 177.934 177.543 0.391 25155 13609 1 16 . 1 1 160 160 TRP CA C 160 62.745 62.745 62.248 0.497 25155 13610 1 16 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.247 0.103 25155 13611 1 16 . 1 1 160 160 TRP H H 160 9.243 9.243 8.343 0.900 25155 13612 1 16 . 1 1 161 161 CYS N N 161 116.395 116.395 118.744 -2.349 25155 13613 1 16 . 1 1 161 161 CYS HA H 161 3.886 3.886 3.609 0.277 25155 13614 1 16 . 1 1 161 161 CYS C C 161 176.245 176.245 176.966 -0.721 25155 13615 1 16 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.745 0.555 25155 13616 1 16 . 1 1 161 161 CYS CB C 161 27.723 27.723 27.031 0.692 25155 13617 1 16 . 1 1 161 161 CYS H H 161 8.845 8.845 9.055 -0.210 25155 13618 1 16 . 1 1 162 162 GLU N N 162 118.030 118.030 119.443 -1.413 25155 13619 1 16 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.853 0.067 25155 13620 1 16 . 1 1 162 162 GLU C C 162 178.700 178.700 178.765 -0.065 25155 13621 1 16 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.538 0.262 25155 13622 1 16 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.242 0.258 25155 13623 1 16 . 1 1 163 163 GLN N N 163 120.650 120.650 119.693 0.957 25155 13624 1 16 . 1 1 163 163 GLN HA H 163 4.173 4.173 3.998 0.175 25155 13625 1 16 . 1 1 163 163 GLN C C 163 179.700 179.700 178.333 1.367 25155 13626 1 16 . 1 1 163 163 GLN CA C 163 59.688 59.688 59.243 0.445 25155 13627 1 16 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.878 0.022 25155 13628 1 16 . 1 1 163 163 GLN H H 163 8.148 8.148 7.733 0.415 25155 13629 1 16 . 1 1 164 164 ILE N N 164 114.836 114.836 117.286 -2.450 25155 13630 1 16 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.635 0.425 25155 13631 1 16 . 1 1 164 164 ILE C C 164 178.676 178.676 177.642 1.034 25155 13632 1 16 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.434 1.726 25155 13633 1 16 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.305 0.325 25155 13634 1 16 . 1 1 164 164 ILE H H 164 8.958 8.958 8.185 0.773 25155 13635 1 16 . 1 1 165 165 LEU N N 165 123.700 123.700 119.887 3.813 25155 13636 1 16 . 1 1 165 165 LEU HA H 165 4.100 4.100 3.996 0.104 25155 13637 1 16 . 1 1 165 165 LEU C C 165 180.548 180.548 178.440 2.108 25155 13638 1 16 . 1 1 165 165 LEU CA C 165 58.150 58.150 58.294 -0.144 25155 13639 1 16 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.414 -0.284 25155 13640 1 16 . 1 1 165 165 LEU H H 165 7.830 7.830 7.923 -0.093 25155 13641 1 16 . 1 1 166 166 ASN N N 166 120.160 120.160 118.414 1.746 25155 13642 1 16 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.367 0.203 25155 13643 1 16 . 1 1 166 166 ASN C C 166 175.690 175.690 177.416 -1.726 25155 13644 1 16 . 1 1 166 166 ASN CA C 166 55.946 55.946 57.032 -1.085 25155 13645 1 16 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.360 0.120 25155 13646 1 16 . 1 1 166 166 ASN H H 166 7.706 7.706 7.835 -0.129 25155 13647 1 16 . 1 1 167 167 GLU N N 167 121.286 121.286 121.068 0.218 25155 13648 1 16 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.388 -0.284 25155 13649 1 16 . 1 1 167 167 GLU C C 167 180.520 180.520 179.375 1.145 25155 13650 1 16 . 1 1 167 167 GLU CA C 167 59.920 59.920 59.017 0.902 25155 13651 1 16 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.783 1.142 25155 13652 1 16 . 1 1 168 168 MET N N 168 118.622 118.622 115.957 2.665 25155 13653 1 16 . 1 1 168 168 MET HA H 168 3.996 3.996 4.503 -0.507 25155 13654 1 16 . 1 1 168 168 MET C C 168 176.856 176.856 177.765 -0.909 25155 13655 1 16 . 1 1 168 168 MET CA C 168 59.500 59.500 58.488 1.012 25155 13656 1 16 . 1 1 168 168 MET CB C 168 33.700 33.700 32.925 0.775 25155 13657 1 16 . 1 1 168 168 MET H H 168 8.723 8.723 8.451 0.272 25155 13658 1 16 . 1 1 169 169 ALA N N 169 121.760 121.760 123.593 -1.833 25155 13659 1 16 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.238 -0.082 25155 13660 1 16 . 1 1 169 169 ALA C C 169 179.790 179.790 179.413 0.377 25155 13661 1 16 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.661 0.139 25155 13662 1 16 . 1 1 169 169 ALA CB C 169 18.220 18.220 19.003 -0.783 25155 13663 1 16 . 1 1 169 169 ALA H H 169 7.494 7.494 7.649 -0.155 25155 13664 1 16 . 1 1 170 170 GLU N N 170 116.970 116.970 118.663 -1.693 25155 13665 1 16 . 1 1 170 170 GLU HA H 170 4.091 4.091 4.078 0.013 25155 13666 1 16 . 1 1 170 170 GLU C C 170 177.745 177.745 177.826 -0.081 25155 13667 1 16 . 1 1 170 170 GLU CA C 170 58.000 58.000 58.780 -0.780 25155 13668 1 16 . 1 1 170 170 GLU CB C 170 29.730 29.730 29.400 0.330 25155 13669 1 16 . 1 1 171 171 HIS N N 171 118.150 118.150 118.409 -0.259 25155 13670 1 16 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.341 0.129 25155 13671 1 16 . 1 1 171 171 HIS C C 171 175.848 175.848 176.356 -0.508 25155 13672 1 16 . 1 1 171 171 HIS CA C 171 57.600 57.600 58.460 -0.860 25155 13673 1 16 . 1 1 171 171 HIS CB C 171 30.800 30.800 29.812 0.988 25155 13674 1 16 . 1 1 171 171 HIS H H 171 7.717 7.717 7.953 -0.236 25155 13675 1 16 . 1 1 172 172 TYR N N 172 119.483 119.483 118.424 1.059 25155 13676 1 16 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.238 0.353 25155 13677 1 16 . 1 1 172 172 TYR C C 172 174.590 174.590 176.038 -1.448 25155 13678 1 16 . 1 1 172 172 TYR CA C 172 57.813 57.813 58.989 -1.176 25155 13679 1 16 . 1 1 172 172 TYR CB C 172 38.900 38.900 38.796 0.104 25155 13680 1 16 . 1 1 172 172 TYR H H 172 7.778 7.778 7.553 0.225 25155 13681 1 17 . 1 1 2 2 ASN N N 2 122.966 122.966 126.007 -3.041 25155 13682 1 17 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.372 -0.197 25155 13683 1 17 . 1 1 2 2 ASN C C 2 175.200 175.200 173.754 1.446 25155 13684 1 17 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.128 0.792 25155 13685 1 17 . 1 1 2 2 ASN CB C 2 40.000 40.000 42.976 -2.976 25155 13686 1 17 . 1 1 2 2 ASN H H 2 9.392 9.392 9.144 0.248 25155 13687 1 17 . 1 1 3 3 MET N N 3 120.660 120.660 121.484 -0.824 25155 13688 1 17 . 1 1 3 3 MET HA H 3 5.565 5.565 5.126 0.439 25155 13689 1 17 . 1 1 3 3 MET C C 3 174.200 174.200 175.446 -1.246 25155 13690 1 17 . 1 1 3 3 MET CA C 3 54.550 54.550 54.220 0.330 25155 13691 1 17 . 1 1 3 3 MET CB C 3 34.100 34.100 34.967 -0.867 25155 13692 1 17 . 1 1 3 3 MET H H 3 8.745 8.745 8.909 -0.164 25155 13693 1 17 . 1 1 4 4 GLY N N 4 115.792 115.792 110.035 5.757 25155 13694 1 17 . 1 1 4 4 GLY C C 4 170.444 170.444 171.965 -1.521 25155 13695 1 17 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.264 -0.377 25155 13696 1 17 . 1 1 4 4 GLY H H 4 8.989 8.989 8.959 0.030 25155 13697 1 17 . 1 1 5 5 LEU N N 5 131.175 131.175 125.022 6.153 25155 13698 1 17 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.334 0.988 25155 13699 1 17 . 1 1 5 5 LEU C C 5 175.700 175.700 174.732 0.968 25155 13700 1 17 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.649 -0.329 25155 13701 1 17 . 1 1 5 5 LEU CB C 5 44.700 44.700 43.855 0.845 25155 13702 1 17 . 1 1 5 5 LEU H H 5 8.917 8.917 8.101 0.816 25155 13703 1 17 . 1 1 6 6 PHE N N 6 125.990 125.990 125.247 0.743 25155 13704 1 17 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.880 -0.142 25155 13705 1 17 . 1 1 6 6 PHE C C 6 174.358 174.358 173.551 0.807 25155 13706 1 17 . 1 1 6 6 PHE CA C 6 55.480 55.480 55.007 0.473 25155 13707 1 17 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.409 -0.359 25155 13708 1 17 . 1 1 6 6 PHE H H 6 9.225 9.225 9.335 -0.110 25155 13709 1 17 . 1 1 7 7 TYR N N 7 118.040 118.040 117.557 0.483 25155 13710 1 17 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.829 0.100 25155 13711 1 17 . 1 1 7 7 TYR C C 7 171.690 171.690 173.789 -2.099 25155 13712 1 17 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.130 -0.670 25155 13713 1 17 . 1 1 7 7 TYR CB C 7 40.800 40.800 40.933 -0.133 25155 13714 1 17 . 1 1 7 7 TYR H H 7 8.235 8.235 8.184 0.051 25155 13715 1 17 . 1 1 8 8 GLY N N 8 106.640 106.640 105.652 0.988 25155 13716 1 17 . 1 1 8 8 GLY C C 8 171.682 171.682 172.081 -0.399 25155 13717 1 17 . 1 1 8 8 GLY CA C 8 44.050 44.050 44.718 -0.668 25155 13718 1 17 . 1 1 8 8 GLY H H 8 6.996 6.996 8.176 -1.180 25155 13719 1 17 . 1 1 9 9 SER N N 9 118.164 118.164 116.276 1.888 25155 13720 1 17 . 1 1 9 9 SER C C 9 174.560 174.560 172.888 1.672 25155 13721 1 17 . 1 1 9 9 SER CA C 9 57.140 57.140 57.288 -0.149 25155 13722 1 17 . 1 1 9 9 SER H H 9 9.680 9.680 8.485 1.195 25155 13723 1 17 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.816 -0.186 25155 13724 1 17 . 1 1 17 17 ALA C C 17 177.740 177.740 178.622 -0.882 25155 13725 1 17 . 1 1 17 17 ALA CA C 17 54.900 54.900 55.191 -0.291 25155 13726 1 17 . 1 1 17 17 ALA CB C 17 17.790 17.790 17.964 -0.174 25155 13727 1 17 . 1 1 17 17 ALA H H 17 8.055 8.055 7.495 0.560 25155 13728 1 17 . 1 1 18 18 ALA N N 18 120.026 120.026 120.033 -0.007 25155 13729 1 17 . 1 1 18 18 ALA HA H 18 3.713 3.713 3.845 -0.132 25155 13730 1 17 . 1 1 18 18 ALA C C 18 179.040 179.040 179.550 -0.510 25155 13731 1 17 . 1 1 18 18 ALA CA C 18 54.860 54.860 55.117 -0.257 25155 13732 1 17 . 1 1 18 18 ALA CB C 18 18.200 18.200 17.586 0.614 25155 13733 1 17 . 1 1 18 18 ALA H H 18 7.015 7.015 7.704 -0.689 25155 13734 1 17 . 1 1 19 19 GLU N N 19 116.656 116.656 118.686 -2.030 25155 13735 1 17 . 1 1 19 19 GLU HA H 19 3.580 3.580 3.986 -0.406 25155 13736 1 17 . 1 1 19 19 GLU C C 19 178.487 178.487 179.297 -0.810 25155 13737 1 17 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.759 -0.089 25155 13738 1 17 . 1 1 19 19 GLU CB C 19 29.400 29.400 29.360 0.040 25155 13739 1 17 . 1 1 20 20 LYS N N 20 120.100 120.100 119.829 0.271 25155 13740 1 17 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.060 0.286 25155 13741 1 17 . 1 1 20 20 LYS C C 20 175.330 175.330 179.133 -3.803 25155 13742 1 17 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.412 -2.312 25155 13743 1 17 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.496 0.504 25155 13744 1 17 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.623 -0.158 25155 13745 1 17 . 1 1 21 21 ILE C C 21 177.680 177.680 177.959 -0.279 25155 13746 1 17 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.695 -0.055 25155 13747 1 17 . 1 1 21 21 ILE CB C 21 38.030 38.030 37.841 0.189 25155 13748 1 17 . 1 1 21 21 ILE H H 21 8.220 8.220 8.605 -0.385 25155 13749 1 17 . 1 1 22 22 ARG N N 22 119.433 119.433 119.781 -0.348 25155 13750 1 17 . 1 1 22 22 ARG HA H 22 3.550 3.550 3.884 -0.334 25155 13751 1 17 . 1 1 22 22 ARG C C 22 177.268 177.268 178.272 -1.004 25155 13752 1 17 . 1 1 22 22 ARG CA C 22 59.760 59.760 59.714 0.046 25155 13753 1 17 . 1 1 22 22 ARG CB C 22 28.900 28.900 29.869 -0.969 25155 13754 1 17 . 1 1 23 23 ASP N N 23 118.945 118.945 119.479 -0.534 25155 13755 1 17 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.439 -0.097 25155 13756 1 17 . 1 1 23 23 ASP C C 23 178.470 178.470 178.883 -0.413 25155 13757 1 17 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.248 0.202 25155 13758 1 17 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.859 -0.489 25155 13759 1 17 . 1 1 24 24 ILE N N 24 121.200 121.200 119.289 1.911 25155 13760 1 17 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.812 -0.079 25155 13761 1 17 . 1 1 24 24 ILE C C 24 178.297 178.297 177.867 0.430 25155 13762 1 17 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.653 -0.152 25155 13763 1 17 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.482 0.258 25155 13764 1 17 . 1 1 24 24 ILE H H 24 8.160 8.160 8.011 0.149 25155 13765 1 17 . 1 1 25 25 ILE N N 25 121.166 121.166 117.805 3.361 25155 13766 1 17 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.866 -0.223 25155 13767 1 17 . 1 1 25 25 ILE C C 25 176.825 176.825 176.659 0.166 25155 13768 1 17 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.159 2.731 25155 13769 1 17 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.800 -1.050 25155 13770 1 17 . 1 1 25 25 ILE H H 25 8.480 8.480 8.078 0.402 25155 13771 1 17 . 1 1 26 26 GLY N N 26 109.050 109.050 104.832 4.218 25155 13772 1 17 . 1 1 26 26 GLY C C 26 173.800 173.800 172.582 1.218 25155 13773 1 17 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.461 -0.060 25155 13774 1 17 . 1 1 26 26 GLY H H 26 7.945 7.945 7.733 0.212 25155 13775 1 17 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.446 -0.083 25155 13776 1 17 . 1 1 27 27 PRO C C 27 177.157 177.157 177.004 0.153 25155 13777 1 17 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.748 0.782 25155 13778 1 17 . 1 1 27 27 PRO CB C 27 32.000 32.000 32.129 -0.129 25155 13779 1 17 . 1 1 28 28 GLU N N 28 116.510 116.510 116.809 -0.299 25155 13780 1 17 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.214 0.046 25155 13781 1 17 . 1 1 28 28 GLU C C 28 177.000 177.000 176.976 0.024 25155 13782 1 17 . 1 1 28 28 GLU CA C 28 57.680 57.680 57.827 -0.147 25155 13783 1 17 . 1 1 28 28 GLU CB C 28 28.620 28.620 29.187 -0.567 25155 13784 1 17 . 1 1 29 29 LEU N N 29 120.334 120.334 112.384 7.950 25155 13785 1 17 . 1 1 29 29 LEU HA H 29 4.650 4.650 5.025 -0.375 25155 13786 1 17 . 1 1 29 29 LEU C C 29 175.676 175.676 174.938 0.738 25155 13787 1 17 . 1 1 29 29 LEU CA C 29 55.924 55.924 54.679 1.245 25155 13788 1 17 . 1 1 29 29 LEU CB C 29 44.880 44.880 44.494 0.386 25155 13789 1 17 . 1 1 29 29 LEU H H 29 7.924 7.924 7.550 0.374 25155 13790 1 17 . 1 1 30 30 VAL N N 30 118.900 118.900 120.707 -1.807 25155 13791 1 17 . 1 1 30 30 VAL HA H 30 4.639 4.639 5.038 -0.399 25155 13792 1 17 . 1 1 30 30 VAL C C 30 174.368 174.368 175.577 -1.209 25155 13793 1 17 . 1 1 30 30 VAL CA C 30 61.110 61.110 60.781 0.329 25155 13794 1 17 . 1 1 30 30 VAL CB C 30 34.500 34.500 35.322 -0.822 25155 13795 1 17 . 1 1 30 30 VAL H H 30 7.486 7.486 7.459 0.027 25155 13796 1 17 . 1 1 31 31 THR N N 31 124.000 124.000 120.080 3.920 25155 13797 1 17 . 1 1 31 31 THR HA H 31 4.331 4.331 4.704 -0.373 25155 13798 1 17 . 1 1 31 31 THR C C 31 172.670 172.670 172.743 -0.073 25155 13799 1 17 . 1 1 31 31 THR CA C 31 61.784 61.784 61.434 0.350 25155 13800 1 17 . 1 1 31 31 THR CB C 31 70.483 70.483 71.164 -0.681 25155 13801 1 17 . 1 1 31 31 THR H H 31 7.947 7.947 8.649 -0.702 25155 13802 1 17 . 1 1 32 32 LEU N N 32 127.408 127.408 125.030 2.378 25155 13803 1 17 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.498 0.139 25155 13804 1 17 . 1 1 32 32 LEU C C 32 176.425 176.425 177.303 -0.878 25155 13805 1 17 . 1 1 32 32 LEU CA C 32 54.760 54.760 55.042 -0.282 25155 13806 1 17 . 1 1 32 32 LEU CB C 32 43.809 43.809 43.041 0.768 25155 13807 1 17 . 1 1 32 32 LEU H H 32 8.614 8.614 8.557 0.057 25155 13808 1 17 . 1 1 33 33 HIS N N 33 120.230 120.230 124.150 -3.920 25155 13809 1 17 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.968 -0.548 25155 13810 1 17 . 1 1 33 33 HIS C C 33 171.914 171.914 173.871 -1.957 25155 13811 1 17 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.778 0.522 25155 13812 1 17 . 1 1 33 33 HIS CB C 33 32.050 32.050 30.473 1.577 25155 13813 1 17 . 1 1 33 33 HIS H H 33 9.130 9.130 9.208 -0.078 25155 13814 1 17 . 1 1 34 34 ASN N N 34 123.987 123.987 122.128 1.859 25155 13815 1 17 . 1 1 34 34 ASN HA H 34 3.600 3.600 3.974 -0.374 25155 13816 1 17 . 1 1 34 34 ASN C C 34 177.930 177.930 175.652 2.278 25155 13817 1 17 . 1 1 34 34 ASN CA C 34 51.730 51.730 52.097 -0.367 25155 13818 1 17 . 1 1 34 34 ASN CB C 34 38.747 38.747 38.388 0.359 25155 13819 1 17 . 1 1 34 34 ASN H H 34 8.759 8.759 8.029 0.730 25155 13820 1 17 . 1 1 35 35 LEU N N 35 128.751 128.751 126.256 2.495 25155 13821 1 17 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.166 0.124 25155 13822 1 17 . 1 1 35 35 LEU C C 35 177.363 177.363 178.011 -0.648 25155 13823 1 17 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.204 0.346 25155 13824 1 17 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.492 1.270 25155 13825 1 17 . 1 1 35 35 LEU H H 35 8.758 8.758 8.554 0.204 25155 13826 1 17 . 1 1 36 36 LYS N N 36 120.870 120.870 118.694 2.176 25155 13827 1 17 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.212 -0.279 25155 13828 1 17 . 1 1 36 36 LYS C C 36 176.540 176.540 177.060 -0.520 25155 13829 1 17 . 1 1 36 36 LYS CA C 36 59.260 59.260 58.138 1.122 25155 13830 1 17 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.539 0.261 25155 13831 1 17 . 1 1 37 37 ASP N N 37 115.288 115.288 115.752 -0.464 25155 13832 1 17 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.746 0.001 25155 13833 1 17 . 1 1 37 37 ASP C C 37 175.500 175.500 176.136 -0.636 25155 13834 1 17 . 1 1 37 37 ASP CA C 37 54.805 54.805 54.666 0.139 25155 13835 1 17 . 1 1 37 37 ASP CB C 37 44.650 44.650 43.497 1.153 25155 13836 1 17 . 1 1 38 38 ASP N N 38 121.550 121.550 121.381 0.169 25155 13837 1 17 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.875 -0.010 25155 13838 1 17 . 1 1 38 38 ASP C C 38 174.895 174.895 175.956 -1.061 25155 13839 1 17 . 1 1 38 38 ASP CA C 38 52.840 52.840 54.307 -1.467 25155 13840 1 17 . 1 1 38 38 ASP CB C 38 42.240 42.240 42.248 -0.008 25155 13841 1 17 . 1 1 39 39 SER N N 39 115.170 115.170 117.893 -2.723 25155 13842 1 17 . 1 1 39 39 SER HA H 39 4.600 4.600 4.667 -0.067 25155 13843 1 17 . 1 1 39 39 SER C C 39 174.930 174.930 174.332 0.598 25155 13844 1 17 . 1 1 39 39 SER CA C 39 54.786 54.786 56.693 -1.907 25155 13845 1 17 . 1 1 39 39 SER CB C 39 64.840 64.840 63.444 1.396 25155 13846 1 17 . 1 1 39 39 SER H H 39 8.330 8.330 8.648 -0.318 25155 13847 1 17 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.442 -0.442 25155 13848 1 17 . 1 1 40 40 PRO C C 40 176.620 176.620 178.214 -1.594 25155 13849 1 17 . 1 1 40 40 PRO CA C 40 63.870 63.870 64.838 -0.968 25155 13850 1 17 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.884 -0.524 25155 13851 1 17 . 1 1 41 41 LYS N N 41 120.913 120.913 118.905 2.008 25155 13852 1 17 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.104 -0.208 25155 13853 1 17 . 1 1 41 41 LYS C C 41 179.580 179.580 178.593 0.987 25155 13854 1 17 . 1 1 41 41 LYS CA C 41 58.000 58.000 58.877 -0.876 25155 13855 1 17 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.109 0.991 25155 13856 1 17 . 1 1 42 42 LEU N N 42 118.206 118.206 120.043 -1.837 25155 13857 1 17 . 1 1 42 42 LEU HA H 42 4.025 4.025 3.870 0.155 25155 13858 1 17 . 1 1 42 42 LEU C C 42 178.630 178.630 178.093 0.537 25155 13859 1 17 . 1 1 42 42 LEU CA C 42 57.030 57.030 57.104 -0.074 25155 13860 1 17 . 1 1 42 42 LEU CB C 42 41.820 41.820 40.880 0.940 25155 13861 1 17 . 1 1 42 42 LEU H H 42 7.598 7.598 7.543 0.055 25155 13862 1 17 . 1 1 43 43 MET N N 43 118.913 118.913 116.819 2.094 25155 13863 1 17 . 1 1 43 43 MET HA H 43 3.760 3.760 4.109 -0.349 25155 13864 1 17 . 1 1 43 43 MET C C 43 177.710 177.710 177.745 -0.035 25155 13865 1 17 . 1 1 43 43 MET CA C 43 59.864 59.864 58.277 1.587 25155 13866 1 17 . 1 1 43 43 MET CB C 43 32.680 32.680 31.892 0.788 25155 13867 1 17 . 1 1 43 43 MET H H 43 8.180 8.180 8.008 0.172 25155 13868 1 17 . 1 1 44 44 GLU N N 44 110.906 110.906 117.765 -6.859 25155 13869 1 17 . 1 1 44 44 GLU HA H 44 3.732 3.732 3.996 -0.264 25155 13870 1 17 . 1 1 44 44 GLU C C 44 178.120 178.120 178.725 -0.605 25155 13871 1 17 . 1 1 44 44 GLU CA C 44 59.450 59.450 58.943 0.507 25155 13872 1 17 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.466 0.334 25155 13873 1 17 . 1 1 45 45 GLN N N 45 115.770 115.770 117.728 -1.958 25155 13874 1 17 . 1 1 45 45 GLN HA H 45 4.190 4.190 3.948 0.242 25155 13875 1 17 . 1 1 45 45 GLN C C 45 175.480 175.480 176.425 -0.945 25155 13876 1 17 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.299 -1.199 25155 13877 1 17 . 1 1 45 45 GLN CB C 45 28.490 28.490 28.683 -0.193 25155 13878 1 17 . 1 1 45 45 GLN H H 45 7.517 7.517 7.352 0.165 25155 13879 1 17 . 1 1 46 46 TYR N N 46 117.840 117.840 118.076 -0.236 25155 13880 1 17 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.351 0.309 25155 13881 1 17 . 1 1 46 46 TYR C C 46 175.480 175.480 176.728 -1.248 25155 13882 1 17 . 1 1 46 46 TYR CA C 46 58.827 58.827 57.921 0.906 25155 13883 1 17 . 1 1 46 46 TYR CB C 46 41.720 41.720 38.376 3.344 25155 13884 1 17 . 1 1 46 46 TYR H H 46 6.955 6.955 7.160 -0.205 25155 13885 1 17 . 1 1 47 47 ASP N N 47 121.540 121.540 121.594 -0.054 25155 13886 1 17 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.666 0.030 25155 13887 1 17 . 1 1 47 47 ASP C C 47 175.677 175.677 176.053 -0.376 25155 13888 1 17 . 1 1 47 47 ASP CA C 47 56.812 56.812 57.664 -0.852 25155 13889 1 17 . 1 1 47 47 ASP CB C 47 42.978 42.978 42.079 0.899 25155 13890 1 17 . 1 1 48 48 VAL N N 48 118.666 118.666 117.402 1.264 25155 13891 1 17 . 1 1 48 48 VAL HA H 48 5.057 5.057 4.946 0.111 25155 13892 1 17 . 1 1 48 48 VAL C C 48 174.180 174.180 174.194 -0.014 25155 13893 1 17 . 1 1 48 48 VAL CA C 48 60.000 60.000 60.940 -0.940 25155 13894 1 17 . 1 1 48 48 VAL CB C 48 36.200 36.200 34.899 1.301 25155 13895 1 17 . 1 1 48 48 VAL H H 48 7.631 7.631 7.975 -0.344 25155 13896 1 17 . 1 1 49 49 LEU N N 49 128.300 128.300 127.397 0.903 25155 13897 1 17 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.110 0.490 25155 13898 1 17 . 1 1 49 49 LEU C C 49 174.810 174.810 175.093 -0.283 25155 13899 1 17 . 1 1 49 49 LEU CA C 49 52.230 52.230 53.933 -1.703 25155 13900 1 17 . 1 1 49 49 LEU CB C 49 45.400 45.400 45.353 0.047 25155 13901 1 17 . 1 1 49 49 LEU H H 49 9.469 9.469 8.802 0.667 25155 13902 1 17 . 1 1 50 50 ILE N N 50 124.400 124.400 127.882 -3.482 25155 13903 1 17 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.426 1.224 25155 13904 1 17 . 1 1 50 50 ILE C C 50 175.286 175.286 174.313 0.973 25155 13905 1 17 . 1 1 50 50 ILE CA C 50 59.900 59.900 61.601 -1.701 25155 13906 1 17 . 1 1 50 50 ILE CB C 50 40.200 40.200 39.411 0.789 25155 13907 1 17 . 1 1 50 50 ILE H H 50 9.213 9.213 9.298 -0.085 25155 13908 1 17 . 1 1 51 51 LEU N N 51 127.410 127.410 128.628 -1.218 25155 13909 1 17 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.210 1.860 25155 13910 1 17 . 1 1 51 51 LEU C C 51 174.540 174.540 175.526 -0.986 25155 13911 1 17 . 1 1 51 51 LEU CA C 51 52.950 52.950 53.285 -0.335 25155 13912 1 17 . 1 1 51 51 LEU CB C 51 43.190 43.190 43.236 -0.046 25155 13913 1 17 . 1 1 51 51 LEU H H 51 9.256 9.256 8.755 0.501 25155 13914 1 17 . 1 1 52 52 GLY N N 52 108.290 108.290 111.346 -3.056 25155 13915 1 17 . 1 1 52 52 GLY C C 52 174.330 174.330 171.518 2.812 25155 13916 1 17 . 1 1 52 52 GLY CA C 52 44.040 44.040 42.980 1.060 25155 13917 1 17 . 1 1 52 52 GLY H H 52 8.949 8.949 8.800 0.149 25155 13918 1 17 . 1 1 53 53 ILE N N 53 124.912 124.912 122.763 2.149 25155 13919 1 17 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.323 -0.148 25155 13920 1 17 . 1 1 53 53 ILE C C 53 174.470 174.470 172.439 2.031 25155 13921 1 17 . 1 1 53 53 ILE CA C 53 55.850 55.850 57.707 -1.857 25155 13922 1 17 . 1 1 53 53 ILE CB C 53 42.800 42.800 42.031 0.769 25155 13923 1 17 . 1 1 53 53 ILE H H 53 8.612 8.612 7.467 1.145 25155 13924 1 17 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.487 0.325 25155 13925 1 17 . 1 1 54 54 PRO C C 54 174.565 174.565 175.037 -0.472 25155 13926 1 17 . 1 1 54 54 PRO CA C 54 61.850 61.850 61.656 0.194 25155 13927 1 17 . 1 1 54 54 PRO CB C 54 32.400 32.400 31.446 0.954 25155 13928 1 17 . 1 1 55 55 THR N N 55 116.040 116.040 116.079 -0.039 25155 13929 1 17 . 1 1 55 55 THR HA H 55 4.522 4.522 4.543 -0.021 25155 13930 1 17 . 1 1 55 55 THR C C 55 173.990 173.990 173.996 -0.006 25155 13931 1 17 . 1 1 55 55 THR CA C 55 62.845 62.845 60.905 1.940 25155 13932 1 17 . 1 1 55 55 THR CB C 55 70.795 70.795 70.163 0.632 25155 13933 1 17 . 1 1 55 55 THR H H 55 7.663 7.663 8.035 -0.372 25155 13934 1 17 . 1 1 56 56 TRP N N 56 130.540 130.540 129.572 0.968 25155 13935 1 17 . 1 1 56 56 TRP CA C 56 54.800 54.800 57.459 -2.659 25155 13936 1 17 . 1 1 56 56 TRP H H 56 9.075 9.075 8.774 0.301 25155 13937 1 17 . 1 1 58 58 PHE HA H 58 4.540 4.540 4.977 -0.437 25155 13938 1 17 . 1 1 58 58 PHE C C 58 177.070 177.070 176.615 0.455 25155 13939 1 17 . 1 1 58 58 PHE CA C 58 55.460 55.460 57.264 -1.804 25155 13940 1 17 . 1 1 58 58 PHE CB C 58 41.200 41.200 39.355 1.845 25155 13941 1 17 . 1 1 59 59 GLY N N 59 109.796 109.796 109.120 0.676 25155 13942 1 17 . 1 1 59 59 GLY CA C 59 45.763 45.763 44.846 0.917 25155 13943 1 17 . 1 1 59 59 GLY H H 59 8.392 8.392 7.543 0.849 25155 13944 1 17 . 1 1 60 60 GLU C C 60 175.660 175.660 175.994 -0.334 25155 13945 1 17 . 1 1 61 61 ILE N N 61 122.380 122.380 121.155 1.225 25155 13946 1 17 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.589 0.851 25155 13947 1 17 . 1 1 61 61 ILE CA C 61 62.100 62.100 62.390 -0.290 25155 13948 1 17 . 1 1 61 61 ILE CB C 61 38.750 38.750 37.663 1.087 25155 13949 1 17 . 1 1 61 61 ILE H H 61 8.436 8.436 8.359 0.077 25155 13950 1 17 . 1 1 62 62 GLN CB C 62 30.570 30.570 29.606 0.964 25155 13951 1 17 . 1 1 63 63 GLU HA H 63 4.030 4.030 3.997 0.033 25155 13952 1 17 . 1 1 63 63 GLU C C 63 177.134 177.134 178.001 -0.867 25155 13953 1 17 . 1 1 63 63 GLU CA C 63 60.520 60.520 59.645 0.875 25155 13954 1 17 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.768 -0.118 25155 13955 1 17 . 1 1 64 64 ASP N N 64 119.630 119.630 118.126 1.504 25155 13956 1 17 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.515 0.077 25155 13957 1 17 . 1 1 64 64 ASP C C 64 178.680 178.680 177.328 1.352 25155 13958 1 17 . 1 1 64 64 ASP CA C 64 57.823 57.823 57.120 0.703 25155 13959 1 17 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.862 0.238 25155 13960 1 17 . 1 1 65 65 TRP N N 65 120.535 120.535 121.199 -0.664 25155 13961 1 17 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.583 -0.258 25155 13962 1 17 . 1 1 65 65 TRP C C 65 178.684 178.684 177.476 1.208 25155 13963 1 17 . 1 1 65 65 TRP CA C 65 60.500 60.500 59.980 0.520 25155 13964 1 17 . 1 1 65 65 TRP CB C 65 30.100 30.100 31.476 -1.376 25155 13965 1 17 . 1 1 65 65 TRP H H 65 7.416 7.416 7.846 -0.430 25155 13966 1 17 . 1 1 66 66 GLU N N 66 120.760 120.760 120.920 -0.160 25155 13967 1 17 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.295 -0.475 25155 13968 1 17 . 1 1 66 66 GLU C C 66 178.860 178.860 178.880 -0.020 25155 13969 1 17 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.876 0.224 25155 13970 1 17 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.599 -0.588 25155 13971 1 17 . 1 1 67 67 ALA N N 67 118.972 118.972 122.067 -3.095 25155 13972 1 17 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.230 0.017 25155 13973 1 17 . 1 1 67 67 ALA C C 67 179.610 179.610 179.000 0.610 25155 13974 1 17 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.895 -0.295 25155 13975 1 17 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.854 -0.066 25155 13976 1 17 . 1 1 67 67 ALA H H 67 7.690 7.690 8.578 -0.888 25155 13977 1 17 . 1 1 68 68 VAL N N 68 107.530 107.530 111.415 -3.885 25155 13978 1 17 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.342 0.368 25155 13979 1 17 . 1 1 68 68 VAL C C 68 176.800 176.800 177.200 -0.400 25155 13980 1 17 . 1 1 68 68 VAL CA C 68 60.060 60.060 62.149 -2.089 25155 13981 1 17 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.259 0.341 25155 13982 1 17 . 1 1 68 68 VAL H H 68 7.240 7.240 7.523 -0.283 25155 13983 1 17 . 1 1 69 69 TRP N N 69 126.960 126.960 125.878 1.082 25155 13984 1 17 . 1 1 69 69 TRP HA H 69 4.182 4.182 4.084 0.098 25155 13985 1 17 . 1 1 69 69 TRP C C 69 178.640 178.640 176.715 1.925 25155 13986 1 17 . 1 1 69 69 TRP CA C 69 61.300 61.300 62.469 -1.169 25155 13987 1 17 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.197 2.373 25155 13988 1 17 . 1 1 69 69 TRP H H 69 7.810 7.810 8.282 -0.472 25155 13989 1 17 . 1 1 70 70 ASP N N 70 114.644 114.644 116.483 -1.839 25155 13990 1 17 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.145 0.374 25155 13991 1 17 . 1 1 70 70 ASP C C 70 178.685 178.685 178.091 0.594 25155 13992 1 17 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.314 -0.314 25155 13993 1 17 . 1 1 70 70 ASP CB C 70 39.810 39.810 41.005 -1.195 25155 13994 1 17 . 1 1 71 71 GLN N N 71 120.100 120.100 117.563 2.537 25155 13995 1 17 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.251 -0.061 25155 13996 1 17 . 1 1 71 71 GLN C C 71 178.870 178.870 177.920 0.950 25155 13997 1 17 . 1 1 71 71 GLN CA C 71 57.617 57.617 56.900 0.717 25155 13998 1 17 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.452 -0.632 25155 13999 1 17 . 1 1 71 71 GLN H H 71 7.980 7.980 7.938 0.042 25155 14000 1 17 . 1 1 72 72 LEU N N 72 117.535 117.535 118.315 -0.780 25155 14001 1 17 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.980 -0.183 25155 14002 1 17 . 1 1 72 72 LEU C C 72 178.308 178.308 177.596 0.712 25155 14003 1 17 . 1 1 72 72 LEU CA C 72 57.340 57.340 56.548 0.792 25155 14004 1 17 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.582 0.118 25155 14005 1 17 . 1 1 72 72 LEU H H 72 7.435 7.435 7.432 0.003 25155 14006 1 17 . 1 1 73 73 ASP N N 73 115.534 115.534 116.751 -1.217 25155 14007 1 17 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.460 -0.310 25155 14008 1 17 . 1 1 73 73 ASP C C 73 177.553 177.553 177.144 0.409 25155 14009 1 17 . 1 1 73 73 ASP CA C 73 57.350 57.350 55.699 1.651 25155 14010 1 17 . 1 1 73 73 ASP CB C 73 40.040 40.040 41.632 -1.592 25155 14011 1 17 . 1 1 74 74 ASP N N 74 117.300 117.300 120.544 -3.244 25155 14012 1 17 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.446 0.260 25155 14013 1 17 . 1 1 74 74 ASP C C 74 176.424 176.424 177.189 -0.765 25155 14014 1 17 . 1 1 74 74 ASP CA C 74 54.170 54.170 55.337 -1.167 25155 14015 1 17 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.276 0.543 25155 14016 1 17 . 1 1 75 75 LEU N N 75 118.500 118.500 120.579 -2.079 25155 14017 1 17 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.135 0.160 25155 14018 1 17 . 1 1 75 75 LEU C C 75 176.800 176.800 176.241 0.559 25155 14019 1 17 . 1 1 75 75 LEU CA C 75 54.400 54.400 55.118 -0.718 25155 14020 1 17 . 1 1 75 75 LEU CB C 75 43.280 43.280 41.829 1.451 25155 14021 1 17 . 1 1 75 75 LEU H H 75 6.966 6.966 7.769 -0.803 25155 14022 1 17 . 1 1 76 76 ASN N N 76 123.040 123.040 121.420 1.620 25155 14023 1 17 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.633 0.229 25155 14024 1 17 . 1 1 76 76 ASN C C 76 174.927 174.927 174.028 0.899 25155 14025 1 17 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.283 -1.402 25155 14026 1 17 . 1 1 76 76 ASN CB C 76 37.510 37.510 38.269 -0.759 25155 14027 1 17 . 1 1 76 76 ASN H H 76 9.882 9.882 8.925 0.957 25155 14028 1 17 . 1 1 77 77 LEU N N 77 123.614 123.614 119.428 4.186 25155 14029 1 17 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.792 -0.422 25155 14030 1 17 . 1 1 77 77 LEU C C 77 175.110 175.110 174.233 0.877 25155 14031 1 17 . 1 1 77 77 LEU CA C 77 52.200 52.200 54.096 -1.895 25155 14032 1 17 . 1 1 77 77 LEU CB C 77 42.786 42.786 44.579 -1.793 25155 14033 1 17 . 1 1 77 77 LEU H H 77 8.700 8.700 7.458 1.242 25155 14034 1 17 . 1 1 78 78 GLU N N 78 120.822 120.822 124.179 -3.357 25155 14035 1 17 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.666 -0.766 25155 14036 1 17 . 1 1 78 78 GLU C C 78 178.670 178.670 176.533 2.137 25155 14037 1 17 . 1 1 78 78 GLU CA C 78 58.700 58.700 55.328 3.372 25155 14038 1 17 . 1 1 78 78 GLU CB C 78 29.467 29.467 32.595 -3.128 25155 14039 1 17 . 1 1 79 79 GLY N N 79 113.160 113.160 112.960 0.200 25155 14040 1 17 . 1 1 79 79 GLY C C 79 174.523 174.523 173.381 1.142 25155 14041 1 17 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.836 -0.416 25155 14042 1 17 . 1 1 79 79 GLY H H 79 8.450 8.450 8.348 0.102 25155 14043 1 17 . 1 1 80 80 LYS N N 80 120.283 120.283 119.122 1.161 25155 14044 1 17 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.252 0.106 25155 14045 1 17 . 1 1 80 80 LYS C C 80 175.304 175.304 175.505 -0.201 25155 14046 1 17 . 1 1 80 80 LYS CA C 80 56.890 56.890 55.664 1.226 25155 14047 1 17 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.463 -0.343 25155 14048 1 17 . 1 1 81 81 ILE N N 81 122.288 122.288 120.406 1.882 25155 14049 1 17 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.412 0.394 25155 14050 1 17 . 1 1 81 81 ILE C C 81 174.750 174.750 175.380 -0.630 25155 14051 1 17 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.530 -1.710 25155 14052 1 17 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.080 0.770 25155 14053 1 17 . 1 1 81 81 ILE H H 81 7.405 7.405 7.865 -0.460 25155 14054 1 17 . 1 1 82 82 VAL N N 82 127.793 127.793 126.167 1.626 25155 14055 1 17 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.113 0.167 25155 14056 1 17 . 1 1 82 82 VAL C C 82 172.680 172.680 174.358 -1.678 25155 14057 1 17 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.099 0.001 25155 14058 1 17 . 1 1 82 82 VAL CB C 82 35.280 35.280 35.602 -0.322 25155 14059 1 17 . 1 1 82 82 VAL H H 82 8.800 8.800 9.017 -0.217 25155 14060 1 17 . 1 1 83 83 ALA N N 83 130.911 130.911 129.416 1.495 25155 14061 1 17 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.747 -0.358 25155 14062 1 17 . 1 1 83 83 ALA C C 83 175.870 175.870 176.204 -0.334 25155 14063 1 17 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.355 0.645 25155 14064 1 17 . 1 1 83 83 ALA CB C 83 23.722 23.722 22.598 1.124 25155 14065 1 17 . 1 1 83 83 ALA H H 83 9.252 9.252 8.862 0.390 25155 14066 1 17 . 1 1 84 84 LEU N N 84 124.269 124.269 121.532 2.737 25155 14067 1 17 . 1 1 84 84 LEU HA H 84 5.508 5.508 5.506 0.002 25155 14068 1 17 . 1 1 84 84 LEU C C 84 175.490 175.490 175.416 0.074 25155 14069 1 17 . 1 1 84 84 LEU CA C 84 53.670 53.670 53.916 -0.246 25155 14070 1 17 . 1 1 84 84 LEU CB C 84 45.000 45.000 46.176 -1.176 25155 14071 1 17 . 1 1 84 84 LEU H H 84 10.378 10.378 8.735 1.643 25155 14072 1 17 . 1 1 85 85 TYR N N 85 115.826 115.826 119.263 -3.437 25155 14073 1 17 . 1 1 85 85 TYR HA H 85 4.950 4.950 5.188 -0.238 25155 14074 1 17 . 1 1 85 85 TYR C C 85 172.661 172.661 173.241 -0.580 25155 14075 1 17 . 1 1 85 85 TYR CA C 85 55.853 55.853 55.346 0.507 25155 14076 1 17 . 1 1 85 85 TYR CB C 85 43.200 43.200 40.981 2.219 25155 14077 1 17 . 1 1 85 85 TYR H H 85 9.200 9.200 8.686 0.514 25155 14078 1 17 . 1 1 86 86 GLY N N 86 106.802 106.802 105.539 1.263 25155 14079 1 17 . 1 1 86 86 GLY C C 86 170.348 170.348 171.345 -0.997 25155 14080 1 17 . 1 1 86 86 GLY CA C 86 44.687 44.687 44.600 0.087 25155 14081 1 17 . 1 1 86 86 GLY H H 86 8.752 8.752 8.153 0.599 25155 14082 1 17 . 1 1 87 87 LEU N N 87 120.860 120.860 118.865 1.995 25155 14083 1 17 . 1 1 87 87 LEU HA H 87 5.476 5.476 5.266 0.210 25155 14084 1 17 . 1 1 87 87 LEU C C 87 177.720 177.720 174.842 2.878 25155 14085 1 17 . 1 1 87 87 LEU CA C 87 52.630 52.630 52.095 0.535 25155 14086 1 17 . 1 1 87 87 LEU CB C 87 45.900 45.900 45.035 0.865 25155 14087 1 17 . 1 1 87 87 LEU H H 87 6.320 6.320 7.985 -1.665 25155 14088 1 17 . 1 1 88 88 GLY N N 88 109.910 109.910 106.191 3.719 25155 14089 1 17 . 1 1 88 88 GLY C C 88 171.386 171.386 171.750 -0.364 25155 14090 1 17 . 1 1 88 88 GLY CA C 88 45.710 45.710 45.314 0.396 25155 14091 1 17 . 1 1 88 88 GLY H H 88 8.320 8.320 7.791 0.529 25155 14092 1 17 . 1 1 89 89 ASP N N 89 121.580 121.580 117.663 3.917 25155 14093 1 17 . 1 1 89 89 ASP HA H 89 5.190 5.190 5.310 -0.120 25155 14094 1 17 . 1 1 89 89 ASP C C 89 176.608 176.608 175.042 1.566 25155 14095 1 17 . 1 1 89 89 ASP CA C 89 52.200 52.200 51.993 0.207 25155 14096 1 17 . 1 1 89 89 ASP CB C 89 41.900 41.900 44.418 -2.518 25155 14097 1 17 . 1 1 90 90 GLN N N 90 123.900 123.900 118.644 5.256 25155 14098 1 17 . 1 1 90 90 GLN HA H 90 3.645 3.645 4.332 -0.687 25155 14099 1 17 . 1 1 90 90 GLN C C 90 173.523 173.523 175.850 -2.327 25155 14100 1 17 . 1 1 90 90 GLN CA C 90 58.706 58.706 56.242 2.464 25155 14101 1 17 . 1 1 90 90 GLN CB C 90 28.800 28.800 30.222 -1.422 25155 14102 1 17 . 1 1 90 90 GLN H H 90 8.726 8.726 8.450 0.276 25155 14103 1 17 . 1 1 91 91 LEU N N 91 117.080 117.080 121.115 -4.035 25155 14104 1 17 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.300 0.170 25155 14105 1 17 . 1 1 91 91 LEU C C 91 179.840 179.840 177.992 1.848 25155 14106 1 17 . 1 1 91 91 LEU CA C 91 55.800 55.800 55.668 0.132 25155 14107 1 17 . 1 1 91 91 LEU CB C 91 41.640 41.640 41.873 -0.233 25155 14108 1 17 . 1 1 91 91 LEU H H 91 7.092 7.092 8.705 -1.613 25155 14109 1 17 . 1 1 92 92 GLY N N 92 110.460 110.460 107.985 2.475 25155 14110 1 17 . 1 1 92 92 GLY C C 92 174.824 174.824 174.106 0.718 25155 14111 1 17 . 1 1 92 92 GLY CA C 92 46.390 46.390 47.028 -0.638 25155 14112 1 17 . 1 1 92 92 GLY H H 92 9.243 9.243 8.862 0.381 25155 14113 1 17 . 1 1 93 93 TYR N N 93 118.140 118.140 119.234 -1.094 25155 14114 1 17 . 1 1 93 93 TYR HA H 93 5.173 5.173 4.310 0.863 25155 14115 1 17 . 1 1 93 93 TYR C C 93 177.805 177.805 176.275 1.530 25155 14116 1 17 . 1 1 93 93 TYR CA C 93 57.430 57.430 59.178 -1.748 25155 14117 1 17 . 1 1 93 93 TYR CB C 93 39.300 39.300 40.247 -0.947 25155 14118 1 17 . 1 1 93 93 TYR H H 93 7.252 7.252 8.610 -1.358 25155 14119 1 17 . 1 1 94 94 GLY N N 94 112.455 112.455 107.938 4.517 25155 14120 1 17 . 1 1 94 94 GLY C C 94 177.740 177.740 175.556 2.184 25155 14121 1 17 . 1 1 94 94 GLY CA C 94 49.880 49.880 46.765 3.115 25155 14122 1 17 . 1 1 94 94 GLY H H 94 8.154 8.154 8.972 -0.818 25155 14123 1 17 . 1 1 95 95 GLU N N 95 123.040 123.040 122.041 0.999 25155 14124 1 17 . 1 1 95 95 GLU HA H 95 4.000 4.000 4.416 -0.416 25155 14125 1 17 . 1 1 95 95 GLU C C 95 175.145 175.145 176.985 -1.840 25155 14126 1 17 . 1 1 95 95 GLU CA C 95 57.950 57.950 57.704 0.246 25155 14127 1 17 . 1 1 95 95 GLU CB C 95 27.400 27.400 29.326 -1.926 25155 14128 1 17 . 1 1 96 96 TRP N N 96 118.000 118.000 117.209 0.791 25155 14129 1 17 . 1 1 96 96 TRP HA H 96 5.213 5.213 5.198 0.015 25155 14130 1 17 . 1 1 96 96 TRP C C 96 176.616 176.616 176.485 0.131 25155 14131 1 17 . 1 1 96 96 TRP CA C 96 57.120 57.120 54.943 2.177 25155 14132 1 17 . 1 1 96 96 TRP CB C 96 29.970 29.970 29.550 0.420 25155 14133 1 17 . 1 1 96 96 TRP H H 96 7.785 7.785 8.188 -0.403 25155 14134 1 17 . 1 1 97 97 PHE N N 97 123.268 123.268 118.806 4.462 25155 14135 1 17 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.934 -0.274 25155 14136 1 17 . 1 1 97 97 PHE CA C 97 58.742 58.742 55.438 3.304 25155 14137 1 17 . 1 1 97 97 PHE CB C 97 40.835 40.835 40.021 0.814 25155 14138 1 17 . 1 1 97 97 PHE H H 97 7.054 7.054 8.234 -1.180 25155 14139 1 17 . 1 1 98 98 LEU HA H 98 3.440 3.440 3.473 -0.033 25155 14140 1 17 . 1 1 98 98 LEU C C 98 176.613 176.613 177.696 -1.083 25155 14141 1 17 . 1 1 98 98 LEU CA C 98 56.000 56.000 55.156 0.844 25155 14142 1 17 . 1 1 98 98 LEU CB C 98 38.600 38.600 39.114 -0.514 25155 14143 1 17 . 1 1 98 98 LEU H H 98 8.584 8.584 8.621 -0.037 25155 14144 1 17 . 1 1 99 99 ASP N N 99 123.268 123.268 120.048 3.220 25155 14145 1 17 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.217 -0.252 25155 14146 1 17 . 1 1 99 99 ASP C C 99 178.876 178.876 176.855 2.021 25155 14147 1 17 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.474 1.786 25155 14148 1 17 . 1 1 99 99 ASP CB C 99 40.350 40.350 41.036 -0.686 25155 14149 1 17 . 1 1 100 100 ALA N N 100 119.124 119.124 121.385 -2.261 25155 14150 1 17 . 1 1 100 100 ALA HA H 100 3.822 3.822 3.939 -0.117 25155 14151 1 17 . 1 1 100 100 ALA C C 100 178.490 178.490 179.266 -0.776 25155 14152 1 17 . 1 1 100 100 ALA CA C 100 55.100 55.100 54.686 0.414 25155 14153 1 17 . 1 1 100 100 ALA CB C 100 19.700 19.700 17.948 1.752 25155 14154 1 17 . 1 1 100 100 ALA H H 100 8.400 8.400 7.531 0.869 25155 14155 1 17 . 1 1 101 101 LEU N N 101 118.687 118.687 119.667 -0.980 25155 14156 1 17 . 1 1 101 101 LEU HA H 101 3.674 3.674 3.859 -0.185 25155 14157 1 17 . 1 1 101 101 LEU C C 101 179.050 179.050 178.706 0.344 25155 14158 1 17 . 1 1 101 101 LEU CA C 101 57.800 57.800 56.781 1.019 25155 14159 1 17 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.550 1.100 25155 14160 1 17 . 1 1 101 101 LEU H H 101 6.518 6.518 7.082 -0.564 25155 14161 1 17 . 1 1 102 102 GLY N N 102 104.410 104.410 106.429 -2.019 25155 14162 1 17 . 1 1 102 102 GLY C C 102 176.056 176.056 175.901 0.155 25155 14163 1 17 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.027 0.723 25155 14164 1 17 . 1 1 102 102 GLY H H 102 7.712 7.712 7.954 -0.242 25155 14165 1 17 . 1 1 103 103 MET N N 103 120.550 120.550 121.575 -1.025 25155 14166 1 17 . 1 1 103 103 MET HA H 103 4.256 4.256 4.292 -0.036 25155 14167 1 17 . 1 1 103 103 MET C C 103 179.650 179.650 178.424 1.226 25155 14168 1 17 . 1 1 103 103 MET CA C 103 59.450 59.450 59.502 -0.051 25155 14169 1 17 . 1 1 103 103 MET CB C 103 32.300 32.300 32.580 -0.280 25155 14170 1 17 . 1 1 103 103 MET H H 103 8.485 8.485 8.122 0.363 25155 14171 1 17 . 1 1 104 104 LEU N N 104 123.480 123.480 119.924 3.556 25155 14172 1 17 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.309 -0.248 25155 14173 1 17 . 1 1 104 104 LEU C C 104 177.750 177.750 178.418 -0.668 25155 14174 1 17 . 1 1 104 104 LEU CA C 104 58.100 58.100 57.521 0.579 25155 14175 1 17 . 1 1 104 104 LEU CB C 104 41.450 41.450 41.241 0.209 25155 14176 1 17 . 1 1 104 104 LEU H H 104 8.392 8.392 7.810 0.582 25155 14177 1 17 . 1 1 105 105 HIS N N 105 119.570 119.570 120.393 -0.823 25155 14178 1 17 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.242 -0.390 25155 14179 1 17 . 1 1 105 105 HIS C C 105 177.550 177.550 177.345 0.205 25155 14180 1 17 . 1 1 105 105 HIS CA C 105 61.000 61.000 60.922 0.078 25155 14181 1 17 . 1 1 105 105 HIS CB C 105 28.820 28.820 30.083 -1.263 25155 14182 1 17 . 1 1 105 105 HIS H H 105 8.247 8.247 7.812 0.435 25155 14183 1 17 . 1 1 106 106 ASP N N 106 119.780 119.780 120.156 -0.376 25155 14184 1 17 . 1 1 106 106 ASP HA H 106 4.333 4.333 4.415 -0.082 25155 14185 1 17 . 1 1 106 106 ASP C C 106 179.410 179.410 178.192 1.218 25155 14186 1 17 . 1 1 106 106 ASP CA C 106 57.800 57.800 57.483 0.317 25155 14187 1 17 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.051 -0.451 25155 14188 1 17 . 1 1 107 107 LYS N N 107 121.660 121.660 120.000 1.660 25155 14189 1 17 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.046 0.054 25155 14190 1 17 . 1 1 107 107 LYS C C 107 178.316 178.316 179.003 -0.687 25155 14191 1 17 . 1 1 107 107 LYS CA C 107 58.750 58.750 59.335 -0.585 25155 14192 1 17 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.673 -0.823 25155 14193 1 17 . 1 1 108 108 LEU N N 108 116.050 116.050 118.052 -2.002 25155 14194 1 17 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.247 -0.237 25155 14195 1 17 . 1 1 108 108 LEU C C 108 179.050 179.050 178.617 0.433 25155 14196 1 17 . 1 1 108 108 LEU CA C 108 56.240 56.240 56.771 -0.531 25155 14197 1 17 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.012 -0.212 25155 14198 1 17 . 1 1 108 108 LEU H H 108 8.072 8.072 8.259 -0.187 25155 14199 1 17 . 1 1 109 109 SER N N 109 116.280 116.280 114.753 1.527 25155 14200 1 17 . 1 1 109 109 SER HA H 109 4.300 4.300 4.346 -0.046 25155 14201 1 17 . 1 1 109 109 SER C C 109 175.848 175.848 175.948 -0.100 25155 14202 1 17 . 1 1 109 109 SER CA C 109 62.410 62.410 62.057 0.353 25155 14203 1 17 . 1 1 109 109 SER CB C 109 62.850 62.850 63.081 -0.231 25155 14204 1 17 . 1 1 109 109 SER H H 109 8.366 8.366 8.572 -0.206 25155 14205 1 17 . 1 1 110 110 THR N N 110 110.416 110.416 111.943 -1.527 25155 14206 1 17 . 1 1 110 110 THR HA H 110 4.614 4.614 4.310 0.304 25155 14207 1 17 . 1 1 110 110 THR C C 110 175.675 175.675 175.852 -0.177 25155 14208 1 17 . 1 1 110 110 THR CA C 110 62.030 62.030 64.372 -2.342 25155 14209 1 17 . 1 1 110 110 THR CB C 110 68.810 68.810 68.937 -0.127 25155 14210 1 17 . 1 1 110 110 THR H H 110 7.185 7.185 7.562 -0.377 25155 14211 1 17 . 1 1 111 111 LYS N N 111 120.090 120.090 120.288 -0.198 25155 14212 1 17 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.288 0.225 25155 14213 1 17 . 1 1 111 111 LYS C C 111 176.814 176.814 177.269 -0.455 25155 14214 1 17 . 1 1 111 111 LYS CA C 111 55.730 55.730 56.358 -0.628 25155 14215 1 17 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.532 -1.602 25155 14216 1 17 . 1 1 112 112 GLY N N 112 107.540 107.540 107.906 -0.366 25155 14217 1 17 . 1 1 112 112 GLY C C 112 176.223 176.223 173.853 2.370 25155 14218 1 17 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.259 1.667 25155 14219 1 17 . 1 1 112 112 GLY H H 112 8.315 8.315 7.733 0.582 25155 14220 1 17 . 1 1 113 113 VAL N N 113 113.536 113.536 114.479 -0.943 25155 14221 1 17 . 1 1 113 113 VAL HA H 113 4.494 4.494 3.863 0.631 25155 14222 1 17 . 1 1 113 113 VAL C C 113 174.560 174.560 174.356 0.204 25155 14223 1 17 . 1 1 113 113 VAL CA C 113 59.550 59.550 61.669 -2.119 25155 14224 1 17 . 1 1 113 113 VAL CB C 113 32.800 32.800 31.940 0.860 25155 14225 1 17 . 1 1 113 113 VAL H H 113 6.835 6.835 7.104 -0.269 25155 14226 1 17 . 1 1 114 114 LYS N N 114 122.920 122.920 121.852 1.068 25155 14227 1 17 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.403 0.091 25155 14228 1 17 . 1 1 114 114 LYS C C 114 174.925 174.925 174.676 0.249 25155 14229 1 17 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.290 -0.010 25155 14230 1 17 . 1 1 114 114 LYS CB C 114 33.630 33.630 34.112 -0.482 25155 14231 1 17 . 1 1 115 115 PHE N N 115 123.140 123.140 123.671 -0.531 25155 14232 1 17 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.493 0.207 25155 14233 1 17 . 1 1 115 115 PHE C C 115 177.580 177.580 176.416 1.164 25155 14234 1 17 . 1 1 115 115 PHE CA C 115 58.677 58.677 57.114 1.563 25155 14235 1 17 . 1 1 115 115 PHE CB C 115 41.120 41.120 40.557 0.563 25155 14236 1 17 . 1 1 115 115 PHE H H 115 8.506 8.506 8.540 -0.034 25155 14237 1 17 . 1 1 116 116 VAL N N 116 115.737 115.737 116.332 -0.595 25155 14238 1 17 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.390 0.088 25155 14239 1 17 . 1 1 116 116 VAL C C 116 175.300 175.300 175.801 -0.501 25155 14240 1 17 . 1 1 116 116 VAL CA C 116 58.877 58.877 60.022 -1.145 25155 14241 1 17 . 1 1 116 116 VAL CB C 116 34.120 34.120 34.515 -0.395 25155 14242 1 17 . 1 1 116 116 VAL H H 116 8.860 8.860 8.958 -0.098 25155 14243 1 17 . 1 1 117 117 GLY N N 117 108.137 108.137 110.527 -2.390 25155 14244 1 17 . 1 1 117 117 GLY C C 117 176.110 176.110 175.024 1.086 25155 14245 1 17 . 1 1 117 117 GLY CA C 117 47.500 47.500 45.758 1.742 25155 14246 1 17 . 1 1 117 117 GLY H H 117 9.838 9.838 9.446 0.392 25155 14247 1 17 . 1 1 118 118 TYR N N 118 120.380 120.380 119.975 0.405 25155 14248 1 17 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.718 0.252 25155 14249 1 17 . 1 1 118 118 TYR C C 118 177.630 177.630 175.725 1.905 25155 14250 1 17 . 1 1 118 118 TYR CA C 118 55.800 55.800 57.646 -1.846 25155 14251 1 17 . 1 1 118 118 TYR CB C 118 35.970 35.970 38.983 -3.014 25155 14252 1 17 . 1 1 118 118 TYR H H 118 8.652 8.652 8.088 0.564 25155 14253 1 17 . 1 1 119 119 TRP N N 119 126.040 126.040 122.333 3.707 25155 14254 1 17 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.161 0.860 25155 14255 1 17 . 1 1 119 119 TRP C C 119 173.000 173.000 173.767 -0.767 25155 14256 1 17 . 1 1 119 119 TRP CA C 119 53.820 53.820 53.935 -0.115 25155 14257 1 17 . 1 1 119 119 TRP CB C 119 36.050 36.050 33.461 2.589 25155 14258 1 17 . 1 1 119 119 TRP H H 119 8.070 8.070 8.326 -0.256 25155 14259 1 17 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.515 0.269 25155 14260 1 17 . 1 1 120 120 PRO C C 120 176.870 176.870 176.304 0.566 25155 14261 1 17 . 1 1 120 120 PRO CA C 120 63.780 63.780 63.014 0.766 25155 14262 1 17 . 1 1 120 120 PRO CB C 120 31.990 31.990 32.053 -0.063 25155 14263 1 17 . 1 1 121 121 THR N N 121 109.310 109.310 112.027 -2.717 25155 14264 1 17 . 1 1 121 121 THR HA H 121 4.073 4.073 4.328 -0.255 25155 14265 1 17 . 1 1 121 121 THR C C 121 176.324 176.324 175.282 1.042 25155 14266 1 17 . 1 1 121 121 THR CA C 121 61.250 61.250 61.966 -0.716 25155 14267 1 17 . 1 1 121 121 THR CB C 121 69.730 69.730 68.879 0.851 25155 14268 1 17 . 1 1 121 121 THR H H 121 7.370 7.370 8.430 -1.060 25155 14269 1 17 . 1 1 122 122 GLU N N 122 123.937 123.937 122.016 1.921 25155 14270 1 17 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.183 0.041 25155 14271 1 17 . 1 1 122 122 GLU C C 122 177.737 177.737 177.296 0.441 25155 14272 1 17 . 1 1 122 122 GLU CA C 122 58.200 58.200 57.741 0.459 25155 14273 1 17 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.683 0.117 25155 14274 1 17 . 1 1 123 123 GLY N N 123 114.563 114.563 112.085 2.478 25155 14275 1 17 . 1 1 123 123 GLY C C 123 173.783 173.783 174.227 -0.444 25155 14276 1 17 . 1 1 123 123 GLY CA C 123 45.380 45.380 44.985 0.395 25155 14277 1 17 . 1 1 123 123 GLY H H 123 9.144 9.144 8.709 0.435 25155 14278 1 17 . 1 1 124 124 TYR N N 124 118.800 118.800 121.373 -2.573 25155 14279 1 17 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.431 0.787 25155 14280 1 17 . 1 1 124 124 TYR C C 124 175.673 175.673 174.168 1.505 25155 14281 1 17 . 1 1 124 124 TYR CA C 124 56.950 56.950 57.487 -0.537 25155 14282 1 17 . 1 1 124 124 TYR CB C 124 41.100 41.100 40.184 0.916 25155 14283 1 17 . 1 1 124 124 TYR H H 124 7.895 7.895 7.903 -0.008 25155 14284 1 17 . 1 1 125 125 GLU N N 125 124.790 124.790 121.344 3.446 25155 14285 1 17 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.504 0.181 25155 14286 1 17 . 1 1 125 125 GLU C C 125 172.877 172.877 174.503 -1.626 25155 14287 1 17 . 1 1 125 125 GLU CA C 125 55.700 55.700 54.809 0.891 25155 14288 1 17 . 1 1 125 125 GLU CB C 125 31.340 31.340 31.511 -0.171 25155 14289 1 17 . 1 1 126 126 PHE N N 126 118.670 118.670 119.643 -0.973 25155 14290 1 17 . 1 1 126 126 PHE HA H 126 4.841 4.841 4.863 -0.022 25155 14291 1 17 . 1 1 126 126 PHE C C 126 173.800 173.800 175.611 -1.811 25155 14292 1 17 . 1 1 126 126 PHE CA C 126 56.950 56.950 57.660 -0.710 25155 14293 1 17 . 1 1 126 126 PHE CB C 126 40.300 40.300 43.073 -2.773 25155 14294 1 17 . 1 1 126 126 PHE H H 126 7.645 7.645 8.308 -0.663 25155 14295 1 17 . 1 1 127 127 THR N N 127 107.038 107.038 115.768 -8.730 25155 14296 1 17 . 1 1 127 127 THR HA H 127 4.370 4.370 4.576 -0.206 25155 14297 1 17 . 1 1 127 127 THR C C 127 175.100 175.100 174.813 0.287 25155 14298 1 17 . 1 1 127 127 THR CA C 127 61.080 61.080 62.298 -1.218 25155 14299 1 17 . 1 1 127 127 THR CB C 127 70.500 70.500 70.145 0.355 25155 14300 1 17 . 1 1 127 127 THR H H 127 7.306 7.306 8.752 -1.446 25155 14301 1 17 . 1 1 128 128 SER N N 128 118.150 118.150 120.215 -2.065 25155 14302 1 17 . 1 1 128 128 SER HA H 128 4.650 4.650 4.967 -0.317 25155 14303 1 17 . 1 1 128 128 SER C C 128 175.760 175.760 173.731 2.029 25155 14304 1 17 . 1 1 128 128 SER CA C 128 55.813 55.813 57.738 -1.925 25155 14305 1 17 . 1 1 128 128 SER CB C 128 65.300 65.300 64.778 0.522 25155 14306 1 17 . 1 1 128 128 SER H H 128 7.354 7.354 8.208 -0.854 25155 14307 1 17 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.463 0.301 25155 14308 1 17 . 1 1 129 129 PRO C C 129 178.860 178.860 177.934 0.926 25155 14309 1 17 . 1 1 129 129 PRO CA C 129 62.728 62.728 63.888 -1.160 25155 14310 1 17 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.531 -0.131 25155 14311 1 17 . 1 1 130 130 LYS N N 130 122.158 122.158 119.521 2.637 25155 14312 1 17 . 1 1 130 130 LYS HA H 130 4.210 4.210 3.997 0.213 25155 14313 1 17 . 1 1 130 130 LYS C C 130 176.890 176.890 175.612 1.278 25155 14314 1 17 . 1 1 130 130 LYS CA C 130 61.375 61.375 60.918 0.457 25155 14315 1 17 . 1 1 130 130 LYS CB C 130 30.350 30.350 30.912 -0.562 25155 14316 1 17 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.225 0.308 25155 14317 1 17 . 1 1 131 131 PRO C C 131 173.810 173.810 175.920 -2.110 25155 14318 1 17 . 1 1 131 131 PRO CA C 131 64.510 64.510 64.038 0.472 25155 14319 1 17 . 1 1 131 131 PRO CB C 131 31.745 31.745 31.725 0.020 25155 14320 1 17 . 1 1 132 132 VAL N N 132 114.480 114.480 112.448 2.032 25155 14321 1 17 . 1 1 132 132 VAL HA H 132 5.158 5.158 4.881 0.277 25155 14322 1 17 . 1 1 132 132 VAL C C 132 175.137 175.137 173.910 1.227 25155 14323 1 17 . 1 1 132 132 VAL CA C 132 59.800 59.800 58.889 0.911 25155 14324 1 17 . 1 1 132 132 VAL CB C 132 34.780 34.780 35.159 -0.379 25155 14325 1 17 . 1 1 132 132 VAL H H 132 6.716 6.716 7.443 -0.727 25155 14326 1 17 . 1 1 133 133 ILE N N 133 120.670 120.670 110.892 9.778 25155 14327 1 17 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.568 -0.176 25155 14328 1 17 . 1 1 133 133 ILE C C 133 175.485 175.485 174.964 0.521 25155 14329 1 17 . 1 1 133 133 ILE CA C 133 60.000 60.000 59.475 0.525 25155 14330 1 17 . 1 1 133 133 ILE CB C 133 42.020 42.020 41.175 0.845 25155 14331 1 17 . 1 1 133 133 ILE H H 133 8.740 8.740 8.480 0.260 25155 14332 1 17 . 1 1 134 134 ALA N N 134 122.454 122.454 121.771 0.683 25155 14333 1 17 . 1 1 134 134 ALA HA H 134 3.953 3.953 4.034 -0.081 25155 14334 1 17 . 1 1 134 134 ALA C C 134 178.387 178.387 176.664 1.723 25155 14335 1 17 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.387 -0.337 25155 14336 1 17 . 1 1 134 134 ALA CB C 134 16.982 16.982 17.149 -0.167 25155 14337 1 17 . 1 1 134 134 ALA H H 134 8.490 8.490 8.768 -0.278 25155 14338 1 17 . 1 1 135 135 ASP N N 135 117.310 117.310 116.365 0.945 25155 14339 1 17 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.343 -0.099 25155 14340 1 17 . 1 1 135 135 ASP C C 135 176.390 176.390 176.320 0.070 25155 14341 1 17 . 1 1 135 135 ASP CA C 135 55.120 55.120 55.089 0.031 25155 14342 1 17 . 1 1 135 135 ASP CB C 135 39.865 39.865 39.808 0.057 25155 14343 1 17 . 1 1 136 136 GLY N N 136 104.336 104.336 103.916 0.420 25155 14344 1 17 . 1 1 136 136 GLY C C 136 174.940 174.940 175.217 -0.277 25155 14345 1 17 . 1 1 136 136 GLY CA C 136 45.150 45.150 45.191 -0.042 25155 14346 1 17 . 1 1 136 136 GLY H H 136 7.592 7.592 7.838 -0.246 25155 14347 1 17 . 1 1 137 137 GLN N N 137 118.675 118.675 118.544 0.131 25155 14348 1 17 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.475 -0.413 25155 14349 1 17 . 1 1 137 137 GLN C C 137 176.420 176.420 175.212 1.208 25155 14350 1 17 . 1 1 137 137 GLN CA C 137 57.760 57.760 56.103 1.657 25155 14351 1 17 . 1 1 137 137 GLN CB C 137 30.400 30.400 30.358 0.042 25155 14352 1 17 . 1 1 137 137 GLN H H 137 7.843 7.843 7.902 -0.059 25155 14353 1 17 . 1 1 138 138 LEU N N 138 118.160 118.160 119.468 -1.308 25155 14354 1 17 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.567 0.394 25155 14355 1 17 . 1 1 138 138 LEU C C 138 175.700 175.700 174.224 1.476 25155 14356 1 17 . 1 1 138 138 LEU CA C 138 53.705 53.705 54.515 -0.810 25155 14357 1 17 . 1 1 138 138 LEU CB C 138 46.480 46.480 46.274 0.206 25155 14358 1 17 . 1 1 138 138 LEU H H 138 7.356 7.356 7.351 0.005 25155 14359 1 17 . 1 1 139 139 PHE N N 139 119.060 119.060 121.793 -2.733 25155 14360 1 17 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.793 0.551 25155 14361 1 17 . 1 1 139 139 PHE C C 139 178.850 178.850 177.363 1.487 25155 14362 1 17 . 1 1 139 139 PHE CA C 139 56.670 56.670 57.730 -1.060 25155 14363 1 17 . 1 1 139 139 PHE CB C 139 43.652 43.652 40.050 3.602 25155 14364 1 17 . 1 1 139 139 PHE H H 139 10.026 10.026 9.218 0.808 25155 14365 1 17 . 1 1 140 140 VAL N N 140 109.905 109.905 118.162 -8.257 25155 14366 1 17 . 1 1 140 140 VAL HA H 140 3.500 3.500 2.975 0.525 25155 14367 1 17 . 1 1 140 140 VAL C C 140 172.860 172.860 174.644 -1.784 25155 14368 1 17 . 1 1 140 140 VAL CA C 140 61.812 61.812 61.645 0.167 25155 14369 1 17 . 1 1 140 140 VAL CB C 140 30.250 30.250 30.053 0.197 25155 14370 1 17 . 1 1 140 140 VAL H H 140 7.550 7.550 8.295 -0.745 25155 14371 1 17 . 1 1 141 141 GLY N N 141 106.600 106.600 106.767 -0.167 25155 14372 1 17 . 1 1 141 141 GLY C C 141 171.350 171.350 172.668 -1.318 25155 14373 1 17 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.257 1.203 25155 14374 1 17 . 1 1 141 141 GLY H H 141 7.052 7.052 7.231 -0.179 25155 14375 1 17 . 1 1 142 142 LEU N N 142 117.820 117.820 119.890 -2.070 25155 14376 1 17 . 1 1 142 142 LEU HA H 142 4.962 4.962 3.722 1.240 25155 14377 1 17 . 1 1 142 142 LEU CA C 142 55.600 55.600 54.308 1.292 25155 14378 1 17 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.204 -4.274 25155 14379 1 17 . 1 1 142 142 LEU H H 142 7.643 7.643 8.188 -0.545 25155 14380 1 17 . 1 1 143 143 ALA HA H 143 4.220 4.220 4.224 -0.004 25155 14381 1 17 . 1 1 143 143 ALA C C 143 175.505 175.505 175.949 -0.444 25155 14382 1 17 . 1 1 143 143 ALA CA C 143 49.600 49.600 49.827 -0.227 25155 14383 1 17 . 1 1 143 143 ALA CB C 143 23.330 23.330 18.413 4.917 25155 14384 1 17 . 1 1 144 144 LEU N N 144 124.960 124.960 124.271 0.689 25155 14385 1 17 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.426 0.354 25155 14386 1 17 . 1 1 144 144 LEU C C 144 174.700 174.700 175.624 -0.924 25155 14387 1 17 . 1 1 144 144 LEU CA C 144 52.790 52.790 53.594 -0.804 25155 14388 1 17 . 1 1 144 144 LEU CB C 144 45.300 45.300 43.957 1.343 25155 14389 1 17 . 1 1 144 144 LEU H H 144 8.583 8.583 8.416 0.167 25155 14390 1 17 . 1 1 145 145 ASP N N 145 119.100 119.100 119.178 -0.078 25155 14391 1 17 . 1 1 145 145 ASP HA H 145 5.422 5.422 5.109 0.313 25155 14392 1 17 . 1 1 145 145 ASP C C 145 176.180 176.180 174.749 1.431 25155 14393 1 17 . 1 1 145 145 ASP CA C 145 53.600 53.600 53.317 0.283 25155 14394 1 17 . 1 1 145 145 ASP CB C 145 43.180 43.180 44.489 -1.309 25155 14395 1 17 . 1 1 147 147 THR HA H 147 4.093 4.093 4.526 -0.433 25155 14396 1 17 . 1 1 147 147 THR C C 147 175.858 175.858 174.706 1.152 25155 14397 1 17 . 1 1 147 147 THR CA C 147 66.400 66.400 64.430 1.970 25155 14398 1 17 . 1 1 147 147 THR CB C 147 69.400 69.400 70.807 -1.407 25155 14399 1 17 . 1 1 147 147 THR H H 147 8.745 8.745 8.649 0.096 25155 14400 1 17 . 1 1 148 148 ASN N N 148 115.408 115.408 118.460 -3.052 25155 14401 1 17 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.683 0.327 25155 14402 1 17 . 1 1 148 148 ASN C C 148 175.750 175.750 175.041 0.709 25155 14403 1 17 . 1 1 148 148 ASN CA C 148 53.400 53.400 54.558 -1.158 25155 14404 1 17 . 1 1 148 148 ASN CB C 148 41.900 41.900 39.738 2.162 25155 14405 1 17 . 1 1 148 148 ASN H H 148 8.975 8.975 8.992 -0.017 25155 14406 1 17 . 1 1 149 149 GLN N N 149 117.900 117.900 117.066 0.834 25155 14407 1 17 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.502 0.434 25155 14408 1 17 . 1 1 149 149 GLN C C 149 178.280 178.280 174.456 3.824 25155 14409 1 17 . 1 1 149 149 GLN CA C 149 53.730 53.730 54.955 -1.225 25155 14410 1 17 . 1 1 149 149 GLN CB C 149 29.790 29.790 31.861 -2.071 25155 14411 1 17 . 1 1 149 149 GLN H H 149 7.430 7.430 7.497 -0.067 25155 14412 1 17 . 1 1 150 150 TYR N N 150 121.060 121.060 119.798 1.262 25155 14413 1 17 . 1 1 150 150 TYR HA H 150 4.671 4.671 4.523 0.148 25155 14414 1 17 . 1 1 150 150 TYR C C 150 178.680 178.680 177.339 1.341 25155 14415 1 17 . 1 1 150 150 TYR CA C 150 57.930 57.930 58.971 -1.041 25155 14416 1 17 . 1 1 150 150 TYR CB C 150 38.860 38.860 39.509 -0.649 25155 14417 1 17 . 1 1 150 150 TYR H H 150 8.115 8.115 8.591 -0.476 25155 14418 1 17 . 1 1 151 151 ASP N N 151 121.175 121.175 120.908 0.267 25155 14419 1 17 . 1 1 151 151 ASP CA C 151 57.000 57.000 56.838 0.162 25155 14420 1 17 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.721 1.279 25155 14421 1 17 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.145 0.445 25155 14422 1 17 . 1 1 152 152 LEU C C 152 178.300 178.300 178.017 0.283 25155 14423 1 17 . 1 1 152 152 LEU CA C 152 54.788 54.788 56.853 -2.065 25155 14424 1 17 . 1 1 152 152 LEU CB C 152 42.200 42.200 41.644 0.556 25155 14425 1 17 . 1 1 153 153 SER N N 153 116.170 116.170 115.448 0.722 25155 14426 1 17 . 1 1 153 153 SER HA H 153 3.911 3.911 4.026 -0.115 25155 14427 1 17 . 1 1 153 153 SER CA C 153 63.400 63.400 61.767 1.633 25155 14428 1 17 . 1 1 153 153 SER CB C 153 63.200 63.200 62.604 0.596 25155 14429 1 17 . 1 1 153 153 SER H H 153 7.378 7.378 8.387 -1.009 25155 14430 1 17 . 1 1 154 154 ASP N N 154 121.640 121.640 121.665 -0.025 25155 14431 1 17 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.364 -0.124 25155 14432 1 17 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.354 1.946 25155 14433 1 17 . 1 1 154 154 ASP CB C 154 40.000 40.000 40.988 -0.988 25155 14434 1 17 . 1 1 155 155 GLU HA H 155 4.170 4.170 3.966 0.204 25155 14435 1 17 . 1 1 155 155 GLU C C 155 179.420 179.420 178.990 0.430 25155 14436 1 17 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.413 -0.213 25155 14437 1 17 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.686 -0.205 25155 14438 1 17 . 1 1 156 156 ARG N N 156 121.230 121.230 118.943 2.287 25155 14439 1 17 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.235 0.041 25155 14440 1 17 . 1 1 156 156 ARG C C 156 177.350 177.350 179.140 -1.790 25155 14441 1 17 . 1 1 156 156 ARG CA C 156 59.950 59.950 59.541 0.409 25155 14442 1 17 . 1 1 156 156 ARG CB C 156 31.100 31.100 30.202 0.898 25155 14443 1 17 . 1 1 157 157 ILE N N 157 118.190 118.190 120.010 -1.820 25155 14444 1 17 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.596 -0.166 25155 14445 1 17 . 1 1 157 157 ILE C C 157 178.480 178.480 177.919 0.561 25155 14446 1 17 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.627 0.932 25155 14447 1 17 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.737 0.743 25155 14448 1 17 . 1 1 157 157 ILE H H 157 8.705 8.705 8.326 0.379 25155 14449 1 17 . 1 1 158 158 GLN N N 158 119.975 119.975 120.446 -0.471 25155 14450 1 17 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.893 0.063 25155 14451 1 17 . 1 1 158 158 GLN C C 158 178.730 178.730 178.273 0.457 25155 14452 1 17 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.245 1.455 25155 14453 1 17 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.320 0.162 25155 14454 1 17 . 1 1 158 158 GLN H H 158 8.262 8.262 8.560 -0.298 25155 14455 1 17 . 1 1 159 159 SER N N 159 115.466 115.466 115.851 -0.385 25155 14456 1 17 . 1 1 159 159 SER HA H 159 4.446 4.446 4.296 0.150 25155 14457 1 17 . 1 1 159 159 SER C C 159 177.320 177.320 176.952 0.368 25155 14458 1 17 . 1 1 159 159 SER CA C 159 63.500 63.500 61.260 2.240 25155 14459 1 17 . 1 1 159 159 SER CB C 159 63.818 63.818 63.321 0.497 25155 14460 1 17 . 1 1 159 159 SER H H 159 8.440 8.440 8.411 0.029 25155 14461 1 17 . 1 1 160 160 TRP N N 160 126.784 126.784 125.241 1.543 25155 14462 1 17 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.522 -0.068 25155 14463 1 17 . 1 1 160 160 TRP C C 160 177.934 177.934 177.610 0.324 25155 14464 1 17 . 1 1 160 160 TRP CA C 160 62.745 62.745 62.240 0.505 25155 14465 1 17 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.218 0.132 25155 14466 1 17 . 1 1 160 160 TRP H H 160 9.243 9.243 8.293 0.950 25155 14467 1 17 . 1 1 161 161 CYS N N 161 116.395 116.395 118.674 -2.279 25155 14468 1 17 . 1 1 161 161 CYS HA H 161 3.886 3.886 3.595 0.291 25155 14469 1 17 . 1 1 161 161 CYS C C 161 176.245 176.245 176.968 -0.723 25155 14470 1 17 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.766 0.534 25155 14471 1 17 . 1 1 161 161 CYS CB C 161 27.723 27.723 27.051 0.672 25155 14472 1 17 . 1 1 161 161 CYS H H 161 8.845 8.845 8.998 -0.153 25155 14473 1 17 . 1 1 162 162 GLU N N 162 118.030 118.030 119.325 -1.295 25155 14474 1 17 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.858 0.062 25155 14475 1 17 . 1 1 162 162 GLU C C 162 178.700 178.700 178.798 -0.098 25155 14476 1 17 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.506 0.294 25155 14477 1 17 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.240 0.260 25155 14478 1 17 . 1 1 163 163 GLN N N 163 120.650 120.650 119.708 0.942 25155 14479 1 17 . 1 1 163 163 GLN HA H 163 4.173 4.173 4.000 0.173 25155 14480 1 17 . 1 1 163 163 GLN C C 163 179.700 179.700 178.300 1.400 25155 14481 1 17 . 1 1 163 163 GLN CA C 163 59.688 59.688 59.240 0.448 25155 14482 1 17 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.883 0.017 25155 14483 1 17 . 1 1 163 163 GLN H H 163 8.148 8.148 7.745 0.403 25155 14484 1 17 . 1 1 164 164 ILE N N 164 114.836 114.836 117.406 -2.570 25155 14485 1 17 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.629 0.431 25155 14486 1 17 . 1 1 164 164 ILE C C 164 178.676 178.676 177.658 1.018 25155 14487 1 17 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.469 1.691 25155 14488 1 17 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.307 0.323 25155 14489 1 17 . 1 1 164 164 ILE H H 164 8.958 8.958 8.273 0.685 25155 14490 1 17 . 1 1 165 165 LEU N N 165 123.700 123.700 119.657 4.043 25155 14491 1 17 . 1 1 165 165 LEU HA H 165 4.100 4.100 4.024 0.076 25155 14492 1 17 . 1 1 165 165 LEU C C 165 180.548 180.548 178.431 2.117 25155 14493 1 17 . 1 1 165 165 LEU CA C 165 58.150 58.150 58.281 -0.130 25155 14494 1 17 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.434 -0.304 25155 14495 1 17 . 1 1 165 165 LEU H H 165 7.830 7.830 7.974 -0.144 25155 14496 1 17 . 1 1 166 166 ASN N N 166 120.160 120.160 118.447 1.713 25155 14497 1 17 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.380 0.190 25155 14498 1 17 . 1 1 166 166 ASN C C 166 175.690 175.690 177.374 -1.684 25155 14499 1 17 . 1 1 166 166 ASN CA C 166 55.946 55.946 57.008 -1.062 25155 14500 1 17 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.376 0.104 25155 14501 1 17 . 1 1 166 166 ASN H H 166 7.706 7.706 7.745 -0.039 25155 14502 1 17 . 1 1 167 167 GLU N N 167 121.286 121.286 121.106 0.180 25155 14503 1 17 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.378 -0.274 25155 14504 1 17 . 1 1 167 167 GLU C C 167 180.520 180.520 179.387 1.133 25155 14505 1 17 . 1 1 167 167 GLU CA C 167 59.920 59.920 59.038 0.882 25155 14506 1 17 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.779 1.146 25155 14507 1 17 . 1 1 168 168 MET N N 168 118.622 118.622 116.084 2.538 25155 14508 1 17 . 1 1 168 168 MET HA H 168 3.996 3.996 4.451 -0.455 25155 14509 1 17 . 1 1 168 168 MET C C 168 176.856 176.856 177.782 -0.926 25155 14510 1 17 . 1 1 168 168 MET CA C 168 59.500 59.500 58.570 0.930 25155 14511 1 17 . 1 1 168 168 MET CB C 168 33.700 33.700 32.878 0.822 25155 14512 1 17 . 1 1 168 168 MET H H 168 8.723 8.723 8.460 0.263 25155 14513 1 17 . 1 1 169 169 ALA N N 169 121.760 121.760 123.677 -1.917 25155 14514 1 17 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.300 -0.144 25155 14515 1 17 . 1 1 169 169 ALA C C 169 179.790 179.790 179.467 0.323 25155 14516 1 17 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.578 0.222 25155 14517 1 17 . 1 1 169 169 ALA CB C 169 18.220 18.220 19.041 -0.821 25155 14518 1 17 . 1 1 169 169 ALA H H 169 7.494 7.494 7.630 -0.136 25155 14519 1 17 . 1 1 170 170 GLU N N 170 116.970 116.970 118.427 -1.457 25155 14520 1 17 . 1 1 170 170 GLU HA H 170 4.091 4.091 4.048 0.043 25155 14521 1 17 . 1 1 170 170 GLU C C 170 177.745 177.745 177.901 -0.156 25155 14522 1 17 . 1 1 170 170 GLU CA C 170 58.000 58.000 58.804 -0.804 25155 14523 1 17 . 1 1 170 170 GLU CB C 170 29.730 29.730 29.404 0.326 25155 14524 1 17 . 1 1 171 171 HIS N N 171 118.150 118.150 118.405 -0.255 25155 14525 1 17 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.302 0.168 25155 14526 1 17 . 1 1 171 171 HIS C C 171 175.848 175.848 176.399 -0.551 25155 14527 1 17 . 1 1 171 171 HIS CA C 171 57.600 57.600 58.525 -0.925 25155 14528 1 17 . 1 1 171 171 HIS CB C 171 30.800 30.800 29.789 1.011 25155 14529 1 17 . 1 1 171 171 HIS H H 171 7.717 7.717 7.965 -0.248 25155 14530 1 17 . 1 1 172 172 TYR N N 172 119.483 119.483 118.145 1.338 25155 14531 1 17 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.348 0.243 25155 14532 1 17 . 1 1 172 172 TYR C C 172 174.590 174.590 176.148 -1.558 25155 14533 1 17 . 1 1 172 172 TYR CA C 172 57.813 57.813 58.792 -0.979 25155 14534 1 17 . 1 1 172 172 TYR CB C 172 38.900 38.900 38.661 0.239 25155 14535 1 17 . 1 1 172 172 TYR H H 172 7.778 7.778 7.658 0.120 25155 14536 1 18 . 1 1 2 2 ASN N N 2 122.966 122.966 121.921 1.045 25155 14537 1 18 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.213 -0.038 25155 14538 1 18 . 1 1 2 2 ASN C C 2 175.200 175.200 173.818 1.382 25155 14539 1 18 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.839 0.081 25155 14540 1 18 . 1 1 2 2 ASN CB C 2 40.000 40.000 41.583 -1.583 25155 14541 1 18 . 1 1 2 2 ASN H H 2 9.392 9.392 8.383 1.009 25155 14542 1 18 . 1 1 3 3 MET N N 3 120.660 120.660 121.026 -0.366 25155 14543 1 18 . 1 1 3 3 MET HA H 3 5.565 5.565 5.084 0.481 25155 14544 1 18 . 1 1 3 3 MET C C 3 174.200 174.200 175.406 -1.206 25155 14545 1 18 . 1 1 3 3 MET CA C 3 54.550 54.550 54.263 0.287 25155 14546 1 18 . 1 1 3 3 MET CB C 3 34.100 34.100 34.937 -0.837 25155 14547 1 18 . 1 1 3 3 MET H H 3 8.745 8.745 8.862 -0.117 25155 14548 1 18 . 1 1 4 4 GLY N N 4 115.792 115.792 110.278 5.514 25155 14549 1 18 . 1 1 4 4 GLY C C 4 170.444 170.444 171.955 -1.511 25155 14550 1 18 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.377 -0.490 25155 14551 1 18 . 1 1 4 4 GLY H H 4 8.989 8.989 8.975 0.014 25155 14552 1 18 . 1 1 5 5 LEU N N 5 131.175 131.175 125.411 5.764 25155 14553 1 18 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.315 1.007 25155 14554 1 18 . 1 1 5 5 LEU C C 5 175.700 175.700 174.688 1.012 25155 14555 1 18 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.569 -0.249 25155 14556 1 18 . 1 1 5 5 LEU CB C 5 44.700 44.700 43.832 0.868 25155 14557 1 18 . 1 1 5 5 LEU H H 5 8.917 8.917 8.143 0.774 25155 14558 1 18 . 1 1 6 6 PHE N N 6 125.990 125.990 125.208 0.782 25155 14559 1 18 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.755 -0.017 25155 14560 1 18 . 1 1 6 6 PHE C C 6 174.358 174.358 173.319 1.039 25155 14561 1 18 . 1 1 6 6 PHE CA C 6 55.480 55.480 54.821 0.659 25155 14562 1 18 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.246 -0.196 25155 14563 1 18 . 1 1 6 6 PHE H H 6 9.225 9.225 9.199 0.026 25155 14564 1 18 . 1 1 7 7 TYR N N 7 118.040 118.040 116.984 1.056 25155 14565 1 18 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.188 0.741 25155 14566 1 18 . 1 1 7 7 TYR C C 7 171.690 171.690 173.440 -1.750 25155 14567 1 18 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.405 -0.945 25155 14568 1 18 . 1 1 7 7 TYR CB C 7 40.800 40.800 40.756 0.044 25155 14569 1 18 . 1 1 7 7 TYR H H 7 8.235 8.235 7.936 0.299 25155 14570 1 18 . 1 1 8 8 GLY N N 8 106.640 106.640 105.825 0.815 25155 14571 1 18 . 1 1 8 8 GLY C C 8 171.682 171.682 172.487 -0.805 25155 14572 1 18 . 1 1 8 8 GLY CA C 8 44.050 44.050 44.541 -0.491 25155 14573 1 18 . 1 1 8 8 GLY H H 8 6.996 6.996 8.698 -1.702 25155 14574 1 18 . 1 1 9 9 SER N N 9 118.164 118.164 116.696 1.468 25155 14575 1 18 . 1 1 9 9 SER C C 9 174.560 174.560 173.663 0.897 25155 14576 1 18 . 1 1 9 9 SER CA C 9 57.140 57.140 57.495 -0.355 25155 14577 1 18 . 1 1 9 9 SER H H 9 9.680 9.680 8.694 0.986 25155 14578 1 18 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.939 -0.309 25155 14579 1 18 . 1 1 17 17 ALA C C 17 177.740 177.740 179.275 -1.535 25155 14580 1 18 . 1 1 17 17 ALA CA C 17 54.900 54.900 54.868 0.032 25155 14581 1 18 . 1 1 17 17 ALA CB C 17 17.790 17.790 17.691 0.099 25155 14582 1 18 . 1 1 17 17 ALA H H 17 8.055 8.055 7.671 0.384 25155 14583 1 18 . 1 1 18 18 ALA N N 18 120.026 120.026 121.448 -1.422 25155 14584 1 18 . 1 1 18 18 ALA HA H 18 3.713 3.713 3.991 -0.278 25155 14585 1 18 . 1 1 18 18 ALA C C 18 179.040 179.040 179.388 -0.348 25155 14586 1 18 . 1 1 18 18 ALA CA C 18 54.860 54.860 55.063 -0.203 25155 14587 1 18 . 1 1 18 18 ALA CB C 18 18.200 18.200 18.384 -0.184 25155 14588 1 18 . 1 1 18 18 ALA H H 18 7.015 7.015 7.788 -0.773 25155 14589 1 18 . 1 1 19 19 GLU N N 19 116.656 116.656 118.043 -1.387 25155 14590 1 18 . 1 1 19 19 GLU HA H 19 3.580 3.580 4.094 -0.514 25155 14591 1 18 . 1 1 19 19 GLU C C 19 178.487 178.487 179.257 -0.770 25155 14592 1 18 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.053 0.617 25155 14593 1 18 . 1 1 19 19 GLU CB C 19 29.400 29.400 29.010 0.390 25155 14594 1 18 . 1 1 20 20 LYS N N 20 120.100 120.100 120.624 -0.524 25155 14595 1 18 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.027 0.319 25155 14596 1 18 . 1 1 20 20 LYS C C 20 175.330 175.330 178.855 -3.525 25155 14597 1 18 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.121 -2.021 25155 14598 1 18 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.135 0.865 25155 14599 1 18 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.767 -0.302 25155 14600 1 18 . 1 1 21 21 ILE C C 21 177.680 177.680 178.251 -0.571 25155 14601 1 18 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.598 0.042 25155 14602 1 18 . 1 1 21 21 ILE CB C 21 38.030 38.030 37.941 0.089 25155 14603 1 18 . 1 1 21 21 ILE H H 21 8.220 8.220 8.511 -0.291 25155 14604 1 18 . 1 1 22 22 ARG N N 22 119.433 119.433 118.633 0.800 25155 14605 1 18 . 1 1 22 22 ARG HA H 22 3.550 3.550 4.027 -0.477 25155 14606 1 18 . 1 1 22 22 ARG C C 22 177.268 177.268 178.242 -0.974 25155 14607 1 18 . 1 1 22 22 ARG CA C 22 59.760 59.760 58.813 0.947 25155 14608 1 18 . 1 1 22 22 ARG CB C 22 28.900 28.900 28.989 -0.089 25155 14609 1 18 . 1 1 23 23 ASP N N 23 118.945 118.945 119.916 -0.971 25155 14610 1 18 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.438 -0.096 25155 14611 1 18 . 1 1 23 23 ASP C C 23 178.470 178.470 178.581 -0.111 25155 14612 1 18 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.136 0.314 25155 14613 1 18 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.894 -0.524 25155 14614 1 18 . 1 1 24 24 ILE N N 24 121.200 121.200 119.217 1.983 25155 14615 1 18 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.816 -0.082 25155 14616 1 18 . 1 1 24 24 ILE C C 24 178.297 178.297 177.909 0.388 25155 14617 1 18 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.526 -0.026 25155 14618 1 18 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.546 0.194 25155 14619 1 18 . 1 1 24 24 ILE H H 24 8.160 8.160 7.984 0.176 25155 14620 1 18 . 1 1 25 25 ILE N N 25 121.166 121.166 117.620 3.546 25155 14621 1 18 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.835 -0.192 25155 14622 1 18 . 1 1 25 25 ILE C C 25 176.825 176.825 176.795 0.030 25155 14623 1 18 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.398 2.492 25155 14624 1 18 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.739 -0.989 25155 14625 1 18 . 1 1 25 25 ILE H H 25 8.480 8.480 8.156 0.324 25155 14626 1 18 . 1 1 26 26 GLY N N 26 109.050 109.050 104.780 4.270 25155 14627 1 18 . 1 1 26 26 GLY C C 26 173.800 173.800 172.589 1.211 25155 14628 1 18 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.484 -0.084 25155 14629 1 18 . 1 1 26 26 GLY H H 26 7.945 7.945 7.773 0.172 25155 14630 1 18 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.430 -0.067 25155 14631 1 18 . 1 1 27 27 PRO C C 27 177.157 177.157 176.845 0.312 25155 14632 1 18 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.898 0.632 25155 14633 1 18 . 1 1 27 27 PRO CB C 27 32.000 32.000 32.109 -0.109 25155 14634 1 18 . 1 1 28 28 GLU N N 28 116.510 116.510 116.712 -0.202 25155 14635 1 18 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.223 0.037 25155 14636 1 18 . 1 1 28 28 GLU C C 28 177.000 177.000 176.976 0.024 25155 14637 1 18 . 1 1 28 28 GLU CA C 28 57.680 57.680 57.834 -0.154 25155 14638 1 18 . 1 1 28 28 GLU CB C 28 28.620 28.620 29.209 -0.589 25155 14639 1 18 . 1 1 29 29 LEU N N 29 120.334 120.334 113.043 7.291 25155 14640 1 18 . 1 1 29 29 LEU HA H 29 4.650 4.650 5.030 -0.380 25155 14641 1 18 . 1 1 29 29 LEU C C 29 175.676 175.676 174.917 0.759 25155 14642 1 18 . 1 1 29 29 LEU CA C 29 55.924 55.924 54.736 1.188 25155 14643 1 18 . 1 1 29 29 LEU CB C 29 44.880 44.880 44.333 0.547 25155 14644 1 18 . 1 1 29 29 LEU H H 29 7.924 7.924 7.490 0.434 25155 14645 1 18 . 1 1 30 30 VAL N N 30 118.900 118.900 120.439 -1.539 25155 14646 1 18 . 1 1 30 30 VAL HA H 30 4.639 4.639 4.988 -0.349 25155 14647 1 18 . 1 1 30 30 VAL C C 30 174.368 174.368 175.686 -1.318 25155 14648 1 18 . 1 1 30 30 VAL CA C 30 61.110 61.110 60.745 0.366 25155 14649 1 18 . 1 1 30 30 VAL CB C 30 34.500 34.500 35.477 -0.977 25155 14650 1 18 . 1 1 30 30 VAL H H 30 7.486 7.486 7.413 0.073 25155 14651 1 18 . 1 1 31 31 THR N N 31 124.000 124.000 120.926 3.074 25155 14652 1 18 . 1 1 31 31 THR HA H 31 4.331 4.331 4.665 -0.334 25155 14653 1 18 . 1 1 31 31 THR C C 31 172.670 172.670 173.218 -0.548 25155 14654 1 18 . 1 1 31 31 THR CA C 31 61.784 61.784 60.910 0.874 25155 14655 1 18 . 1 1 31 31 THR CB C 31 70.483 70.483 71.258 -0.775 25155 14656 1 18 . 1 1 31 31 THR H H 31 7.947 7.947 8.889 -0.942 25155 14657 1 18 . 1 1 32 32 LEU N N 32 127.408 127.408 126.382 1.026 25155 14658 1 18 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.565 0.072 25155 14659 1 18 . 1 1 32 32 LEU C C 32 176.425 176.425 176.888 -0.463 25155 14660 1 18 . 1 1 32 32 LEU CA C 32 54.760 54.760 55.034 -0.274 25155 14661 1 18 . 1 1 32 32 LEU CB C 32 43.809 43.809 42.889 0.920 25155 14662 1 18 . 1 1 32 32 LEU H H 32 8.614 8.614 8.737 -0.123 25155 14663 1 18 . 1 1 33 33 HIS N N 33 120.230 120.230 125.187 -4.957 25155 14664 1 18 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.924 -0.504 25155 14665 1 18 . 1 1 33 33 HIS C C 33 171.914 171.914 173.758 -1.844 25155 14666 1 18 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.599 0.701 25155 14667 1 18 . 1 1 33 33 HIS CB C 33 32.050 32.050 30.121 1.929 25155 14668 1 18 . 1 1 33 33 HIS H H 33 9.130 9.130 9.126 0.004 25155 14669 1 18 . 1 1 34 34 ASN N N 34 123.987 123.987 122.330 1.657 25155 14670 1 18 . 1 1 34 34 ASN HA H 34 3.600 3.600 3.963 -0.363 25155 14671 1 18 . 1 1 34 34 ASN C C 34 177.930 177.930 175.681 2.249 25155 14672 1 18 . 1 1 34 34 ASN CA C 34 51.730 51.730 51.971 -0.241 25155 14673 1 18 . 1 1 34 34 ASN CB C 34 38.747 38.747 38.402 0.345 25155 14674 1 18 . 1 1 34 34 ASN H H 34 8.759 8.759 7.947 0.812 25155 14675 1 18 . 1 1 35 35 LEU N N 35 128.751 128.751 126.125 2.626 25155 14676 1 18 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.146 0.144 25155 14677 1 18 . 1 1 35 35 LEU C C 35 177.363 177.363 178.065 -0.702 25155 14678 1 18 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.236 0.314 25155 14679 1 18 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.424 1.338 25155 14680 1 18 . 1 1 35 35 LEU H H 35 8.758 8.758 8.574 0.184 25155 14681 1 18 . 1 1 36 36 LYS N N 36 120.870 120.870 118.731 2.139 25155 14682 1 18 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.223 -0.290 25155 14683 1 18 . 1 1 36 36 LYS C C 36 176.540 176.540 177.028 -0.488 25155 14684 1 18 . 1 1 36 36 LYS CA C 36 59.260 59.260 58.140 1.120 25155 14685 1 18 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.614 0.186 25155 14686 1 18 . 1 1 37 37 ASP N N 37 115.288 115.288 115.669 -0.381 25155 14687 1 18 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.739 0.008 25155 14688 1 18 . 1 1 37 37 ASP C C 37 175.500 175.500 176.072 -0.572 25155 14689 1 18 . 1 1 37 37 ASP CA C 37 54.805 54.805 54.642 0.163 25155 14690 1 18 . 1 1 37 37 ASP CB C 37 44.650 44.650 43.490 1.160 25155 14691 1 18 . 1 1 38 38 ASP N N 38 121.550 121.550 121.478 0.072 25155 14692 1 18 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.864 0.001 25155 14693 1 18 . 1 1 38 38 ASP C C 38 174.895 174.895 175.957 -1.062 25155 14694 1 18 . 1 1 38 38 ASP CA C 38 52.840 52.840 54.260 -1.420 25155 14695 1 18 . 1 1 38 38 ASP CB C 38 42.240 42.240 42.144 0.096 25155 14696 1 18 . 1 1 39 39 SER N N 39 115.170 115.170 118.321 -3.151 25155 14697 1 18 . 1 1 39 39 SER HA H 39 4.600 4.600 4.643 -0.043 25155 14698 1 18 . 1 1 39 39 SER C C 39 174.930 174.930 174.357 0.573 25155 14699 1 18 . 1 1 39 39 SER CA C 39 54.786 54.786 56.803 -2.017 25155 14700 1 18 . 1 1 39 39 SER CB C 39 64.840 64.840 63.384 1.456 25155 14701 1 18 . 1 1 39 39 SER H H 39 8.330 8.330 8.663 -0.333 25155 14702 1 18 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.489 -0.489 25155 14703 1 18 . 1 1 40 40 PRO C C 40 176.620 176.620 178.230 -1.610 25155 14704 1 18 . 1 1 40 40 PRO CA C 40 63.870 63.870 64.981 -1.111 25155 14705 1 18 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.758 -0.398 25155 14706 1 18 . 1 1 41 41 LYS N N 41 120.913 120.913 119.344 1.569 25155 14707 1 18 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.137 -0.241 25155 14708 1 18 . 1 1 41 41 LYS C C 41 179.580 179.580 178.608 0.972 25155 14709 1 18 . 1 1 41 41 LYS CA C 41 58.000 58.000 58.463 -0.463 25155 14710 1 18 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.448 0.652 25155 14711 1 18 . 1 1 42 42 LEU N N 42 118.206 118.206 120.548 -2.342 25155 14712 1 18 . 1 1 42 42 LEU HA H 42 4.025 4.025 3.820 0.205 25155 14713 1 18 . 1 1 42 42 LEU C C 42 178.630 178.630 177.958 0.672 25155 14714 1 18 . 1 1 42 42 LEU CA C 42 57.030 57.030 57.120 -0.090 25155 14715 1 18 . 1 1 42 42 LEU CB C 42 41.820 41.820 40.925 0.895 25155 14716 1 18 . 1 1 42 42 LEU H H 42 7.598 7.598 7.519 0.079 25155 14717 1 18 . 1 1 43 43 MET N N 43 118.913 118.913 116.175 2.738 25155 14718 1 18 . 1 1 43 43 MET HA H 43 3.760 3.760 3.987 -0.227 25155 14719 1 18 . 1 1 43 43 MET C C 43 177.710 177.710 176.982 0.728 25155 14720 1 18 . 1 1 43 43 MET CA C 43 59.864 59.864 58.110 1.754 25155 14721 1 18 . 1 1 43 43 MET CB C 43 32.680 32.680 32.007 0.673 25155 14722 1 18 . 1 1 43 43 MET H H 43 8.180 8.180 7.935 0.245 25155 14723 1 18 . 1 1 44 44 GLU N N 44 110.906 110.906 116.427 -5.521 25155 14724 1 18 . 1 1 44 44 GLU HA H 44 3.732 3.732 3.977 -0.245 25155 14725 1 18 . 1 1 44 44 GLU C C 44 178.120 178.120 179.320 -1.200 25155 14726 1 18 . 1 1 44 44 GLU CA C 44 59.450 59.450 58.547 0.903 25155 14727 1 18 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.596 0.204 25155 14728 1 18 . 1 1 45 45 GLN N N 45 115.770 115.770 117.999 -2.229 25155 14729 1 18 . 1 1 45 45 GLN HA H 45 4.190 4.190 3.928 0.262 25155 14730 1 18 . 1 1 45 45 GLN C C 45 175.480 175.480 176.242 -0.762 25155 14731 1 18 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.358 -1.258 25155 14732 1 18 . 1 1 45 45 GLN CB C 45 28.490 28.490 28.668 -0.177 25155 14733 1 18 . 1 1 45 45 GLN H H 45 7.517 7.517 7.299 0.218 25155 14734 1 18 . 1 1 46 46 TYR N N 46 117.840 117.840 117.670 0.170 25155 14735 1 18 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.403 0.257 25155 14736 1 18 . 1 1 46 46 TYR C C 46 175.480 175.480 176.421 -0.941 25155 14737 1 18 . 1 1 46 46 TYR CA C 46 58.827 58.827 57.387 1.440 25155 14738 1 18 . 1 1 46 46 TYR CB C 46 41.720 41.720 38.454 3.266 25155 14739 1 18 . 1 1 46 46 TYR H H 46 6.955 6.955 7.090 -0.135 25155 14740 1 18 . 1 1 47 47 ASP N N 47 121.540 121.540 122.716 -1.176 25155 14741 1 18 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.598 0.098 25155 14742 1 18 . 1 1 47 47 ASP C C 47 175.677 175.677 175.836 -0.159 25155 14743 1 18 . 1 1 47 47 ASP CA C 47 56.812 56.812 57.050 -0.238 25155 14744 1 18 . 1 1 47 47 ASP CB C 47 42.978 42.978 41.766 1.212 25155 14745 1 18 . 1 1 48 48 VAL N N 48 118.666 118.666 117.453 1.213 25155 14746 1 18 . 1 1 48 48 VAL HA H 48 5.057 5.057 4.876 0.181 25155 14747 1 18 . 1 1 48 48 VAL C C 48 174.180 174.180 174.344 -0.164 25155 14748 1 18 . 1 1 48 48 VAL CA C 48 60.000 60.000 61.574 -1.574 25155 14749 1 18 . 1 1 48 48 VAL CB C 48 36.200 36.200 33.661 2.539 25155 14750 1 18 . 1 1 48 48 VAL H H 48 7.631 7.631 7.927 -0.296 25155 14751 1 18 . 1 1 49 49 LEU N N 49 128.300 128.300 127.770 0.530 25155 14752 1 18 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.114 0.486 25155 14753 1 18 . 1 1 49 49 LEU C C 49 174.810 174.810 175.053 -0.243 25155 14754 1 18 . 1 1 49 49 LEU CA C 49 52.230 52.230 54.210 -1.980 25155 14755 1 18 . 1 1 49 49 LEU CB C 49 45.400 45.400 45.246 0.154 25155 14756 1 18 . 1 1 49 49 LEU H H 49 9.469 9.469 8.903 0.566 25155 14757 1 18 . 1 1 50 50 ILE N N 50 124.400 124.400 127.861 -3.461 25155 14758 1 18 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.355 1.295 25155 14759 1 18 . 1 1 50 50 ILE C C 50 175.286 175.286 174.229 1.057 25155 14760 1 18 . 1 1 50 50 ILE CA C 50 59.900 59.900 61.511 -1.611 25155 14761 1 18 . 1 1 50 50 ILE CB C 50 40.200 40.200 39.295 0.905 25155 14762 1 18 . 1 1 50 50 ILE H H 50 9.213 9.213 9.247 -0.034 25155 14763 1 18 . 1 1 51 51 LEU N N 51 127.410 127.410 128.799 -1.389 25155 14764 1 18 . 1 1 51 51 LEU HA H 51 6.070 6.070 3.959 2.111 25155 14765 1 18 . 1 1 51 51 LEU C C 51 174.540 174.540 175.831 -1.291 25155 14766 1 18 . 1 1 51 51 LEU CA C 51 52.950 52.950 53.262 -0.312 25155 14767 1 18 . 1 1 51 51 LEU CB C 51 43.190 43.190 42.840 0.350 25155 14768 1 18 . 1 1 51 51 LEU H H 51 9.256 9.256 8.643 0.613 25155 14769 1 18 . 1 1 52 52 GLY N N 52 108.290 108.290 110.988 -2.698 25155 14770 1 18 . 1 1 52 52 GLY C C 52 174.330 174.330 171.756 2.574 25155 14771 1 18 . 1 1 52 52 GLY CA C 52 44.040 44.040 43.550 0.490 25155 14772 1 18 . 1 1 52 52 GLY H H 52 8.949 8.949 8.325 0.624 25155 14773 1 18 . 1 1 53 53 ILE N N 53 124.912 124.912 124.760 0.152 25155 14774 1 18 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.846 -0.671 25155 14775 1 18 . 1 1 53 53 ILE C C 53 174.470 174.470 173.035 1.435 25155 14776 1 18 . 1 1 53 53 ILE CA C 53 55.850 55.850 58.050 -2.200 25155 14777 1 18 . 1 1 53 53 ILE CB C 53 42.800 42.800 42.291 0.509 25155 14778 1 18 . 1 1 53 53 ILE H H 53 8.612 8.612 8.430 0.182 25155 14779 1 18 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.237 0.575 25155 14780 1 18 . 1 1 54 54 PRO C C 54 174.565 174.565 176.173 -1.608 25155 14781 1 18 . 1 1 54 54 PRO CA C 54 61.850 61.850 64.050 -2.200 25155 14782 1 18 . 1 1 54 54 PRO CB C 54 32.400 32.400 31.670 0.730 25155 14783 1 18 . 1 1 55 55 THR N N 55 116.040 116.040 110.324 5.716 25155 14784 1 18 . 1 1 55 55 THR HA H 55 4.522 4.522 4.036 0.486 25155 14785 1 18 . 1 1 55 55 THR C C 55 173.990 173.990 173.711 0.279 25155 14786 1 18 . 1 1 55 55 THR CA C 55 62.845 62.845 63.377 -0.532 25155 14787 1 18 . 1 1 55 55 THR CB C 55 70.795 70.795 69.096 1.699 25155 14788 1 18 . 1 1 55 55 THR H H 55 7.663 7.663 7.909 -0.246 25155 14789 1 18 . 1 1 56 56 TRP N N 56 130.540 130.540 128.220 2.320 25155 14790 1 18 . 1 1 56 56 TRP CA C 56 54.800 54.800 56.482 -1.682 25155 14791 1 18 . 1 1 56 56 TRP H H 56 9.075 9.075 8.305 0.770 25155 14792 1 18 . 1 1 58 58 PHE HA H 58 4.540 4.540 3.831 0.709 25155 14793 1 18 . 1 1 58 58 PHE C C 58 177.070 177.070 174.088 2.982 25155 14794 1 18 . 1 1 58 58 PHE CA C 58 55.460 55.460 58.134 -2.674 25155 14795 1 18 . 1 1 58 58 PHE CB C 58 41.200 41.200 37.965 3.236 25155 14796 1 18 . 1 1 59 59 GLY N N 59 109.796 109.796 104.958 4.838 25155 14797 1 18 . 1 1 59 59 GLY CA C 59 45.763 45.763 44.614 1.149 25155 14798 1 18 . 1 1 59 59 GLY H H 59 8.392 8.392 7.618 0.774 25155 14799 1 18 . 1 1 60 60 GLU C C 60 175.660 175.660 175.610 0.050 25155 14800 1 18 . 1 1 61 61 ILE N N 61 122.380 122.380 121.702 0.678 25155 14801 1 18 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.796 0.644 25155 14802 1 18 . 1 1 61 61 ILE CA C 61 62.100 62.100 62.261 -0.161 25155 14803 1 18 . 1 1 61 61 ILE CB C 61 38.750 38.750 37.415 1.335 25155 14804 1 18 . 1 1 61 61 ILE H H 61 8.436 8.436 8.139 0.297 25155 14805 1 18 . 1 1 62 62 GLN CB C 62 30.570 30.570 29.495 1.075 25155 14806 1 18 . 1 1 63 63 GLU HA H 63 4.030 4.030 4.011 0.019 25155 14807 1 18 . 1 1 63 63 GLU C C 63 177.134 177.134 178.213 -1.079 25155 14808 1 18 . 1 1 63 63 GLU CA C 63 60.520 60.520 59.977 0.543 25155 14809 1 18 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.514 0.136 25155 14810 1 18 . 1 1 64 64 ASP N N 64 119.630 119.630 118.039 1.591 25155 14811 1 18 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.575 0.017 25155 14812 1 18 . 1 1 64 64 ASP C C 64 178.680 178.680 177.419 1.261 25155 14813 1 18 . 1 1 64 64 ASP CA C 64 57.823 57.823 56.935 0.888 25155 14814 1 18 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.944 0.156 25155 14815 1 18 . 1 1 65 65 TRP N N 65 120.535 120.535 121.417 -0.882 25155 14816 1 18 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.674 -0.349 25155 14817 1 18 . 1 1 65 65 TRP C C 65 178.684 178.684 178.217 0.467 25155 14818 1 18 . 1 1 65 65 TRP CA C 65 60.500 60.500 59.415 1.085 25155 14819 1 18 . 1 1 65 65 TRP CB C 65 30.100 30.100 31.409 -1.309 25155 14820 1 18 . 1 1 65 65 TRP H H 65 7.416 7.416 7.913 -0.497 25155 14821 1 18 . 1 1 66 66 GLU N N 66 120.760 120.760 121.202 -0.442 25155 14822 1 18 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.248 -0.428 25155 14823 1 18 . 1 1 66 66 GLU C C 66 178.860 178.860 178.589 0.271 25155 14824 1 18 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.633 0.467 25155 14825 1 18 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.543 -0.533 25155 14826 1 18 . 1 1 67 67 ALA N N 67 118.972 118.972 121.037 -2.065 25155 14827 1 18 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.189 0.058 25155 14828 1 18 . 1 1 67 67 ALA C C 67 179.610 179.610 178.967 0.643 25155 14829 1 18 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.951 -0.351 25155 14830 1 18 . 1 1 67 67 ALA CB C 67 18.788 18.788 19.037 -0.249 25155 14831 1 18 . 1 1 67 67 ALA H H 67 7.690 7.690 8.431 -0.741 25155 14832 1 18 . 1 1 68 68 VAL N N 68 107.530 107.530 109.941 -2.411 25155 14833 1 18 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.415 0.295 25155 14834 1 18 . 1 1 68 68 VAL C C 68 176.800 176.800 177.104 -0.304 25155 14835 1 18 . 1 1 68 68 VAL CA C 68 60.060 60.060 62.371 -2.311 25155 14836 1 18 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.768 -0.168 25155 14837 1 18 . 1 1 68 68 VAL H H 68 7.240 7.240 7.754 -0.514 25155 14838 1 18 . 1 1 69 69 TRP N N 69 126.960 126.960 125.335 1.625 25155 14839 1 18 . 1 1 69 69 TRP HA H 69 4.182 4.182 4.500 -0.318 25155 14840 1 18 . 1 1 69 69 TRP C C 69 178.640 178.640 176.630 2.010 25155 14841 1 18 . 1 1 69 69 TRP CA C 69 61.300 61.300 62.326 -1.026 25155 14842 1 18 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.524 2.046 25155 14843 1 18 . 1 1 69 69 TRP H H 69 7.810 7.810 7.580 0.230 25155 14844 1 18 . 1 1 70 70 ASP N N 70 114.644 114.644 115.911 -1.267 25155 14845 1 18 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.645 -0.126 25155 14846 1 18 . 1 1 70 70 ASP C C 70 178.685 178.685 178.392 0.293 25155 14847 1 18 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.357 -0.357 25155 14848 1 18 . 1 1 70 70 ASP CB C 70 39.810 39.810 41.291 -1.481 25155 14849 1 18 . 1 1 71 71 GLN N N 71 120.100 120.100 117.547 2.553 25155 14850 1 18 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.293 -0.103 25155 14851 1 18 . 1 1 71 71 GLN C C 71 178.870 178.870 178.231 0.639 25155 14852 1 18 . 1 1 71 71 GLN CA C 71 57.617 57.617 57.459 0.158 25155 14853 1 18 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.560 -0.740 25155 14854 1 18 . 1 1 71 71 GLN H H 71 7.980 7.980 8.064 -0.084 25155 14855 1 18 . 1 1 72 72 LEU N N 72 117.535 117.535 120.655 -3.120 25155 14856 1 18 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.982 -0.185 25155 14857 1 18 . 1 1 72 72 LEU C C 72 178.308 178.308 178.856 -0.548 25155 14858 1 18 . 1 1 72 72 LEU CA C 72 57.340 57.340 57.319 0.021 25155 14859 1 18 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.312 0.388 25155 14860 1 18 . 1 1 72 72 LEU H H 72 7.435 7.435 7.691 -0.256 25155 14861 1 18 . 1 1 73 73 ASP N N 73 115.534 115.534 119.814 -4.280 25155 14862 1 18 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.390 -0.240 25155 14863 1 18 . 1 1 73 73 ASP C C 73 177.553 177.553 176.948 0.605 25155 14864 1 18 . 1 1 73 73 ASP CA C 73 57.350 57.350 56.776 0.574 25155 14865 1 18 . 1 1 73 73 ASP CB C 73 40.040 40.040 40.772 -0.732 25155 14866 1 18 . 1 1 74 74 ASP N N 74 117.300 117.300 119.163 -1.863 25155 14867 1 18 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.563 0.143 25155 14868 1 18 . 1 1 74 74 ASP C C 74 176.424 176.424 176.946 -0.522 25155 14869 1 18 . 1 1 74 74 ASP CA C 74 54.170 54.170 55.137 -0.967 25155 14870 1 18 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.432 0.388 25155 14871 1 18 . 1 1 75 75 LEU N N 75 118.500 118.500 119.981 -1.481 25155 14872 1 18 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.190 0.105 25155 14873 1 18 . 1 1 75 75 LEU C C 75 176.800 176.800 176.508 0.292 25155 14874 1 18 . 1 1 75 75 LEU CA C 75 54.400 54.400 54.777 -0.377 25155 14875 1 18 . 1 1 75 75 LEU CB C 75 43.280 43.280 42.247 1.033 25155 14876 1 18 . 1 1 75 75 LEU H H 75 6.966 6.966 7.269 -0.303 25155 14877 1 18 . 1 1 76 76 ASN N N 76 123.040 123.040 119.311 3.729 25155 14878 1 18 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.689 0.173 25155 14879 1 18 . 1 1 76 76 ASN C C 76 174.927 174.927 174.803 0.124 25155 14880 1 18 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.281 -1.400 25155 14881 1 18 . 1 1 76 76 ASN CB C 76 37.510 37.510 38.808 -1.298 25155 14882 1 18 . 1 1 76 76 ASN H H 76 9.882 9.882 9.092 0.790 25155 14883 1 18 . 1 1 77 77 LEU N N 77 123.614 123.614 123.786 -0.172 25155 14884 1 18 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.546 -0.176 25155 14885 1 18 . 1 1 77 77 LEU C C 77 175.110 175.110 176.518 -1.408 25155 14886 1 18 . 1 1 77 77 LEU CA C 77 52.200 52.200 54.118 -1.918 25155 14887 1 18 . 1 1 77 77 LEU CB C 77 42.786 42.786 42.666 0.120 25155 14888 1 18 . 1 1 77 77 LEU H H 77 8.700 8.700 8.284 0.416 25155 14889 1 18 . 1 1 78 78 GLU N N 78 120.822 120.822 121.401 -0.579 25155 14890 1 18 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.243 -0.343 25155 14891 1 18 . 1 1 78 78 GLU C C 78 178.670 178.670 178.033 0.637 25155 14892 1 18 . 1 1 78 78 GLU CA C 78 58.700 58.700 57.991 0.709 25155 14893 1 18 . 1 1 78 78 GLU CB C 78 29.467 29.467 29.503 -0.037 25155 14894 1 18 . 1 1 79 79 GLY N N 79 113.160 113.160 112.906 0.254 25155 14895 1 18 . 1 1 79 79 GLY C C 79 174.523 174.523 174.104 0.419 25155 14896 1 18 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.361 0.059 25155 14897 1 18 . 1 1 79 79 GLY H H 79 8.450 8.450 8.590 -0.140 25155 14898 1 18 . 1 1 80 80 LYS N N 80 120.283 120.283 120.465 -0.182 25155 14899 1 18 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.323 0.035 25155 14900 1 18 . 1 1 80 80 LYS C C 80 175.304 175.304 176.134 -0.830 25155 14901 1 18 . 1 1 80 80 LYS CA C 80 56.890 56.890 56.174 0.716 25155 14902 1 18 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.805 -0.685 25155 14903 1 18 . 1 1 81 81 ILE N N 81 122.288 122.288 122.426 -0.138 25155 14904 1 18 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.504 0.302 25155 14905 1 18 . 1 1 81 81 ILE C C 81 174.750 174.750 175.395 -0.645 25155 14906 1 18 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.590 -1.770 25155 14907 1 18 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.366 0.484 25155 14908 1 18 . 1 1 81 81 ILE H H 81 7.405 7.405 8.167 -0.762 25155 14909 1 18 . 1 1 82 82 VAL N N 82 127.793 127.793 126.171 1.622 25155 14910 1 18 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.114 0.166 25155 14911 1 18 . 1 1 82 82 VAL C C 82 172.680 172.680 174.140 -1.460 25155 14912 1 18 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.431 -0.331 25155 14913 1 18 . 1 1 82 82 VAL CB C 82 35.280 35.280 36.327 -1.047 25155 14914 1 18 . 1 1 82 82 VAL H H 82 8.800 8.800 8.941 -0.141 25155 14915 1 18 . 1 1 83 83 ALA N N 83 130.911 130.911 127.646 3.265 25155 14916 1 18 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.883 -0.494 25155 14917 1 18 . 1 1 83 83 ALA C C 83 175.870 175.870 176.218 -0.348 25155 14918 1 18 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.105 0.895 25155 14919 1 18 . 1 1 83 83 ALA CB C 83 23.722 23.722 22.892 0.830 25155 14920 1 18 . 1 1 83 83 ALA H H 83 9.252 9.252 8.671 0.581 25155 14921 1 18 . 1 1 84 84 LEU N N 84 124.269 124.269 120.372 3.897 25155 14922 1 18 . 1 1 84 84 LEU HA H 84 5.508 5.508 5.383 0.125 25155 14923 1 18 . 1 1 84 84 LEU C C 84 175.490 175.490 175.465 0.025 25155 14924 1 18 . 1 1 84 84 LEU CA C 84 53.670 53.670 54.481 -0.811 25155 14925 1 18 . 1 1 84 84 LEU CB C 84 45.000 45.000 46.391 -1.391 25155 14926 1 18 . 1 1 84 84 LEU H H 84 10.378 10.378 9.080 1.298 25155 14927 1 18 . 1 1 85 85 TYR N N 85 115.826 115.826 118.136 -2.310 25155 14928 1 18 . 1 1 85 85 TYR HA H 85 4.950 4.950 4.900 0.050 25155 14929 1 18 . 1 1 85 85 TYR C C 85 172.661 172.661 173.144 -0.483 25155 14930 1 18 . 1 1 85 85 TYR CA C 85 55.853 55.853 56.015 -0.162 25155 14931 1 18 . 1 1 85 85 TYR CB C 85 43.200 43.200 40.941 2.260 25155 14932 1 18 . 1 1 85 85 TYR H H 85 9.200 9.200 8.087 1.113 25155 14933 1 18 . 1 1 86 86 GLY N N 86 106.802 106.802 105.976 0.826 25155 14934 1 18 . 1 1 86 86 GLY C C 86 170.348 170.348 171.460 -1.112 25155 14935 1 18 . 1 1 86 86 GLY CA C 86 44.687 44.687 45.325 -0.638 25155 14936 1 18 . 1 1 86 86 GLY H H 86 8.752 8.752 7.695 1.057 25155 14937 1 18 . 1 1 87 87 LEU N N 87 120.860 120.860 116.216 4.644 25155 14938 1 18 . 1 1 87 87 LEU HA H 87 5.476 5.476 5.181 0.295 25155 14939 1 18 . 1 1 87 87 LEU C C 87 177.720 177.720 175.824 1.896 25155 14940 1 18 . 1 1 87 87 LEU CA C 87 52.630 52.630 52.408 0.222 25155 14941 1 18 . 1 1 87 87 LEU CB C 87 45.900 45.900 44.260 1.640 25155 14942 1 18 . 1 1 87 87 LEU H H 87 6.320 6.320 8.229 -1.909 25155 14943 1 18 . 1 1 88 88 GLY N N 88 109.910 109.910 106.814 3.096 25155 14944 1 18 . 1 1 88 88 GLY C C 88 171.386 171.386 171.421 -0.035 25155 14945 1 18 . 1 1 88 88 GLY CA C 88 45.710 45.710 43.044 2.666 25155 14946 1 18 . 1 1 88 88 GLY H H 88 8.320 8.320 8.467 -0.147 25155 14947 1 18 . 1 1 89 89 ASP N N 89 121.580 121.580 118.096 3.484 25155 14948 1 18 . 1 1 89 89 ASP HA H 89 5.190 5.190 5.117 0.073 25155 14949 1 18 . 1 1 89 89 ASP C C 89 176.608 176.608 176.827 -0.219 25155 14950 1 18 . 1 1 89 89 ASP CA C 89 52.200 52.200 53.330 -1.130 25155 14951 1 18 . 1 1 89 89 ASP CB C 89 41.900 41.900 43.048 -1.148 25155 14952 1 18 . 1 1 90 90 GLN N N 90 123.900 123.900 123.844 0.056 25155 14953 1 18 . 1 1 90 90 GLN HA H 90 3.645 3.645 4.464 -0.819 25155 14954 1 18 . 1 1 90 90 GLN C C 90 173.523 173.523 175.709 -2.186 25155 14955 1 18 . 1 1 90 90 GLN CA C 90 58.706 58.706 57.750 0.956 25155 14956 1 18 . 1 1 90 90 GLN CB C 90 28.800 28.800 28.767 0.033 25155 14957 1 18 . 1 1 90 90 GLN H H 90 8.726 8.726 9.092 -0.366 25155 14958 1 18 . 1 1 91 91 LEU N N 91 117.080 117.080 118.627 -1.547 25155 14959 1 18 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.308 0.162 25155 14960 1 18 . 1 1 91 91 LEU C C 91 179.840 179.840 178.360 1.480 25155 14961 1 18 . 1 1 91 91 LEU CA C 91 55.800 55.800 55.605 0.195 25155 14962 1 18 . 1 1 91 91 LEU CB C 91 41.640 41.640 42.403 -0.763 25155 14963 1 18 . 1 1 91 91 LEU H H 91 7.092 7.092 8.358 -1.266 25155 14964 1 18 . 1 1 92 92 GLY N N 92 110.460 110.460 104.607 5.853 25155 14965 1 18 . 1 1 92 92 GLY C C 92 174.824 174.824 175.891 -1.067 25155 14966 1 18 . 1 1 92 92 GLY CA C 92 46.390 46.390 45.725 0.665 25155 14967 1 18 . 1 1 92 92 GLY H H 92 9.243 9.243 8.704 0.539 25155 14968 1 18 . 1 1 93 93 TYR N N 93 118.140 118.140 123.395 -5.255 25155 14969 1 18 . 1 1 93 93 TYR HA H 93 5.173 5.173 4.673 0.500 25155 14970 1 18 . 1 1 93 93 TYR C C 93 177.805 177.805 175.950 1.855 25155 14971 1 18 . 1 1 93 93 TYR CA C 93 57.430 57.430 55.794 1.635 25155 14972 1 18 . 1 1 93 93 TYR CB C 93 39.300 39.300 36.336 2.964 25155 14973 1 18 . 1 1 93 93 TYR H H 93 7.252 7.252 8.437 -1.185 25155 14974 1 18 . 1 1 94 94 GLY N N 94 112.455 112.455 108.342 4.113 25155 14975 1 18 . 1 1 94 94 GLY C C 94 177.740 177.740 175.206 2.534 25155 14976 1 18 . 1 1 94 94 GLY CA C 94 49.880 49.880 46.745 3.135 25155 14977 1 18 . 1 1 94 94 GLY H H 94 8.154 8.154 7.868 0.286 25155 14978 1 18 . 1 1 95 95 GLU N N 95 123.040 123.040 119.060 3.980 25155 14979 1 18 . 1 1 95 95 GLU HA H 95 4.000 4.000 4.288 -0.288 25155 14980 1 18 . 1 1 95 95 GLU C C 95 175.145 175.145 176.963 -1.818 25155 14981 1 18 . 1 1 95 95 GLU CA C 95 57.950 57.950 57.569 0.381 25155 14982 1 18 . 1 1 95 95 GLU CB C 95 27.400 27.400 29.627 -2.227 25155 14983 1 18 . 1 1 96 96 TRP N N 96 118.000 118.000 116.975 1.025 25155 14984 1 18 . 1 1 96 96 TRP HA H 96 5.213 5.213 4.895 0.318 25155 14985 1 18 . 1 1 96 96 TRP C C 96 176.616 176.616 176.244 0.372 25155 14986 1 18 . 1 1 96 96 TRP CA C 96 57.120 57.120 54.908 2.212 25155 14987 1 18 . 1 1 96 96 TRP CB C 96 29.970 29.970 29.588 0.382 25155 14988 1 18 . 1 1 96 96 TRP H H 96 7.785 7.785 7.421 0.364 25155 14989 1 18 . 1 1 97 97 PHE N N 97 123.268 123.268 122.981 0.287 25155 14990 1 18 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.272 0.388 25155 14991 1 18 . 1 1 97 97 PHE CA C 97 58.742 58.742 60.837 -2.095 25155 14992 1 18 . 1 1 97 97 PHE CB C 97 40.835 40.835 39.124 1.711 25155 14993 1 18 . 1 1 97 97 PHE H H 97 7.054 7.054 8.314 -1.260 25155 14994 1 18 . 1 1 98 98 LEU HA H 98 3.440 3.440 3.696 -0.256 25155 14995 1 18 . 1 1 98 98 LEU C C 98 176.613 176.613 177.465 -0.852 25155 14996 1 18 . 1 1 98 98 LEU CA C 98 56.000 56.000 55.313 0.687 25155 14997 1 18 . 1 1 98 98 LEU CB C 98 38.600 38.600 39.448 -0.848 25155 14998 1 18 . 1 1 98 98 LEU H H 98 8.584 8.584 8.748 -0.164 25155 14999 1 18 . 1 1 99 99 ASP N N 99 123.268 123.268 120.819 2.449 25155 15000 1 18 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.389 -0.424 25155 15001 1 18 . 1 1 99 99 ASP C C 99 178.876 178.876 176.926 1.950 25155 15002 1 18 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.612 1.648 25155 15003 1 18 . 1 1 99 99 ASP CB C 99 40.350 40.350 41.215 -0.865 25155 15004 1 18 . 1 1 100 100 ALA N N 100 119.124 119.124 120.409 -1.285 25155 15005 1 18 . 1 1 100 100 ALA HA H 100 3.822 3.822 4.130 -0.308 25155 15006 1 18 . 1 1 100 100 ALA C C 100 178.490 178.490 178.958 -0.468 25155 15007 1 18 . 1 1 100 100 ALA CA C 100 55.100 55.100 54.412 0.688 25155 15008 1 18 . 1 1 100 100 ALA CB C 100 19.700 19.700 18.617 1.083 25155 15009 1 18 . 1 1 100 100 ALA H H 100 8.400 8.400 7.517 0.883 25155 15010 1 18 . 1 1 101 101 LEU N N 101 118.687 118.687 119.120 -0.433 25155 15011 1 18 . 1 1 101 101 LEU HA H 101 3.674 3.674 4.150 -0.476 25155 15012 1 18 . 1 1 101 101 LEU C C 101 179.050 179.050 179.080 -0.030 25155 15013 1 18 . 1 1 101 101 LEU CA C 101 57.800 57.800 58.329 -0.529 25155 15014 1 18 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.484 1.166 25155 15015 1 18 . 1 1 101 101 LEU H H 101 6.518 6.518 8.063 -1.545 25155 15016 1 18 . 1 1 102 102 GLY N N 102 104.410 104.410 107.110 -2.700 25155 15017 1 18 . 1 1 102 102 GLY C C 102 176.056 176.056 176.149 -0.093 25155 15018 1 18 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.304 0.446 25155 15019 1 18 . 1 1 102 102 GLY H H 102 7.712 7.712 7.796 -0.084 25155 15020 1 18 . 1 1 103 103 MET N N 103 120.550 120.550 121.732 -1.182 25155 15021 1 18 . 1 1 103 103 MET HA H 103 4.256 4.256 4.401 -0.145 25155 15022 1 18 . 1 1 103 103 MET C C 103 179.650 179.650 178.474 1.176 25155 15023 1 18 . 1 1 103 103 MET CA C 103 59.450 59.450 59.673 -0.223 25155 15024 1 18 . 1 1 103 103 MET CB C 103 32.300 32.300 32.832 -0.532 25155 15025 1 18 . 1 1 103 103 MET H H 103 8.485 8.485 7.620 0.865 25155 15026 1 18 . 1 1 104 104 LEU N N 104 123.480 123.480 120.204 3.276 25155 15027 1 18 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.123 -0.062 25155 15028 1 18 . 1 1 104 104 LEU C C 104 177.750 177.750 178.724 -0.974 25155 15029 1 18 . 1 1 104 104 LEU CA C 104 58.100 58.100 57.006 1.094 25155 15030 1 18 . 1 1 104 104 LEU CB C 104 41.450 41.450 41.033 0.417 25155 15031 1 18 . 1 1 104 104 LEU H H 104 8.392 8.392 8.036 0.356 25155 15032 1 18 . 1 1 105 105 HIS N N 105 119.570 119.570 120.198 -0.628 25155 15033 1 18 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.214 -0.362 25155 15034 1 18 . 1 1 105 105 HIS C C 105 177.550 177.550 176.880 0.670 25155 15035 1 18 . 1 1 105 105 HIS CA C 105 61.000 61.000 60.781 0.219 25155 15036 1 18 . 1 1 105 105 HIS CB C 105 28.820 28.820 29.974 -1.154 25155 15037 1 18 . 1 1 105 105 HIS H H 105 8.247 8.247 8.826 -0.579 25155 15038 1 18 . 1 1 106 106 ASP N N 106 119.780 119.780 119.323 0.457 25155 15039 1 18 . 1 1 106 106 ASP HA H 106 4.333 4.333 4.420 -0.087 25155 15040 1 18 . 1 1 106 106 ASP C C 106 179.410 179.410 178.469 0.941 25155 15041 1 18 . 1 1 106 106 ASP CA C 106 57.800 57.800 57.228 0.572 25155 15042 1 18 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.257 -0.657 25155 15043 1 18 . 1 1 107 107 LYS N N 107 121.660 121.660 118.594 3.066 25155 15044 1 18 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.124 -0.024 25155 15045 1 18 . 1 1 107 107 LYS C C 107 178.316 178.316 178.008 0.308 25155 15046 1 18 . 1 1 107 107 LYS CA C 107 58.750 58.750 59.059 -0.309 25155 15047 1 18 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.592 -0.742 25155 15048 1 18 . 1 1 108 108 LEU N N 108 116.050 116.050 117.271 -1.221 25155 15049 1 18 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.401 -0.391 25155 15050 1 18 . 1 1 108 108 LEU C C 108 179.050 179.050 178.235 0.815 25155 15051 1 18 . 1 1 108 108 LEU CA C 108 56.240 56.240 55.758 0.482 25155 15052 1 18 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.488 -0.688 25155 15053 1 18 . 1 1 108 108 LEU H H 108 8.072 8.072 7.634 0.438 25155 15054 1 18 . 1 1 109 109 SER N N 109 116.280 116.280 115.380 0.900 25155 15055 1 18 . 1 1 109 109 SER HA H 109 4.300 4.300 4.285 0.015 25155 15056 1 18 . 1 1 109 109 SER C C 109 175.848 175.848 175.957 -0.109 25155 15057 1 18 . 1 1 109 109 SER CA C 109 62.410 62.410 61.588 0.822 25155 15058 1 18 . 1 1 109 109 SER CB C 109 62.850 62.850 63.342 -0.492 25155 15059 1 18 . 1 1 109 109 SER H H 109 8.366 8.366 7.998 0.368 25155 15060 1 18 . 1 1 110 110 THR N N 110 110.416 110.416 109.920 0.496 25155 15061 1 18 . 1 1 110 110 THR HA H 110 4.614 4.614 4.323 0.291 25155 15062 1 18 . 1 1 110 110 THR C C 110 175.675 175.675 175.519 0.156 25155 15063 1 18 . 1 1 110 110 THR CA C 110 62.030 62.030 63.635 -1.605 25155 15064 1 18 . 1 1 110 110 THR CB C 110 68.810 68.810 68.893 -0.083 25155 15065 1 18 . 1 1 110 110 THR H H 110 7.185 7.185 8.026 -0.841 25155 15066 1 18 . 1 1 111 111 LYS N N 111 120.090 120.090 120.697 -0.607 25155 15067 1 18 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.404 0.109 25155 15068 1 18 . 1 1 111 111 LYS C C 111 176.814 176.814 176.588 0.226 25155 15069 1 18 . 1 1 111 111 LYS CA C 111 55.730 55.730 55.740 -0.010 25155 15070 1 18 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.410 -1.480 25155 15071 1 18 . 1 1 112 112 GLY N N 112 107.540 107.540 108.007 -0.467 25155 15072 1 18 . 1 1 112 112 GLY C C 112 176.223 176.223 174.245 1.978 25155 15073 1 18 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.312 1.614 25155 15074 1 18 . 1 1 112 112 GLY H H 112 8.315 8.315 7.498 0.817 25155 15075 1 18 . 1 1 113 113 VAL N N 113 113.536 113.536 114.653 -1.117 25155 15076 1 18 . 1 1 113 113 VAL HA H 113 4.494 4.494 4.333 0.161 25155 15077 1 18 . 1 1 113 113 VAL C C 113 174.560 174.560 174.833 -0.273 25155 15078 1 18 . 1 1 113 113 VAL CA C 113 59.550 59.550 60.909 -1.359 25155 15079 1 18 . 1 1 113 113 VAL CB C 113 32.800 32.800 32.258 0.542 25155 15080 1 18 . 1 1 113 113 VAL H H 113 6.835 6.835 7.040 -0.205 25155 15081 1 18 . 1 1 114 114 LYS N N 114 122.920 122.920 121.513 1.407 25155 15082 1 18 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.416 0.078 25155 15083 1 18 . 1 1 114 114 LYS C C 114 174.925 174.925 174.777 0.148 25155 15084 1 18 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.130 0.150 25155 15085 1 18 . 1 1 114 114 LYS CB C 114 33.630 33.630 33.845 -0.215 25155 15086 1 18 . 1 1 115 115 PHE N N 115 123.140 123.140 124.560 -1.420 25155 15087 1 18 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.309 0.391 25155 15088 1 18 . 1 1 115 115 PHE C C 115 177.580 177.580 175.996 1.584 25155 15089 1 18 . 1 1 115 115 PHE CA C 115 58.677 58.677 57.816 0.861 25155 15090 1 18 . 1 1 115 115 PHE CB C 115 41.120 41.120 40.230 0.890 25155 15091 1 18 . 1 1 115 115 PHE H H 115 8.506 8.506 8.683 -0.177 25155 15092 1 18 . 1 1 116 116 VAL N N 116 115.737 115.737 115.476 0.261 25155 15093 1 18 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.289 0.189 25155 15094 1 18 . 1 1 116 116 VAL C C 116 175.300 175.300 175.638 -0.338 25155 15095 1 18 . 1 1 116 116 VAL CA C 116 58.877 58.877 59.867 -0.990 25155 15096 1 18 . 1 1 116 116 VAL CB C 116 34.120 34.120 34.643 -0.523 25155 15097 1 18 . 1 1 116 116 VAL H H 116 8.860 8.860 8.842 0.018 25155 15098 1 18 . 1 1 117 117 GLY N N 117 108.137 108.137 109.800 -1.663 25155 15099 1 18 . 1 1 117 117 GLY C C 117 176.110 176.110 174.954 1.156 25155 15100 1 18 . 1 1 117 117 GLY CA C 117 47.500 47.500 45.546 1.954 25155 15101 1 18 . 1 1 117 117 GLY H H 117 9.838 9.838 9.423 0.415 25155 15102 1 18 . 1 1 118 118 TYR N N 118 120.380 120.380 119.188 1.192 25155 15103 1 18 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.857 0.113 25155 15104 1 18 . 1 1 118 118 TYR C C 118 177.630 177.630 176.103 1.527 25155 15105 1 18 . 1 1 118 118 TYR CA C 118 55.800 55.800 57.991 -2.191 25155 15106 1 18 . 1 1 118 118 TYR CB C 118 35.970 35.970 38.828 -2.858 25155 15107 1 18 . 1 1 118 118 TYR H H 118 8.652 8.652 7.575 1.077 25155 15108 1 18 . 1 1 119 119 TRP N N 119 126.040 126.040 120.125 5.915 25155 15109 1 18 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.156 0.865 25155 15110 1 18 . 1 1 119 119 TRP C C 119 173.000 173.000 174.206 -1.206 25155 15111 1 18 . 1 1 119 119 TRP CA C 119 53.820 53.820 55.120 -1.300 25155 15112 1 18 . 1 1 119 119 TRP CB C 119 36.050 36.050 32.998 3.052 25155 15113 1 18 . 1 1 119 119 TRP H H 119 8.070 8.070 8.298 -0.228 25155 15114 1 18 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.537 0.247 25155 15115 1 18 . 1 1 120 120 PRO C C 120 176.870 176.870 176.739 0.131 25155 15116 1 18 . 1 1 120 120 PRO CA C 120 63.780 63.780 62.942 0.838 25155 15117 1 18 . 1 1 120 120 PRO CB C 120 31.990 31.990 32.390 -0.400 25155 15118 1 18 . 1 1 121 121 THR N N 121 109.310 109.310 112.510 -3.200 25155 15119 1 18 . 1 1 121 121 THR HA H 121 4.073 4.073 3.614 0.459 25155 15120 1 18 . 1 1 121 121 THR C C 121 176.324 176.324 175.613 0.711 25155 15121 1 18 . 1 1 121 121 THR CA C 121 61.250 61.250 62.730 -1.480 25155 15122 1 18 . 1 1 121 121 THR CB C 121 69.730 69.730 68.588 1.142 25155 15123 1 18 . 1 1 121 121 THR H H 121 7.370 7.370 7.934 -0.564 25155 15124 1 18 . 1 1 122 122 GLU N N 122 123.937 123.937 122.563 1.374 25155 15125 1 18 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.178 0.046 25155 15126 1 18 . 1 1 122 122 GLU C C 122 177.737 177.737 177.359 0.378 25155 15127 1 18 . 1 1 122 122 GLU CA C 122 58.200 58.200 58.006 0.194 25155 15128 1 18 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.380 0.420 25155 15129 1 18 . 1 1 123 123 GLY N N 123 114.563 114.563 111.968 2.595 25155 15130 1 18 . 1 1 123 123 GLY C C 123 173.783 173.783 174.803 -1.020 25155 15131 1 18 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.243 0.137 25155 15132 1 18 . 1 1 123 123 GLY H H 123 9.144 9.144 8.841 0.303 25155 15133 1 18 . 1 1 124 124 TYR N N 124 118.800 118.800 120.716 -1.916 25155 15134 1 18 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.511 0.707 25155 15135 1 18 . 1 1 124 124 TYR C C 124 175.673 175.673 176.060 -0.387 25155 15136 1 18 . 1 1 124 124 TYR CA C 124 56.950 56.950 58.076 -1.126 25155 15137 1 18 . 1 1 124 124 TYR CB C 124 41.100 41.100 39.397 1.703 25155 15138 1 18 . 1 1 124 124 TYR H H 124 7.895 7.895 8.037 -0.142 25155 15139 1 18 . 1 1 125 125 GLU N N 125 124.790 124.790 124.169 0.621 25155 15140 1 18 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.635 0.050 25155 15141 1 18 . 1 1 125 125 GLU C C 125 172.877 172.877 175.217 -2.340 25155 15142 1 18 . 1 1 125 125 GLU CA C 125 55.700 55.700 55.716 -0.016 25155 15143 1 18 . 1 1 125 125 GLU CB C 125 31.340 31.340 29.915 1.425 25155 15144 1 18 . 1 1 126 126 PHE N N 126 118.670 118.670 119.692 -1.022 25155 15145 1 18 . 1 1 126 126 PHE HA H 126 4.841 4.841 4.965 -0.124 25155 15146 1 18 . 1 1 126 126 PHE C C 126 173.800 173.800 173.773 0.027 25155 15147 1 18 . 1 1 126 126 PHE CA C 126 56.950 56.950 57.104 -0.154 25155 15148 1 18 . 1 1 126 126 PHE CB C 126 40.300 40.300 40.651 -0.351 25155 15149 1 18 . 1 1 126 126 PHE H H 126 7.645 7.645 7.911 -0.266 25155 15150 1 18 . 1 1 127 127 THR N N 127 107.038 107.038 114.400 -7.362 25155 15151 1 18 . 1 1 127 127 THR HA H 127 4.370 4.370 4.186 0.184 25155 15152 1 18 . 1 1 127 127 THR C C 127 175.100 175.100 174.850 0.250 25155 15153 1 18 . 1 1 127 127 THR CA C 127 61.080 61.080 61.092 -0.012 25155 15154 1 18 . 1 1 127 127 THR CB C 127 70.500 70.500 69.334 1.166 25155 15155 1 18 . 1 1 127 127 THR H H 127 7.306 7.306 8.917 -1.611 25155 15156 1 18 . 1 1 128 128 SER N N 128 118.150 118.150 120.003 -1.853 25155 15157 1 18 . 1 1 128 128 SER HA H 128 4.650 4.650 4.775 -0.125 25155 15158 1 18 . 1 1 128 128 SER C C 128 175.760 175.760 174.354 1.406 25155 15159 1 18 . 1 1 128 128 SER CA C 128 55.813 55.813 56.515 -0.702 25155 15160 1 18 . 1 1 128 128 SER CB C 128 65.300 65.300 64.078 1.222 25155 15161 1 18 . 1 1 128 128 SER H H 128 7.354 7.354 7.874 -0.520 25155 15162 1 18 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.518 0.246 25155 15163 1 18 . 1 1 129 129 PRO C C 129 178.860 178.860 178.557 0.303 25155 15164 1 18 . 1 1 129 129 PRO CA C 129 62.728 62.728 64.535 -1.807 25155 15165 1 18 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.390 0.010 25155 15166 1 18 . 1 1 130 130 LYS N N 130 122.158 122.158 119.863 2.295 25155 15167 1 18 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.156 0.054 25155 15168 1 18 . 1 1 130 130 LYS C C 130 176.890 176.890 175.800 1.090 25155 15169 1 18 . 1 1 130 130 LYS CA C 130 61.375 61.375 60.346 1.029 25155 15170 1 18 . 1 1 130 130 LYS CB C 130 30.350 30.350 30.938 -0.588 25155 15171 1 18 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.466 0.067 25155 15172 1 18 . 1 1 131 131 PRO C C 131 173.810 173.810 175.626 -1.816 25155 15173 1 18 . 1 1 131 131 PRO CA C 131 64.510 64.510 63.955 0.555 25155 15174 1 18 . 1 1 131 131 PRO CB C 131 31.745 31.745 31.867 -0.122 25155 15175 1 18 . 1 1 132 132 VAL N N 132 114.480 114.480 112.864 1.616 25155 15176 1 18 . 1 1 132 132 VAL HA H 132 5.158 5.158 5.153 0.005 25155 15177 1 18 . 1 1 132 132 VAL C C 132 175.137 175.137 174.160 0.977 25155 15178 1 18 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.061 0.739 25155 15179 1 18 . 1 1 132 132 VAL CB C 132 34.780 34.780 35.596 -0.817 25155 15180 1 18 . 1 1 132 132 VAL H H 132 6.716 6.716 7.578 -0.862 25155 15181 1 18 . 1 1 133 133 ILE N N 133 120.670 120.670 112.216 8.454 25155 15182 1 18 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.530 -0.138 25155 15183 1 18 . 1 1 133 133 ILE C C 133 175.485 175.485 174.725 0.760 25155 15184 1 18 . 1 1 133 133 ILE CA C 133 60.000 60.000 59.271 0.729 25155 15185 1 18 . 1 1 133 133 ILE CB C 133 42.020 42.020 40.966 1.054 25155 15186 1 18 . 1 1 133 133 ILE H H 133 8.740 8.740 8.178 0.562 25155 15187 1 18 . 1 1 134 134 ALA N N 134 122.454 122.454 122.741 -0.287 25155 15188 1 18 . 1 1 134 134 ALA HA H 134 3.953 3.953 3.913 0.040 25155 15189 1 18 . 1 1 134 134 ALA C C 134 178.387 178.387 177.329 1.058 25155 15190 1 18 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.355 -0.305 25155 15191 1 18 . 1 1 134 134 ALA CB C 134 16.982 16.982 17.091 -0.109 25155 15192 1 18 . 1 1 134 134 ALA H H 134 8.490 8.490 8.520 -0.030 25155 15193 1 18 . 1 1 135 135 ASP N N 135 117.310 117.310 116.969 0.341 25155 15194 1 18 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.293 -0.049 25155 15195 1 18 . 1 1 135 135 ASP C C 135 176.390 176.390 176.874 -0.484 25155 15196 1 18 . 1 1 135 135 ASP CA C 135 55.120 55.120 54.568 0.552 25155 15197 1 18 . 1 1 135 135 ASP CB C 135 39.865 39.865 40.047 -0.182 25155 15198 1 18 . 1 1 136 136 GLY N N 136 104.336 104.336 103.820 0.516 25155 15199 1 18 . 1 1 136 136 GLY C C 136 174.940 174.940 175.294 -0.354 25155 15200 1 18 . 1 1 136 136 GLY CA C 136 45.150 45.150 45.254 -0.104 25155 15201 1 18 . 1 1 136 136 GLY H H 136 7.592 7.592 7.837 -0.245 25155 15202 1 18 . 1 1 137 137 GLN N N 137 118.675 118.675 119.204 -0.529 25155 15203 1 18 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.468 -0.406 25155 15204 1 18 . 1 1 137 137 GLN C C 137 176.420 176.420 174.995 1.425 25155 15205 1 18 . 1 1 137 137 GLN CA C 137 57.760 57.760 56.970 0.790 25155 15206 1 18 . 1 1 137 137 GLN CB C 137 30.400 30.400 30.093 0.307 25155 15207 1 18 . 1 1 137 137 GLN H H 137 7.843 7.843 7.901 -0.058 25155 15208 1 18 . 1 1 138 138 LEU N N 138 118.160 118.160 118.663 -0.503 25155 15209 1 18 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.820 0.141 25155 15210 1 18 . 1 1 138 138 LEU C C 138 175.700 175.700 174.834 0.866 25155 15211 1 18 . 1 1 138 138 LEU CA C 138 53.705 53.705 53.067 0.638 25155 15212 1 18 . 1 1 138 138 LEU CB C 138 46.480 46.480 45.579 0.901 25155 15213 1 18 . 1 1 138 138 LEU H H 138 7.356 7.356 7.278 0.078 25155 15214 1 18 . 1 1 139 139 PHE N N 139 119.060 119.060 120.976 -1.916 25155 15215 1 18 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.738 0.606 25155 15216 1 18 . 1 1 139 139 PHE C C 139 178.850 178.850 178.078 0.772 25155 15217 1 18 . 1 1 139 139 PHE CA C 139 56.670 56.670 58.004 -1.334 25155 15218 1 18 . 1 1 139 139 PHE CB C 139 43.652 43.652 39.256 4.396 25155 15219 1 18 . 1 1 139 139 PHE H H 139 10.026 10.026 9.004 1.022 25155 15220 1 18 . 1 1 140 140 VAL N N 140 109.905 109.905 117.384 -7.479 25155 15221 1 18 . 1 1 140 140 VAL HA H 140 3.500 3.500 3.635 -0.135 25155 15222 1 18 . 1 1 140 140 VAL C C 140 172.860 172.860 175.322 -2.462 25155 15223 1 18 . 1 1 140 140 VAL CA C 140 61.812 61.812 63.558 -1.746 25155 15224 1 18 . 1 1 140 140 VAL CB C 140 30.250 30.250 31.073 -0.823 25155 15225 1 18 . 1 1 140 140 VAL H H 140 7.550 7.550 8.512 -0.962 25155 15226 1 18 . 1 1 141 141 GLY N N 141 106.600 106.600 105.900 0.700 25155 15227 1 18 . 1 1 141 141 GLY C C 141 171.350 171.350 172.799 -1.449 25155 15228 1 18 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.305 1.155 25155 15229 1 18 . 1 1 141 141 GLY H H 141 7.052 7.052 7.399 -0.347 25155 15230 1 18 . 1 1 142 142 LEU N N 142 117.820 117.820 121.488 -3.668 25155 15231 1 18 . 1 1 142 142 LEU HA H 142 4.962 4.962 4.261 0.701 25155 15232 1 18 . 1 1 142 142 LEU CA C 142 55.600 55.600 55.111 0.489 25155 15233 1 18 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.465 -4.535 25155 15234 1 18 . 1 1 142 142 LEU H H 142 7.643 7.643 8.423 -0.780 25155 15235 1 18 . 1 1 143 143 ALA HA H 143 4.220 4.220 3.980 0.240 25155 15236 1 18 . 1 1 143 143 ALA C C 143 175.505 175.505 175.699 -0.194 25155 15237 1 18 . 1 1 143 143 ALA CA C 143 49.600 49.600 50.058 -0.458 25155 15238 1 18 . 1 1 143 143 ALA CB C 143 23.330 23.330 18.191 5.139 25155 15239 1 18 . 1 1 144 144 LEU N N 144 124.960 124.960 124.372 0.588 25155 15240 1 18 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.242 0.538 25155 15241 1 18 . 1 1 144 144 LEU C C 144 174.700 174.700 175.040 -0.340 25155 15242 1 18 . 1 1 144 144 LEU CA C 144 52.790 52.790 54.198 -1.408 25155 15243 1 18 . 1 1 144 144 LEU CB C 144 45.300 45.300 43.382 1.918 25155 15244 1 18 . 1 1 144 144 LEU H H 144 8.583 8.583 7.585 0.999 25155 15245 1 18 . 1 1 145 145 ASP N N 145 119.100 119.100 120.948 -1.848 25155 15246 1 18 . 1 1 145 145 ASP HA H 145 5.422 5.422 4.992 0.430 25155 15247 1 18 . 1 1 145 145 ASP C C 145 176.180 176.180 175.755 0.425 25155 15248 1 18 . 1 1 145 145 ASP CA C 145 53.600 53.600 53.362 0.238 25155 15249 1 18 . 1 1 145 145 ASP CB C 145 43.180 43.180 42.690 0.490 25155 15250 1 18 . 1 1 147 147 THR HA H 147 4.093 4.093 4.137 -0.044 25155 15251 1 18 . 1 1 147 147 THR C C 147 175.858 175.858 176.509 -0.651 25155 15252 1 18 . 1 1 147 147 THR CA C 147 66.400 66.400 65.646 0.754 25155 15253 1 18 . 1 1 147 147 THR CB C 147 69.400 69.400 68.529 0.871 25155 15254 1 18 . 1 1 147 147 THR H H 147 8.745 8.745 7.806 0.939 25155 15255 1 18 . 1 1 148 148 ASN N N 148 115.408 115.408 118.029 -2.621 25155 15256 1 18 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.799 0.211 25155 15257 1 18 . 1 1 148 148 ASN C C 148 175.750 175.750 175.027 0.723 25155 15258 1 18 . 1 1 148 148 ASN CA C 148 53.400 53.400 54.628 -1.228 25155 15259 1 18 . 1 1 148 148 ASN CB C 148 41.900 41.900 40.345 1.555 25155 15260 1 18 . 1 1 148 148 ASN H H 148 8.975 8.975 8.697 0.278 25155 15261 1 18 . 1 1 149 149 GLN N N 149 117.900 117.900 117.071 0.829 25155 15262 1 18 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.463 0.473 25155 15263 1 18 . 1 1 149 149 GLN C C 149 178.280 178.280 175.988 2.292 25155 15264 1 18 . 1 1 149 149 GLN CA C 149 53.730 53.730 55.177 -1.447 25155 15265 1 18 . 1 1 149 149 GLN CB C 149 29.790 29.790 28.507 1.283 25155 15266 1 18 . 1 1 149 149 GLN H H 149 7.430 7.430 7.600 -0.170 25155 15267 1 18 . 1 1 150 150 TYR N N 150 121.060 121.060 121.255 -0.195 25155 15268 1 18 . 1 1 150 150 TYR HA H 150 4.671 4.671 4.023 0.648 25155 15269 1 18 . 1 1 150 150 TYR C C 150 178.680 178.680 176.524 2.156 25155 15270 1 18 . 1 1 150 150 TYR CA C 150 57.930 57.930 61.126 -3.196 25155 15271 1 18 . 1 1 150 150 TYR CB C 150 38.860 38.860 37.206 1.654 25155 15272 1 18 . 1 1 150 150 TYR H H 150 8.115 8.115 7.864 0.251 25155 15273 1 18 . 1 1 151 151 ASP N N 151 121.175 121.175 119.472 1.703 25155 15274 1 18 . 1 1 151 151 ASP CA C 151 57.000 57.000 55.791 1.209 25155 15275 1 18 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.358 1.642 25155 15276 1 18 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.468 0.122 25155 15277 1 18 . 1 1 152 152 LEU C C 152 178.300 178.300 177.667 0.633 25155 15278 1 18 . 1 1 152 152 LEU CA C 152 54.788 54.788 54.453 0.335 25155 15279 1 18 . 1 1 152 152 LEU CB C 152 42.200 42.200 41.637 0.563 25155 15280 1 18 . 1 1 153 153 SER N N 153 116.170 116.170 116.909 -0.739 25155 15281 1 18 . 1 1 153 153 SER HA H 153 3.911 3.911 3.980 -0.069 25155 15282 1 18 . 1 1 153 153 SER CA C 153 63.400 63.400 61.888 1.512 25155 15283 1 18 . 1 1 153 153 SER CB C 153 63.200 63.200 62.780 0.420 25155 15284 1 18 . 1 1 153 153 SER H H 153 7.378 7.378 7.757 -0.379 25155 15285 1 18 . 1 1 154 154 ASP N N 154 121.640 121.640 121.403 0.237 25155 15286 1 18 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.321 -0.081 25155 15287 1 18 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.440 1.860 25155 15288 1 18 . 1 1 154 154 ASP CB C 154 40.000 40.000 40.804 -0.804 25155 15289 1 18 . 1 1 155 155 GLU HA H 155 4.170 4.170 4.056 0.114 25155 15290 1 18 . 1 1 155 155 GLU C C 155 179.420 179.420 178.926 0.494 25155 15291 1 18 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.378 -0.178 25155 15292 1 18 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.552 -0.072 25155 15293 1 18 . 1 1 156 156 ARG N N 156 121.230 121.230 118.712 2.518 25155 15294 1 18 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.350 -0.074 25155 15295 1 18 . 1 1 156 156 ARG C C 156 177.350 177.350 179.562 -2.212 25155 15296 1 18 . 1 1 156 156 ARG CA C 156 59.950 59.950 59.222 0.728 25155 15297 1 18 . 1 1 156 156 ARG CB C 156 31.100 31.100 30.261 0.839 25155 15298 1 18 . 1 1 157 157 ILE N N 157 118.190 118.190 120.603 -2.413 25155 15299 1 18 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.753 -0.323 25155 15300 1 18 . 1 1 157 157 ILE C C 157 178.480 178.480 177.601 0.879 25155 15301 1 18 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.349 1.211 25155 15302 1 18 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.933 0.547 25155 15303 1 18 . 1 1 157 157 ILE H H 157 8.705 8.705 8.244 0.461 25155 15304 1 18 . 1 1 158 158 GLN N N 158 119.975 119.975 120.873 -0.898 25155 15305 1 18 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.902 0.054 25155 15306 1 18 . 1 1 158 158 GLN C C 158 178.730 178.730 178.286 0.444 25155 15307 1 18 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.334 1.366 25155 15308 1 18 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.288 0.194 25155 15309 1 18 . 1 1 158 158 GLN H H 158 8.262 8.262 8.560 -0.298 25155 15310 1 18 . 1 1 159 159 SER N N 159 115.466 115.466 115.155 0.311 25155 15311 1 18 . 1 1 159 159 SER HA H 159 4.446 4.446 4.269 0.177 25155 15312 1 18 . 1 1 159 159 SER C C 159 177.320 177.320 176.733 0.587 25155 15313 1 18 . 1 1 159 159 SER CA C 159 63.500 63.500 61.096 2.404 25155 15314 1 18 . 1 1 159 159 SER CB C 159 63.818 63.818 63.172 0.646 25155 15315 1 18 . 1 1 159 159 SER H H 159 8.440 8.440 8.485 -0.045 25155 15316 1 18 . 1 1 160 160 TRP N N 160 126.784 126.784 125.045 1.739 25155 15317 1 18 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.393 0.061 25155 15318 1 18 . 1 1 160 160 TRP C C 160 177.934 177.934 177.665 0.269 25155 15319 1 18 . 1 1 160 160 TRP CA C 160 62.745 62.745 62.009 0.736 25155 15320 1 18 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.369 -0.019 25155 15321 1 18 . 1 1 160 160 TRP H H 160 9.243 9.243 7.752 1.491 25155 15322 1 18 . 1 1 161 161 CYS N N 161 116.395 116.395 118.791 -2.396 25155 15323 1 18 . 1 1 161 161 CYS HA H 161 3.886 3.886 3.717 0.169 25155 15324 1 18 . 1 1 161 161 CYS C C 161 176.245 176.245 177.055 -0.810 25155 15325 1 18 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.785 0.515 25155 15326 1 18 . 1 1 161 161 CYS CB C 161 27.723 27.723 27.150 0.573 25155 15327 1 18 . 1 1 161 161 CYS H H 161 8.845 8.845 9.123 -0.278 25155 15328 1 18 . 1 1 162 162 GLU N N 162 118.030 118.030 119.387 -1.357 25155 15329 1 18 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.836 0.084 25155 15330 1 18 . 1 1 162 162 GLU C C 162 178.700 178.700 178.717 -0.017 25155 15331 1 18 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.487 0.313 25155 15332 1 18 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.234 0.266 25155 15333 1 18 . 1 1 163 163 GLN N N 163 120.650 120.650 119.580 1.070 25155 15334 1 18 . 1 1 163 163 GLN HA H 163 4.173 4.173 3.997 0.176 25155 15335 1 18 . 1 1 163 163 GLN C C 163 179.700 179.700 178.484 1.216 25155 15336 1 18 . 1 1 163 163 GLN CA C 163 59.688 59.688 58.910 0.778 25155 15337 1 18 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.728 0.172 25155 15338 1 18 . 1 1 163 163 GLN H H 163 8.148 8.148 7.833 0.315 25155 15339 1 18 . 1 1 164 164 ILE N N 164 114.836 114.836 116.723 -1.887 25155 15340 1 18 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.583 0.477 25155 15341 1 18 . 1 1 164 164 ILE C C 164 178.676 178.676 177.647 1.029 25155 15342 1 18 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.331 1.829 25155 15343 1 18 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.308 0.322 25155 15344 1 18 . 1 1 164 164 ILE H H 164 8.958 8.958 8.175 0.783 25155 15345 1 18 . 1 1 165 165 LEU N N 165 123.700 123.700 120.023 3.677 25155 15346 1 18 . 1 1 165 165 LEU HA H 165 4.100 4.100 4.042 0.058 25155 15347 1 18 . 1 1 165 165 LEU C C 165 180.548 180.548 178.248 2.300 25155 15348 1 18 . 1 1 165 165 LEU CA C 165 58.150 58.150 58.023 0.127 25155 15349 1 18 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.346 -0.216 25155 15350 1 18 . 1 1 165 165 LEU H H 165 7.830 7.830 7.638 0.192 25155 15351 1 18 . 1 1 166 166 ASN N N 166 120.160 120.160 118.307 1.853 25155 15352 1 18 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.252 0.318 25155 15353 1 18 . 1 1 166 166 ASN C C 166 175.690 175.690 177.104 -1.414 25155 15354 1 18 . 1 1 166 166 ASN CA C 166 55.946 55.946 56.543 -0.597 25155 15355 1 18 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.439 0.041 25155 15356 1 18 . 1 1 166 166 ASN H H 166 7.706 7.706 7.910 -0.204 25155 15357 1 18 . 1 1 167 167 GLU N N 167 121.286 121.286 120.213 1.073 25155 15358 1 18 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.337 -0.233 25155 15359 1 18 . 1 1 167 167 GLU C C 167 180.520 180.520 177.944 2.576 25155 15360 1 18 . 1 1 167 167 GLU CA C 167 59.920 59.920 58.370 1.550 25155 15361 1 18 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.647 1.278 25155 15362 1 18 . 1 1 168 168 MET N N 168 118.622 118.622 116.578 2.044 25155 15363 1 18 . 1 1 168 168 MET HA H 168 3.996 3.996 4.806 -0.810 25155 15364 1 18 . 1 1 168 168 MET C C 168 176.856 176.856 178.080 -1.224 25155 15365 1 18 . 1 1 168 168 MET CA C 168 59.500 59.500 58.230 1.270 25155 15366 1 18 . 1 1 168 168 MET CB C 168 33.700 33.700 33.218 0.482 25155 15367 1 18 . 1 1 168 168 MET H H 168 8.723 8.723 8.167 0.556 25155 15368 1 18 . 1 1 169 169 ALA N N 169 121.760 121.760 123.310 -1.550 25155 15369 1 18 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.166 -0.010 25155 15370 1 18 . 1 1 169 169 ALA C C 169 179.790 179.790 178.673 1.117 25155 15371 1 18 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.199 0.601 25155 15372 1 18 . 1 1 169 169 ALA CB C 169 18.220 18.220 18.962 -0.742 25155 15373 1 18 . 1 1 169 169 ALA H H 169 7.494 7.494 7.828 -0.334 25155 15374 1 18 . 1 1 170 170 GLU N N 170 116.970 116.970 117.746 -0.776 25155 15375 1 18 . 1 1 170 170 GLU HA H 170 4.091 4.091 3.856 0.235 25155 15376 1 18 . 1 1 170 170 GLU C C 170 177.745 177.745 177.796 -0.051 25155 15377 1 18 . 1 1 170 170 GLU CA C 170 58.000 58.000 58.610 -0.610 25155 15378 1 18 . 1 1 170 170 GLU CB C 170 29.730 29.730 28.953 0.777 25155 15379 1 18 . 1 1 171 171 HIS N N 171 118.150 118.150 116.249 1.901 25155 15380 1 18 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.363 0.107 25155 15381 1 18 . 1 1 171 171 HIS C C 171 175.848 175.848 175.939 -0.091 25155 15382 1 18 . 1 1 171 171 HIS CA C 171 57.600 57.600 57.683 -0.083 25155 15383 1 18 . 1 1 171 171 HIS CB C 171 30.800 30.800 29.950 0.850 25155 15384 1 18 . 1 1 171 171 HIS H H 171 7.717 7.717 7.178 0.539 25155 15385 1 18 . 1 1 172 172 TYR N N 172 119.483 119.483 116.729 2.754 25155 15386 1 18 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.622 -0.031 25155 15387 1 18 . 1 1 172 172 TYR C C 172 174.590 174.590 176.293 -1.703 25155 15388 1 18 . 1 1 172 172 TYR CA C 172 57.813 57.813 56.864 0.949 25155 15389 1 18 . 1 1 172 172 TYR CB C 172 38.900 38.900 38.947 -0.047 25155 15390 1 18 . 1 1 172 172 TYR H H 172 7.778 7.778 7.850 -0.072 25155 15391 1 19 . 1 1 2 2 ASN N N 2 122.966 122.966 118.678 4.288 25155 15392 1 19 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.151 0.024 25155 15393 1 19 . 1 1 2 2 ASN C C 2 175.200 175.200 174.040 1.160 25155 15394 1 19 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.692 0.228 25155 15395 1 19 . 1 1 2 2 ASN CB C 2 40.000 40.000 41.615 -1.615 25155 15396 1 19 . 1 1 2 2 ASN H H 2 9.392 9.392 8.313 1.079 25155 15397 1 19 . 1 1 3 3 MET N N 3 120.660 120.660 120.788 -0.128 25155 15398 1 19 . 1 1 3 3 MET HA H 3 5.565 5.565 5.109 0.456 25155 15399 1 19 . 1 1 3 3 MET C C 3 174.200 174.200 175.233 -1.033 25155 15400 1 19 . 1 1 3 3 MET CA C 3 54.550 54.550 54.113 0.437 25155 15401 1 19 . 1 1 3 3 MET CB C 3 34.100 34.100 35.719 -1.619 25155 15402 1 19 . 1 1 3 3 MET H H 3 8.745 8.745 8.701 0.044 25155 15403 1 19 . 1 1 4 4 GLY N N 4 115.792 115.792 109.648 6.144 25155 15404 1 19 . 1 1 4 4 GLY C C 4 170.444 170.444 172.023 -1.579 25155 15405 1 19 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.159 -0.272 25155 15406 1 19 . 1 1 4 4 GLY H H 4 8.989 8.989 8.845 0.144 25155 15407 1 19 . 1 1 5 5 LEU N N 5 131.175 131.175 124.658 6.517 25155 15408 1 19 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.385 0.937 25155 15409 1 19 . 1 1 5 5 LEU C C 5 175.700 175.700 174.726 0.974 25155 15410 1 19 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.786 -0.466 25155 15411 1 19 . 1 1 5 5 LEU CB C 5 44.700 44.700 44.018 0.682 25155 15412 1 19 . 1 1 5 5 LEU H H 5 8.917 8.917 8.121 0.796 25155 15413 1 19 . 1 1 6 6 PHE N N 6 125.990 125.990 125.172 0.818 25155 15414 1 19 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.703 0.035 25155 15415 1 19 . 1 1 6 6 PHE C C 6 174.358 174.358 173.426 0.932 25155 15416 1 19 . 1 1 6 6 PHE CA C 6 55.480 55.480 55.016 0.464 25155 15417 1 19 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.640 -0.590 25155 15418 1 19 . 1 1 6 6 PHE H H 6 9.225 9.225 9.418 -0.193 25155 15419 1 19 . 1 1 7 7 TYR N N 7 118.040 118.040 118.361 -0.321 25155 15420 1 19 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.522 0.407 25155 15421 1 19 . 1 1 7 7 TYR C C 7 171.690 171.690 174.153 -2.463 25155 15422 1 19 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.389 -0.929 25155 15423 1 19 . 1 1 7 7 TYR CB C 7 40.800 40.800 40.532 0.268 25155 15424 1 19 . 1 1 7 7 TYR H H 7 8.235 8.235 8.018 0.217 25155 15425 1 19 . 1 1 8 8 GLY N N 8 106.640 106.640 107.093 -0.453 25155 15426 1 19 . 1 1 8 8 GLY C C 8 171.682 171.682 174.104 -2.422 25155 15427 1 19 . 1 1 8 8 GLY CA C 8 44.050 44.050 43.819 0.231 25155 15428 1 19 . 1 1 8 8 GLY H H 8 6.996 6.996 8.707 -1.711 25155 15429 1 19 . 1 1 9 9 SER N N 9 118.164 118.164 115.063 3.101 25155 15430 1 19 . 1 1 9 9 SER C C 9 174.560 174.560 174.911 -0.351 25155 15431 1 19 . 1 1 9 9 SER CA C 9 57.140 57.140 60.772 -3.632 25155 15432 1 19 . 1 1 9 9 SER H H 9 9.680 9.680 9.040 0.640 25155 15433 1 19 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.930 -0.300 25155 15434 1 19 . 1 1 17 17 ALA C C 17 177.740 177.740 179.273 -1.533 25155 15435 1 19 . 1 1 17 17 ALA CA C 17 54.900 54.900 54.961 -0.061 25155 15436 1 19 . 1 1 17 17 ALA CB C 17 17.790 17.790 17.670 0.120 25155 15437 1 19 . 1 1 17 17 ALA H H 17 8.055 8.055 7.407 0.648 25155 15438 1 19 . 1 1 18 18 ALA N N 18 120.026 120.026 121.423 -1.397 25155 15439 1 19 . 1 1 18 18 ALA HA H 18 3.713 3.713 3.848 -0.135 25155 15440 1 19 . 1 1 18 18 ALA C C 18 179.040 179.040 179.620 -0.580 25155 15441 1 19 . 1 1 18 18 ALA CA C 18 54.860 54.860 55.014 -0.154 25155 15442 1 19 . 1 1 18 18 ALA CB C 18 18.200 18.200 17.871 0.329 25155 15443 1 19 . 1 1 18 18 ALA H H 18 7.015 7.015 8.172 -1.157 25155 15444 1 19 . 1 1 19 19 GLU N N 19 116.656 116.656 118.382 -1.726 25155 15445 1 19 . 1 1 19 19 GLU HA H 19 3.580 3.580 3.964 -0.384 25155 15446 1 19 . 1 1 19 19 GLU C C 19 178.487 178.487 179.509 -1.022 25155 15447 1 19 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.679 -0.009 25155 15448 1 19 . 1 1 19 19 GLU CB C 19 29.400 29.400 29.592 -0.192 25155 15449 1 19 . 1 1 20 20 LYS N N 20 120.100 120.100 120.277 -0.177 25155 15450 1 19 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.070 0.276 25155 15451 1 19 . 1 1 20 20 LYS C C 20 175.330 175.330 179.036 -3.706 25155 15452 1 19 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.340 -2.240 25155 15453 1 19 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.495 0.506 25155 15454 1 19 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.723 -0.258 25155 15455 1 19 . 1 1 21 21 ILE C C 21 177.680 177.680 178.000 -0.320 25155 15456 1 19 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.552 0.089 25155 15457 1 19 . 1 1 21 21 ILE CB C 21 38.030 38.030 38.000 0.030 25155 15458 1 19 . 1 1 21 21 ILE H H 21 8.220 8.220 8.602 -0.382 25155 15459 1 19 . 1 1 22 22 ARG N N 22 119.433 119.433 118.457 0.976 25155 15460 1 19 . 1 1 22 22 ARG HA H 22 3.550 3.550 4.038 -0.488 25155 15461 1 19 . 1 1 22 22 ARG C C 22 177.268 177.268 178.261 -0.993 25155 15462 1 19 . 1 1 22 22 ARG CA C 22 59.760 59.760 58.752 1.008 25155 15463 1 19 . 1 1 22 22 ARG CB C 22 28.900 28.900 29.020 -0.120 25155 15464 1 19 . 1 1 23 23 ASP N N 23 118.945 118.945 119.986 -1.041 25155 15465 1 19 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.434 -0.092 25155 15466 1 19 . 1 1 23 23 ASP C C 23 178.470 178.470 178.589 -0.119 25155 15467 1 19 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.178 0.272 25155 15468 1 19 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.912 -0.542 25155 15469 1 19 . 1 1 24 24 ILE N N 24 121.200 121.200 119.233 1.967 25155 15470 1 19 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.814 -0.080 25155 15471 1 19 . 1 1 24 24 ILE C C 24 178.297 178.297 177.944 0.353 25155 15472 1 19 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.558 -0.059 25155 15473 1 19 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.529 0.211 25155 15474 1 19 . 1 1 24 24 ILE H H 24 8.160 8.160 7.995 0.165 25155 15475 1 19 . 1 1 25 25 ILE N N 25 121.166 121.166 117.643 3.523 25155 15476 1 19 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.854 -0.211 25155 15477 1 19 . 1 1 25 25 ILE C C 25 176.825 176.825 176.741 0.084 25155 15478 1 19 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.313 2.576 25155 15479 1 19 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.788 -1.038 25155 15480 1 19 . 1 1 25 25 ILE H H 25 8.480 8.480 8.080 0.400 25155 15481 1 19 . 1 1 26 26 GLY N N 26 109.050 109.050 104.787 4.263 25155 15482 1 19 . 1 1 26 26 GLY C C 26 173.800 173.800 172.610 1.190 25155 15483 1 19 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.505 -0.105 25155 15484 1 19 . 1 1 26 26 GLY H H 26 7.945 7.945 7.763 0.182 25155 15485 1 19 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.365 -0.002 25155 15486 1 19 . 1 1 27 27 PRO C C 27 177.157 177.157 177.803 -0.646 25155 15487 1 19 . 1 1 27 27 PRO CA C 27 64.530 64.530 64.143 0.387 25155 15488 1 19 . 1 1 27 27 PRO CB C 27 32.000 32.000 31.993 0.007 25155 15489 1 19 . 1 1 28 28 GLU N N 28 116.510 116.510 117.839 -1.329 25155 15490 1 19 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.215 0.045 25155 15491 1 19 . 1 1 28 28 GLU C C 28 177.000 177.000 176.844 0.156 25155 15492 1 19 . 1 1 28 28 GLU CA C 28 57.680 57.680 58.276 -0.596 25155 15493 1 19 . 1 1 28 28 GLU CB C 28 28.620 28.620 28.893 -0.273 25155 15494 1 19 . 1 1 29 29 LEU N N 29 120.334 120.334 112.641 7.693 25155 15495 1 19 . 1 1 29 29 LEU HA H 29 4.650 4.650 4.939 -0.289 25155 15496 1 19 . 1 1 29 29 LEU C C 29 175.676 175.676 174.876 0.800 25155 15497 1 19 . 1 1 29 29 LEU CA C 29 55.924 55.924 54.845 1.079 25155 15498 1 19 . 1 1 29 29 LEU CB C 29 44.880 44.880 44.325 0.555 25155 15499 1 19 . 1 1 29 29 LEU H H 29 7.924 7.924 7.520 0.404 25155 15500 1 19 . 1 1 30 30 VAL N N 30 118.900 118.900 120.107 -1.207 25155 15501 1 19 . 1 1 30 30 VAL HA H 30 4.639 4.639 4.973 -0.334 25155 15502 1 19 . 1 1 30 30 VAL C C 30 174.368 174.368 175.737 -1.369 25155 15503 1 19 . 1 1 30 30 VAL CA C 30 61.110 61.110 60.242 0.868 25155 15504 1 19 . 1 1 30 30 VAL CB C 30 34.500 34.500 35.131 -0.631 25155 15505 1 19 . 1 1 30 30 VAL H H 30 7.486 7.486 7.405 0.081 25155 15506 1 19 . 1 1 31 31 THR N N 31 124.000 124.000 120.498 3.502 25155 15507 1 19 . 1 1 31 31 THR HA H 31 4.331 4.331 4.640 -0.309 25155 15508 1 19 . 1 1 31 31 THR C C 31 172.670 172.670 173.220 -0.550 25155 15509 1 19 . 1 1 31 31 THR CA C 31 61.784 61.784 60.805 0.979 25155 15510 1 19 . 1 1 31 31 THR CB C 31 70.483 70.483 71.220 -0.737 25155 15511 1 19 . 1 1 31 31 THR H H 31 7.947 7.947 8.863 -0.915 25155 15512 1 19 . 1 1 32 32 LEU N N 32 127.408 127.408 126.825 0.583 25155 15513 1 19 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.448 0.189 25155 15514 1 19 . 1 1 32 32 LEU C C 32 176.425 176.425 176.893 -0.468 25155 15515 1 19 . 1 1 32 32 LEU CA C 32 54.760 54.760 55.444 -0.685 25155 15516 1 19 . 1 1 32 32 LEU CB C 32 43.809 43.809 42.934 0.875 25155 15517 1 19 . 1 1 32 32 LEU H H 32 8.614 8.614 8.738 -0.124 25155 15518 1 19 . 1 1 33 33 HIS N N 33 120.230 120.230 124.542 -4.312 25155 15519 1 19 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.814 -0.394 25155 15520 1 19 . 1 1 33 33 HIS C C 33 171.914 171.914 173.694 -1.780 25155 15521 1 19 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.351 0.949 25155 15522 1 19 . 1 1 33 33 HIS CB C 33 32.050 32.050 30.509 1.541 25155 15523 1 19 . 1 1 33 33 HIS H H 33 9.130 9.130 9.153 -0.023 25155 15524 1 19 . 1 1 34 34 ASN N N 34 123.987 123.987 120.834 3.153 25155 15525 1 19 . 1 1 34 34 ASN HA H 34 3.600 3.600 3.812 -0.212 25155 15526 1 19 . 1 1 34 34 ASN C C 34 177.930 177.930 175.211 2.719 25155 15527 1 19 . 1 1 34 34 ASN CA C 34 51.730 51.730 53.852 -2.122 25155 15528 1 19 . 1 1 34 34 ASN CB C 34 38.747 38.747 38.605 0.142 25155 15529 1 19 . 1 1 34 34 ASN H H 34 8.759 8.759 8.558 0.201 25155 15530 1 19 . 1 1 35 35 LEU N N 35 128.751 128.751 124.589 4.162 25155 15531 1 19 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.182 0.108 25155 15532 1 19 . 1 1 35 35 LEU C C 35 177.363 177.363 178.028 -0.665 25155 15533 1 19 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.243 0.307 25155 15534 1 19 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.912 0.850 25155 15535 1 19 . 1 1 35 35 LEU H H 35 8.758 8.758 8.514 0.244 25155 15536 1 19 . 1 1 36 36 LYS N N 36 120.870 120.870 118.547 2.323 25155 15537 1 19 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.097 -0.164 25155 15538 1 19 . 1 1 36 36 LYS C C 36 176.540 176.540 177.369 -0.829 25155 15539 1 19 . 1 1 36 36 LYS CA C 36 59.260 59.260 57.819 1.441 25155 15540 1 19 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.270 0.530 25155 15541 1 19 . 1 1 37 37 ASP N N 37 115.288 115.288 117.340 -2.052 25155 15542 1 19 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.606 0.141 25155 15543 1 19 . 1 1 37 37 ASP C C 37 175.500 175.500 176.389 -0.889 25155 15544 1 19 . 1 1 37 37 ASP CA C 37 54.805 54.805 55.512 -0.707 25155 15545 1 19 . 1 1 37 37 ASP CB C 37 44.650 44.650 42.253 2.397 25155 15546 1 19 . 1 1 38 38 ASP N N 38 121.550 121.550 118.108 3.442 25155 15547 1 19 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.936 -0.071 25155 15548 1 19 . 1 1 38 38 ASP C C 38 174.895 174.895 174.745 0.150 25155 15549 1 19 . 1 1 38 38 ASP CA C 38 52.840 52.840 53.119 -0.279 25155 15550 1 19 . 1 1 38 38 ASP CB C 38 42.240 42.240 44.300 -2.060 25155 15551 1 19 . 1 1 39 39 SER N N 39 115.170 115.170 116.777 -1.607 25155 15552 1 19 . 1 1 39 39 SER HA H 39 4.600 4.600 4.783 -0.183 25155 15553 1 19 . 1 1 39 39 SER C C 39 174.930 174.930 174.300 0.630 25155 15554 1 19 . 1 1 39 39 SER CA C 39 54.786 54.786 57.014 -2.228 25155 15555 1 19 . 1 1 39 39 SER CB C 39 64.840 64.840 63.346 1.494 25155 15556 1 19 . 1 1 39 39 SER H H 39 8.330 8.330 8.666 -0.336 25155 15557 1 19 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.496 -0.496 25155 15558 1 19 . 1 1 40 40 PRO C C 40 176.620 176.620 177.872 -1.252 25155 15559 1 19 . 1 1 40 40 PRO CA C 40 63.870 63.870 64.964 -1.094 25155 15560 1 19 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.776 -0.416 25155 15561 1 19 . 1 1 41 41 LYS N N 41 120.913 120.913 117.782 3.131 25155 15562 1 19 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.161 -0.265 25155 15563 1 19 . 1 1 41 41 LYS C C 41 179.580 179.580 178.406 1.174 25155 15564 1 19 . 1 1 41 41 LYS CA C 41 58.000 58.000 57.713 0.287 25155 15565 1 19 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.151 0.949 25155 15566 1 19 . 1 1 42 42 LEU N N 42 118.206 118.206 120.633 -2.427 25155 15567 1 19 . 1 1 42 42 LEU HA H 42 4.025 4.025 3.857 0.168 25155 15568 1 19 . 1 1 42 42 LEU C C 42 178.630 178.630 178.165 0.465 25155 15569 1 19 . 1 1 42 42 LEU CA C 42 57.030 57.030 56.778 0.252 25155 15570 1 19 . 1 1 42 42 LEU CB C 42 41.820 41.820 40.584 1.236 25155 15571 1 19 . 1 1 42 42 LEU H H 42 7.598 7.598 7.504 0.094 25155 15572 1 19 . 1 1 43 43 MET N N 43 118.913 118.913 116.663 2.250 25155 15573 1 19 . 1 1 43 43 MET HA H 43 3.760 3.760 4.027 -0.267 25155 15574 1 19 . 1 1 43 43 MET C C 43 177.710 177.710 177.839 -0.129 25155 15575 1 19 . 1 1 43 43 MET CA C 43 59.864 59.864 58.329 1.535 25155 15576 1 19 . 1 1 43 43 MET CB C 43 32.680 32.680 31.867 0.813 25155 15577 1 19 . 1 1 43 43 MET H H 43 8.180 8.180 7.899 0.281 25155 15578 1 19 . 1 1 44 44 GLU N N 44 110.906 110.906 118.116 -7.210 25155 15579 1 19 . 1 1 44 44 GLU HA H 44 3.732 3.732 4.153 -0.421 25155 15580 1 19 . 1 1 44 44 GLU C C 44 178.120 178.120 178.892 -0.772 25155 15581 1 19 . 1 1 44 44 GLU CA C 44 59.450 59.450 58.772 0.678 25155 15582 1 19 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.415 0.385 25155 15583 1 19 . 1 1 45 45 GLN N N 45 115.770 115.770 117.309 -1.539 25155 15584 1 19 . 1 1 45 45 GLN HA H 45 4.190 4.190 3.969 0.221 25155 15585 1 19 . 1 1 45 45 GLN C C 45 175.480 175.480 176.612 -1.132 25155 15586 1 19 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.291 -1.191 25155 15587 1 19 . 1 1 45 45 GLN CB C 45 28.490 28.490 28.844 -0.354 25155 15588 1 19 . 1 1 45 45 GLN H H 45 7.517 7.517 7.165 0.352 25155 15589 1 19 . 1 1 46 46 TYR N N 46 117.840 117.840 117.705 0.135 25155 15590 1 19 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.365 0.295 25155 15591 1 19 . 1 1 46 46 TYR C C 46 175.480 175.480 176.366 -0.886 25155 15592 1 19 . 1 1 46 46 TYR CA C 46 58.827 58.827 57.343 1.484 25155 15593 1 19 . 1 1 46 46 TYR CB C 46 41.720 41.720 38.467 3.253 25155 15594 1 19 . 1 1 46 46 TYR H H 46 6.955 6.955 6.998 -0.043 25155 15595 1 19 . 1 1 47 47 ASP N N 47 121.540 121.540 121.675 -0.135 25155 15596 1 19 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.592 0.104 25155 15597 1 19 . 1 1 47 47 ASP C C 47 175.677 175.677 175.584 0.093 25155 15598 1 19 . 1 1 47 47 ASP CA C 47 56.812 56.812 56.536 0.276 25155 15599 1 19 . 1 1 47 47 ASP CB C 47 42.978 42.978 41.592 1.386 25155 15600 1 19 . 1 1 48 48 VAL N N 48 118.666 118.666 116.481 2.185 25155 15601 1 19 . 1 1 48 48 VAL HA H 48 5.057 5.057 5.088 -0.031 25155 15602 1 19 . 1 1 48 48 VAL C C 48 174.180 174.180 174.250 -0.070 25155 15603 1 19 . 1 1 48 48 VAL CA C 48 60.000 60.000 60.006 -0.006 25155 15604 1 19 . 1 1 48 48 VAL CB C 48 36.200 36.200 34.172 2.028 25155 15605 1 19 . 1 1 48 48 VAL H H 48 7.631 7.631 7.874 -0.243 25155 15606 1 19 . 1 1 49 49 LEU N N 49 128.300 128.300 128.055 0.245 25155 15607 1 19 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.117 0.483 25155 15608 1 19 . 1 1 49 49 LEU C C 49 174.810 174.810 174.882 -0.072 25155 15609 1 19 . 1 1 49 49 LEU CA C 49 52.230 52.230 54.127 -1.897 25155 15610 1 19 . 1 1 49 49 LEU CB C 49 45.400 45.400 45.416 -0.016 25155 15611 1 19 . 1 1 49 49 LEU H H 49 9.469 9.469 8.812 0.657 25155 15612 1 19 . 1 1 50 50 ILE N N 50 124.400 124.400 127.021 -2.621 25155 15613 1 19 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.688 0.962 25155 15614 1 19 . 1 1 50 50 ILE C C 50 175.286 175.286 174.305 0.981 25155 15615 1 19 . 1 1 50 50 ILE CA C 50 59.900 59.900 61.285 -1.385 25155 15616 1 19 . 1 1 50 50 ILE CB C 50 40.200 40.200 39.702 0.498 25155 15617 1 19 . 1 1 50 50 ILE H H 50 9.213 9.213 9.232 -0.019 25155 15618 1 19 . 1 1 51 51 LEU N N 51 127.410 127.410 129.306 -1.896 25155 15619 1 19 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.441 1.629 25155 15620 1 19 . 1 1 51 51 LEU C C 51 174.540 174.540 174.465 0.075 25155 15621 1 19 . 1 1 51 51 LEU CA C 51 52.950 52.950 52.595 0.355 25155 15622 1 19 . 1 1 51 51 LEU CB C 51 43.190 43.190 44.856 -1.666 25155 15623 1 19 . 1 1 51 51 LEU H H 51 9.256 9.256 8.929 0.327 25155 15624 1 19 . 1 1 52 52 GLY N N 52 108.290 108.290 113.242 -4.952 25155 15625 1 19 . 1 1 52 52 GLY C C 52 174.330 174.330 171.454 2.876 25155 15626 1 19 . 1 1 52 52 GLY CA C 52 44.040 44.040 43.134 0.906 25155 15627 1 19 . 1 1 52 52 GLY H H 52 8.949 8.949 8.480 0.469 25155 15628 1 19 . 1 1 53 53 ILE N N 53 124.912 124.912 120.743 4.169 25155 15629 1 19 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.515 -0.340 25155 15630 1 19 . 1 1 53 53 ILE C C 53 174.470 174.470 173.055 1.415 25155 15631 1 19 . 1 1 53 53 ILE CA C 53 55.850 55.850 57.438 -1.588 25155 15632 1 19 . 1 1 53 53 ILE CB C 53 42.800 42.800 42.166 0.634 25155 15633 1 19 . 1 1 53 53 ILE H H 53 8.612 8.612 7.383 1.229 25155 15634 1 19 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.833 -0.021 25155 15635 1 19 . 1 1 54 54 PRO C C 54 174.565 174.565 176.802 -2.237 25155 15636 1 19 . 1 1 54 54 PRO CA C 54 61.850 61.850 62.367 -0.517 25155 15637 1 19 . 1 1 54 54 PRO CB C 54 32.400 32.400 30.809 1.591 25155 15638 1 19 . 1 1 55 55 THR N N 55 116.040 116.040 118.400 -2.360 25155 15639 1 19 . 1 1 55 55 THR HA H 55 4.522 4.522 3.950 0.572 25155 15640 1 19 . 1 1 55 55 THR C C 55 173.990 173.990 175.766 -1.776 25155 15641 1 19 . 1 1 55 55 THR CA C 55 62.845 62.845 65.994 -3.149 25155 15642 1 19 . 1 1 55 55 THR CB C 55 70.795 70.795 68.930 1.865 25155 15643 1 19 . 1 1 55 55 THR H H 55 7.663 7.663 8.012 -0.349 25155 15644 1 19 . 1 1 56 56 TRP N N 56 130.540 130.540 121.333 9.207 25155 15645 1 19 . 1 1 56 56 TRP CA C 56 54.800 54.800 60.229 -5.429 25155 15646 1 19 . 1 1 56 56 TRP H H 56 9.075 9.075 8.349 0.726 25155 15647 1 19 . 1 1 58 58 PHE HA H 58 4.540 4.540 4.524 0.016 25155 15648 1 19 . 1 1 58 58 PHE C C 58 177.070 177.070 175.683 1.387 25155 15649 1 19 . 1 1 58 58 PHE CA C 58 55.460 55.460 57.272 -1.812 25155 15650 1 19 . 1 1 58 58 PHE CB C 58 41.200 41.200 40.112 1.088 25155 15651 1 19 . 1 1 59 59 GLY N N 59 109.796 109.796 110.012 -0.216 25155 15652 1 19 . 1 1 59 59 GLY CA C 59 45.763 45.763 45.635 0.129 25155 15653 1 19 . 1 1 59 59 GLY H H 59 8.392 8.392 8.348 0.044 25155 15654 1 19 . 1 1 60 60 GLU C C 60 175.660 175.660 175.690 -0.030 25155 15655 1 19 . 1 1 61 61 ILE N N 61 122.380 122.380 121.792 0.588 25155 15656 1 19 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.538 0.902 25155 15657 1 19 . 1 1 61 61 ILE CA C 61 62.100 62.100 61.289 0.811 25155 15658 1 19 . 1 1 61 61 ILE CB C 61 38.750 38.750 37.436 1.314 25155 15659 1 19 . 1 1 61 61 ILE H H 61 8.436 8.436 8.051 0.385 25155 15660 1 19 . 1 1 62 62 GLN CB C 62 30.570 30.570 29.864 0.706 25155 15661 1 19 . 1 1 63 63 GLU HA H 63 4.030 4.030 3.964 0.066 25155 15662 1 19 . 1 1 63 63 GLU C C 63 177.134 177.134 177.890 -0.756 25155 15663 1 19 . 1 1 63 63 GLU CA C 63 60.520 60.520 59.964 0.556 25155 15664 1 19 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.685 -0.035 25155 15665 1 19 . 1 1 64 64 ASP N N 64 119.630 119.630 118.218 1.412 25155 15666 1 19 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.470 0.122 25155 15667 1 19 . 1 1 64 64 ASP C C 64 178.680 178.680 177.141 1.539 25155 15668 1 19 . 1 1 64 64 ASP CA C 64 57.823 57.823 56.798 1.025 25155 15669 1 19 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.435 0.665 25155 15670 1 19 . 1 1 65 65 TRP N N 65 120.535 120.535 120.019 0.516 25155 15671 1 19 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.747 -0.422 25155 15672 1 19 . 1 1 65 65 TRP C C 65 178.684 178.684 177.651 1.033 25155 15673 1 19 . 1 1 65 65 TRP CA C 65 60.500 60.500 59.034 1.466 25155 15674 1 19 . 1 1 65 65 TRP CB C 65 30.100 30.100 31.925 -1.825 25155 15675 1 19 . 1 1 65 65 TRP H H 65 7.416 7.416 7.663 -0.247 25155 15676 1 19 . 1 1 66 66 GLU N N 66 120.760 120.760 120.789 -0.029 25155 15677 1 19 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.229 -0.409 25155 15678 1 19 . 1 1 66 66 GLU C C 66 178.860 178.860 178.924 -0.064 25155 15679 1 19 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.819 0.281 25155 15680 1 19 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.615 -0.605 25155 15681 1 19 . 1 1 67 67 ALA N N 67 118.972 118.972 121.599 -2.627 25155 15682 1 19 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.203 0.044 25155 15683 1 19 . 1 1 67 67 ALA C C 67 179.610 179.610 178.909 0.701 25155 15684 1 19 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.889 -0.289 25155 15685 1 19 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.883 -0.095 25155 15686 1 19 . 1 1 67 67 ALA H H 67 7.690 7.690 8.352 -0.662 25155 15687 1 19 . 1 1 68 68 VAL N N 68 107.530 107.530 110.955 -3.425 25155 15688 1 19 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.354 0.356 25155 15689 1 19 . 1 1 68 68 VAL C C 68 176.800 176.800 177.261 -0.461 25155 15690 1 19 . 1 1 68 68 VAL CA C 68 60.060 60.060 62.583 -2.523 25155 15691 1 19 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.489 0.111 25155 15692 1 19 . 1 1 68 68 VAL H H 68 7.240 7.240 7.496 -0.256 25155 15693 1 19 . 1 1 69 69 TRP N N 69 126.960 126.960 125.650 1.310 25155 15694 1 19 . 1 1 69 69 TRP HA H 69 4.182 4.182 4.108 0.074 25155 15695 1 19 . 1 1 69 69 TRP C C 69 178.640 178.640 176.799 1.841 25155 15696 1 19 . 1 1 69 69 TRP CA C 69 61.300 61.300 62.656 -1.356 25155 15697 1 19 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.436 2.134 25155 15698 1 19 . 1 1 69 69 TRP H H 69 7.810 7.810 8.253 -0.443 25155 15699 1 19 . 1 1 70 70 ASP N N 70 114.644 114.644 116.560 -1.916 25155 15700 1 19 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.163 0.356 25155 15701 1 19 . 1 1 70 70 ASP C C 70 178.685 178.685 178.045 0.640 25155 15702 1 19 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.358 -0.357 25155 15703 1 19 . 1 1 70 70 ASP CB C 70 39.810 39.810 40.980 -1.170 25155 15704 1 19 . 1 1 71 71 GLN N N 71 120.100 120.100 117.028 3.072 25155 15705 1 19 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.243 -0.053 25155 15706 1 19 . 1 1 71 71 GLN C C 71 178.870 178.870 177.755 1.115 25155 15707 1 19 . 1 1 71 71 GLN CA C 71 57.617 57.617 56.911 0.706 25155 15708 1 19 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.607 -0.787 25155 15709 1 19 . 1 1 71 71 GLN H H 71 7.980 7.980 7.922 0.058 25155 15710 1 19 . 1 1 72 72 LEU N N 72 117.535 117.535 119.413 -1.878 25155 15711 1 19 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.941 -0.144 25155 15712 1 19 . 1 1 72 72 LEU C C 72 178.308 178.308 178.086 0.222 25155 15713 1 19 . 1 1 72 72 LEU CA C 72 57.340 57.340 57.254 0.086 25155 15714 1 19 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.620 0.080 25155 15715 1 19 . 1 1 72 72 LEU H H 72 7.435 7.435 7.745 -0.310 25155 15716 1 19 . 1 1 73 73 ASP N N 73 115.534 115.534 117.407 -1.873 25155 15717 1 19 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.401 -0.251 25155 15718 1 19 . 1 1 73 73 ASP C C 73 177.553 177.553 176.821 0.732 25155 15719 1 19 . 1 1 73 73 ASP CA C 73 57.350 57.350 56.305 1.045 25155 15720 1 19 . 1 1 73 73 ASP CB C 73 40.040 40.040 41.604 -1.564 25155 15721 1 19 . 1 1 74 74 ASP N N 74 117.300 117.300 120.242 -2.942 25155 15722 1 19 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.459 0.247 25155 15723 1 19 . 1 1 74 74 ASP C C 74 176.424 176.424 177.333 -0.909 25155 15724 1 19 . 1 1 74 74 ASP CA C 74 54.170 54.170 55.712 -1.542 25155 15725 1 19 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.297 0.523 25155 15726 1 19 . 1 1 75 75 LEU N N 75 118.500 118.500 120.642 -2.142 25155 15727 1 19 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.132 0.163 25155 15728 1 19 . 1 1 75 75 LEU C C 75 176.800 176.800 176.462 0.338 25155 15729 1 19 . 1 1 75 75 LEU CA C 75 54.400 54.400 55.148 -0.748 25155 15730 1 19 . 1 1 75 75 LEU CB C 75 43.280 43.280 41.461 1.819 25155 15731 1 19 . 1 1 75 75 LEU H H 75 6.966 6.966 7.429 -0.463 25155 15732 1 19 . 1 1 76 76 ASN N N 76 123.040 123.040 121.174 1.866 25155 15733 1 19 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.806 0.056 25155 15734 1 19 . 1 1 76 76 ASN C C 76 174.927 174.927 174.654 0.273 25155 15735 1 19 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.413 -1.532 25155 15736 1 19 . 1 1 76 76 ASN CB C 76 37.510 37.510 39.015 -1.505 25155 15737 1 19 . 1 1 76 76 ASN H H 76 9.882 9.882 9.029 0.853 25155 15738 1 19 . 1 1 77 77 LEU N N 77 123.614 123.614 123.178 0.436 25155 15739 1 19 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.583 -0.213 25155 15740 1 19 . 1 1 77 77 LEU C C 77 175.110 175.110 176.192 -1.082 25155 15741 1 19 . 1 1 77 77 LEU CA C 77 52.200 52.200 54.036 -1.836 25155 15742 1 19 . 1 1 77 77 LEU CB C 77 42.786 42.786 43.035 -0.249 25155 15743 1 19 . 1 1 77 77 LEU H H 77 8.700 8.700 8.052 0.648 25155 15744 1 19 . 1 1 78 78 GLU N N 78 120.822 120.822 121.598 -0.776 25155 15745 1 19 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.469 -0.569 25155 15746 1 19 . 1 1 78 78 GLU C C 78 178.670 178.670 178.192 0.478 25155 15747 1 19 . 1 1 78 78 GLU CA C 78 58.700 58.700 57.699 1.001 25155 15748 1 19 . 1 1 78 78 GLU CB C 78 29.467 29.467 28.889 0.578 25155 15749 1 19 . 1 1 79 79 GLY N N 79 113.160 113.160 113.316 -0.156 25155 15750 1 19 . 1 1 79 79 GLY C C 79 174.523 174.523 173.848 0.675 25155 15751 1 19 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.600 -0.180 25155 15752 1 19 . 1 1 79 79 GLY H H 79 8.450 8.450 8.370 0.080 25155 15753 1 19 . 1 1 80 80 LYS N N 80 120.283 120.283 119.653 0.630 25155 15754 1 19 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.379 -0.021 25155 15755 1 19 . 1 1 80 80 LYS C C 80 175.304 175.304 176.048 -0.744 25155 15756 1 19 . 1 1 80 80 LYS CA C 80 56.890 56.890 55.759 1.131 25155 15757 1 19 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.881 -0.761 25155 15758 1 19 . 1 1 81 81 ILE N N 81 122.288 122.288 120.493 1.795 25155 15759 1 19 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.350 0.456 25155 15760 1 19 . 1 1 81 81 ILE C C 81 174.750 174.750 175.284 -0.534 25155 15761 1 19 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.414 -1.594 25155 15762 1 19 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.393 0.457 25155 15763 1 19 . 1 1 81 81 ILE H H 81 7.405 7.405 8.293 -0.888 25155 15764 1 19 . 1 1 82 82 VAL N N 82 127.793 127.793 124.599 3.194 25155 15765 1 19 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.219 0.061 25155 15766 1 19 . 1 1 82 82 VAL C C 82 172.680 172.680 174.139 -1.459 25155 15767 1 19 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.177 -0.077 25155 15768 1 19 . 1 1 82 82 VAL CB C 82 35.280 35.280 36.616 -1.336 25155 15769 1 19 . 1 1 82 82 VAL H H 82 8.800 8.800 9.032 -0.232 25155 15770 1 19 . 1 1 83 83 ALA N N 83 130.911 130.911 127.143 3.768 25155 15771 1 19 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.559 -0.170 25155 15772 1 19 . 1 1 83 83 ALA C C 83 175.870 175.870 175.809 0.061 25155 15773 1 19 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.901 0.099 25155 15774 1 19 . 1 1 83 83 ALA CB C 83 23.722 23.722 23.069 0.653 25155 15775 1 19 . 1 1 83 83 ALA H H 83 9.252 9.252 8.846 0.406 25155 15776 1 19 . 1 1 84 84 LEU N N 84 124.269 124.269 122.790 1.479 25155 15777 1 19 . 1 1 84 84 LEU HA H 84 5.508 5.508 5.449 0.059 25155 15778 1 19 . 1 1 84 84 LEU C C 84 175.490 175.490 175.783 -0.293 25155 15779 1 19 . 1 1 84 84 LEU CA C 84 53.670 53.670 54.533 -0.863 25155 15780 1 19 . 1 1 84 84 LEU CB C 84 45.000 45.000 46.172 -1.172 25155 15781 1 19 . 1 1 84 84 LEU H H 84 10.378 10.378 9.208 1.170 25155 15782 1 19 . 1 1 85 85 TYR N N 85 115.826 115.826 118.713 -2.887 25155 15783 1 19 . 1 1 85 85 TYR HA H 85 4.950 4.950 5.292 -0.342 25155 15784 1 19 . 1 1 85 85 TYR C C 85 172.661 172.661 173.745 -1.084 25155 15785 1 19 . 1 1 85 85 TYR CA C 85 55.853 55.853 55.637 0.216 25155 15786 1 19 . 1 1 85 85 TYR CB C 85 43.200 43.200 41.476 1.724 25155 15787 1 19 . 1 1 85 85 TYR H H 85 9.200 9.200 8.753 0.447 25155 15788 1 19 . 1 1 86 86 GLY N N 86 106.802 106.802 105.368 1.434 25155 15789 1 19 . 1 1 86 86 GLY C C 86 170.348 170.348 171.035 -0.687 25155 15790 1 19 . 1 1 86 86 GLY CA C 86 44.687 44.687 44.639 0.048 25155 15791 1 19 . 1 1 86 86 GLY H H 86 8.752 8.752 8.467 0.285 25155 15792 1 19 . 1 1 87 87 LEU N N 87 120.860 120.860 120.412 0.448 25155 15793 1 19 . 1 1 87 87 LEU HA H 87 5.476 5.476 5.021 0.455 25155 15794 1 19 . 1 1 87 87 LEU C C 87 177.720 177.720 175.433 2.287 25155 15795 1 19 . 1 1 87 87 LEU CA C 87 52.630 52.630 52.656 -0.026 25155 15796 1 19 . 1 1 87 87 LEU CB C 87 45.900 45.900 45.175 0.725 25155 15797 1 19 . 1 1 87 87 LEU H H 87 6.320 6.320 8.147 -1.827 25155 15798 1 19 . 1 1 88 88 GLY N N 88 109.910 109.910 111.089 -1.179 25155 15799 1 19 . 1 1 88 88 GLY C C 88 171.386 171.386 171.904 -0.518 25155 15800 1 19 . 1 1 88 88 GLY CA C 88 45.710 45.710 44.340 1.371 25155 15801 1 19 . 1 1 88 88 GLY H H 88 8.320 8.320 8.773 -0.453 25155 15802 1 19 . 1 1 89 89 ASP N N 89 121.580 121.580 119.031 2.549 25155 15803 1 19 . 1 1 89 89 ASP HA H 89 5.190 5.190 5.444 -0.254 25155 15804 1 19 . 1 1 89 89 ASP C C 89 176.608 176.608 176.181 0.427 25155 15805 1 19 . 1 1 89 89 ASP CA C 89 52.200 52.200 53.374 -1.174 25155 15806 1 19 . 1 1 89 89 ASP CB C 89 41.900 41.900 42.778 -0.878 25155 15807 1 19 . 1 1 90 90 GLN N N 90 123.900 123.900 123.398 0.502 25155 15808 1 19 . 1 1 90 90 GLN HA H 90 3.645 3.645 4.171 -0.526 25155 15809 1 19 . 1 1 90 90 GLN C C 90 173.523 173.523 175.556 -2.033 25155 15810 1 19 . 1 1 90 90 GLN CA C 90 58.706 58.706 57.484 1.222 25155 15811 1 19 . 1 1 90 90 GLN CB C 90 28.800 28.800 29.205 -0.405 25155 15812 1 19 . 1 1 90 90 GLN H H 90 8.726 8.726 8.970 -0.244 25155 15813 1 19 . 1 1 91 91 LEU N N 91 117.080 117.080 118.767 -1.687 25155 15814 1 19 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.417 0.053 25155 15815 1 19 . 1 1 91 91 LEU C C 91 179.840 179.840 177.946 1.894 25155 15816 1 19 . 1 1 91 91 LEU CA C 91 55.800 55.800 55.367 0.433 25155 15817 1 19 . 1 1 91 91 LEU CB C 91 41.640 41.640 42.682 -1.042 25155 15818 1 19 . 1 1 91 91 LEU H H 91 7.092 7.092 8.649 -1.557 25155 15819 1 19 . 1 1 92 92 GLY N N 92 110.460 110.460 107.668 2.792 25155 15820 1 19 . 1 1 92 92 GLY C C 92 174.824 174.824 174.744 0.080 25155 15821 1 19 . 1 1 92 92 GLY CA C 92 46.390 46.390 47.356 -0.966 25155 15822 1 19 . 1 1 92 92 GLY H H 92 9.243 9.243 8.533 0.710 25155 15823 1 19 . 1 1 93 93 TYR N N 93 118.140 118.140 118.587 -0.447 25155 15824 1 19 . 1 1 93 93 TYR HA H 93 5.173 5.173 4.302 0.871 25155 15825 1 19 . 1 1 93 93 TYR C C 93 177.805 177.805 176.551 1.254 25155 15826 1 19 . 1 1 93 93 TYR CA C 93 57.430 57.430 58.499 -1.069 25155 15827 1 19 . 1 1 93 93 TYR CB C 93 39.300 39.300 40.401 -1.101 25155 15828 1 19 . 1 1 93 93 TYR H H 93 7.252 7.252 7.582 -0.330 25155 15829 1 19 . 1 1 94 94 GLY N N 94 112.455 112.455 108.592 3.863 25155 15830 1 19 . 1 1 94 94 GLY C C 94 177.740 177.740 175.667 2.073 25155 15831 1 19 . 1 1 94 94 GLY CA C 94 49.880 49.880 46.470 3.410 25155 15832 1 19 . 1 1 94 94 GLY H H 94 8.154 8.154 8.125 0.029 25155 15833 1 19 . 1 1 95 95 GLU N N 95 123.040 123.040 122.543 0.497 25155 15834 1 19 . 1 1 95 95 GLU HA H 95 4.000 4.000 4.310 -0.310 25155 15835 1 19 . 1 1 95 95 GLU C C 95 175.145 175.145 177.812 -2.667 25155 15836 1 19 . 1 1 95 95 GLU CA C 95 57.950 57.950 58.507 -0.557 25155 15837 1 19 . 1 1 95 95 GLU CB C 95 27.400 27.400 29.732 -2.332 25155 15838 1 19 . 1 1 96 96 TRP N N 96 118.000 118.000 116.356 1.644 25155 15839 1 19 . 1 1 96 96 TRP HA H 96 5.213 5.213 4.993 0.220 25155 15840 1 19 . 1 1 96 96 TRP C C 96 176.616 176.616 176.279 0.337 25155 15841 1 19 . 1 1 96 96 TRP CA C 96 57.120 57.120 54.772 2.349 25155 15842 1 19 . 1 1 96 96 TRP CB C 96 29.970 29.970 28.603 1.367 25155 15843 1 19 . 1 1 96 96 TRP H H 96 7.785 7.785 7.938 -0.153 25155 15844 1 19 . 1 1 97 97 PHE N N 97 123.268 123.268 122.248 1.020 25155 15845 1 19 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.360 0.300 25155 15846 1 19 . 1 1 97 97 PHE CA C 97 58.742 58.742 60.143 -1.401 25155 15847 1 19 . 1 1 97 97 PHE CB C 97 40.835 40.835 39.722 1.113 25155 15848 1 19 . 1 1 97 97 PHE H H 97 7.054 7.054 8.100 -1.046 25155 15849 1 19 . 1 1 98 98 LEU HA H 98 3.440 3.440 3.554 -0.114 25155 15850 1 19 . 1 1 98 98 LEU C C 98 176.613 176.613 177.274 -0.661 25155 15851 1 19 . 1 1 98 98 LEU CA C 98 56.000 56.000 55.182 0.818 25155 15852 1 19 . 1 1 98 98 LEU CB C 98 38.600 38.600 39.458 -0.858 25155 15853 1 19 . 1 1 98 98 LEU H H 98 8.584 8.584 8.171 0.413 25155 15854 1 19 . 1 1 99 99 ASP N N 99 123.268 123.268 120.747 2.521 25155 15855 1 19 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.261 -0.296 25155 15856 1 19 . 1 1 99 99 ASP C C 99 178.876 178.876 176.919 1.957 25155 15857 1 19 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.551 1.709 25155 15858 1 19 . 1 1 99 99 ASP CB C 99 40.350 40.350 41.047 -0.697 25155 15859 1 19 . 1 1 100 100 ALA N N 100 119.124 119.124 120.205 -1.081 25155 15860 1 19 . 1 1 100 100 ALA HA H 100 3.822 3.822 4.081 -0.259 25155 15861 1 19 . 1 1 100 100 ALA C C 100 178.490 178.490 179.376 -0.886 25155 15862 1 19 . 1 1 100 100 ALA CA C 100 55.100 55.100 54.285 0.815 25155 15863 1 19 . 1 1 100 100 ALA CB C 100 19.700 19.700 18.120 1.580 25155 15864 1 19 . 1 1 100 100 ALA H H 100 8.400 8.400 7.502 0.898 25155 15865 1 19 . 1 1 101 101 LEU N N 101 118.687 118.687 120.602 -1.915 25155 15866 1 19 . 1 1 101 101 LEU HA H 101 3.674 3.674 4.040 -0.366 25155 15867 1 19 . 1 1 101 101 LEU C C 101 179.050 179.050 178.634 0.416 25155 15868 1 19 . 1 1 101 101 LEU CA C 101 57.800 57.800 57.174 0.626 25155 15869 1 19 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.673 0.977 25155 15870 1 19 . 1 1 101 101 LEU H H 101 6.518 6.518 7.448 -0.930 25155 15871 1 19 . 1 1 102 102 GLY N N 102 104.410 104.410 106.534 -2.124 25155 15872 1 19 . 1 1 102 102 GLY C C 102 176.056 176.056 175.843 0.213 25155 15873 1 19 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.294 0.456 25155 15874 1 19 . 1 1 102 102 GLY H H 102 7.712 7.712 8.151 -0.439 25155 15875 1 19 . 1 1 103 103 MET N N 103 120.550 120.550 122.333 -1.783 25155 15876 1 19 . 1 1 103 103 MET HA H 103 4.256 4.256 4.291 -0.035 25155 15877 1 19 . 1 1 103 103 MET C C 103 179.650 179.650 178.159 1.491 25155 15878 1 19 . 1 1 103 103 MET CA C 103 59.450 59.450 59.051 0.399 25155 15879 1 19 . 1 1 103 103 MET CB C 103 32.300 32.300 32.615 -0.316 25155 15880 1 19 . 1 1 103 103 MET H H 103 8.485 8.485 7.906 0.579 25155 15881 1 19 . 1 1 104 104 LEU N N 104 123.480 123.480 119.036 4.444 25155 15882 1 19 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.246 -0.185 25155 15883 1 19 . 1 1 104 104 LEU C C 104 177.750 177.750 179.218 -1.468 25155 15884 1 19 . 1 1 104 104 LEU CA C 104 58.100 58.100 58.032 0.068 25155 15885 1 19 . 1 1 104 104 LEU CB C 104 41.450 41.450 41.232 0.218 25155 15886 1 19 . 1 1 104 104 LEU H H 104 8.392 8.392 7.807 0.585 25155 15887 1 19 . 1 1 105 105 HIS N N 105 119.570 119.570 120.413 -0.843 25155 15888 1 19 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.156 -0.304 25155 15889 1 19 . 1 1 105 105 HIS C C 105 177.550 177.550 176.973 0.577 25155 15890 1 19 . 1 1 105 105 HIS CA C 105 61.000 61.000 60.944 0.056 25155 15891 1 19 . 1 1 105 105 HIS CB C 105 28.820 28.820 29.980 -1.160 25155 15892 1 19 . 1 1 105 105 HIS H H 105 8.247 8.247 8.686 -0.439 25155 15893 1 19 . 1 1 106 106 ASP N N 106 119.780 119.780 119.288 0.492 25155 15894 1 19 . 1 1 106 106 ASP HA H 106 4.333 4.333 4.408 -0.075 25155 15895 1 19 . 1 1 106 106 ASP C C 106 179.410 179.410 178.453 0.957 25155 15896 1 19 . 1 1 106 106 ASP CA C 106 57.800 57.800 57.325 0.475 25155 15897 1 19 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.236 -0.636 25155 15898 1 19 . 1 1 107 107 LYS N N 107 121.660 121.660 119.389 2.271 25155 15899 1 19 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.108 -0.008 25155 15900 1 19 . 1 1 107 107 LYS C C 107 178.316 178.316 178.835 -0.519 25155 15901 1 19 . 1 1 107 107 LYS CA C 107 58.750 58.750 59.002 -0.252 25155 15902 1 19 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.593 -0.743 25155 15903 1 19 . 1 1 108 108 LEU N N 108 116.050 116.050 118.289 -2.239 25155 15904 1 19 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.334 -0.324 25155 15905 1 19 . 1 1 108 108 LEU C C 108 179.050 179.050 178.892 0.158 25155 15906 1 19 . 1 1 108 108 LEU CA C 108 56.240 56.240 56.828 -0.588 25155 15907 1 19 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.530 -0.730 25155 15908 1 19 . 1 1 108 108 LEU H H 108 8.072 8.072 7.938 0.134 25155 15909 1 19 . 1 1 109 109 SER N N 109 116.280 116.280 116.042 0.238 25155 15910 1 19 . 1 1 109 109 SER HA H 109 4.300 4.300 4.311 -0.011 25155 15911 1 19 . 1 1 109 109 SER C C 109 175.848 175.848 176.310 -0.462 25155 15912 1 19 . 1 1 109 109 SER CA C 109 62.410 62.410 61.887 0.523 25155 15913 1 19 . 1 1 109 109 SER CB C 109 62.850 62.850 63.168 -0.318 25155 15914 1 19 . 1 1 109 109 SER H H 109 8.366 8.366 8.378 -0.012 25155 15915 1 19 . 1 1 110 110 THR N N 110 110.416 110.416 111.445 -1.029 25155 15916 1 19 . 1 1 110 110 THR HA H 110 4.614 4.614 4.338 0.276 25155 15917 1 19 . 1 1 110 110 THR C C 110 175.675 175.675 175.428 0.247 25155 15918 1 19 . 1 1 110 110 THR CA C 110 62.030 62.030 63.783 -1.753 25155 15919 1 19 . 1 1 110 110 THR CB C 110 68.810 68.810 68.737 0.073 25155 15920 1 19 . 1 1 110 110 THR H H 110 7.185 7.185 8.013 -0.828 25155 15921 1 19 . 1 1 111 111 LYS N N 111 120.090 120.090 120.664 -0.574 25155 15922 1 19 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.451 0.062 25155 15923 1 19 . 1 1 111 111 LYS C C 111 176.814 176.814 176.615 0.199 25155 15924 1 19 . 1 1 111 111 LYS CA C 111 55.730 55.730 55.053 0.677 25155 15925 1 19 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.295 -1.365 25155 15926 1 19 . 1 1 112 112 GLY N N 112 107.540 107.540 107.979 -0.439 25155 15927 1 19 . 1 1 112 112 GLY C C 112 176.223 176.223 174.206 2.017 25155 15928 1 19 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.598 1.328 25155 15929 1 19 . 1 1 112 112 GLY H H 112 8.315 8.315 7.713 0.602 25155 15930 1 19 . 1 1 113 113 VAL N N 113 113.536 113.536 113.901 -0.365 25155 15931 1 19 . 1 1 113 113 VAL HA H 113 4.494 4.494 4.444 0.050 25155 15932 1 19 . 1 1 113 113 VAL C C 113 174.560 174.560 174.699 -0.139 25155 15933 1 19 . 1 1 113 113 VAL CA C 113 59.550 59.550 60.281 -0.731 25155 15934 1 19 . 1 1 113 113 VAL CB C 113 32.800 32.800 32.584 0.216 25155 15935 1 19 . 1 1 113 113 VAL H H 113 6.835 6.835 6.957 -0.122 25155 15936 1 19 . 1 1 114 114 LYS N N 114 122.920 122.920 121.445 1.475 25155 15937 1 19 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.394 0.100 25155 15938 1 19 . 1 1 114 114 LYS C C 114 174.925 174.925 174.700 0.225 25155 15939 1 19 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.360 -0.080 25155 15940 1 19 . 1 1 114 114 LYS CB C 114 33.630 33.630 33.417 0.213 25155 15941 1 19 . 1 1 115 115 PHE N N 115 123.140 123.140 124.785 -1.645 25155 15942 1 19 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.237 0.463 25155 15943 1 19 . 1 1 115 115 PHE C C 115 177.580 177.580 176.157 1.423 25155 15944 1 19 . 1 1 115 115 PHE CA C 115 58.677 58.677 56.327 2.350 25155 15945 1 19 . 1 1 115 115 PHE CB C 115 41.120 41.120 39.705 1.415 25155 15946 1 19 . 1 1 115 115 PHE H H 115 8.506 8.506 8.425 0.081 25155 15947 1 19 . 1 1 116 116 VAL N N 116 115.737 115.737 119.531 -3.794 25155 15948 1 19 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.520 -0.042 25155 15949 1 19 . 1 1 116 116 VAL C C 116 175.300 175.300 175.280 0.020 25155 15950 1 19 . 1 1 116 116 VAL CA C 116 58.877 58.877 60.038 -1.161 25155 15951 1 19 . 1 1 116 116 VAL CB C 116 34.120 34.120 33.727 0.393 25155 15952 1 19 . 1 1 116 116 VAL H H 116 8.860 8.860 8.828 0.032 25155 15953 1 19 . 1 1 117 117 GLY N N 117 108.137 108.137 111.711 -3.574 25155 15954 1 19 . 1 1 117 117 GLY C C 117 176.110 176.110 174.077 2.033 25155 15955 1 19 . 1 1 117 117 GLY CA C 117 47.500 47.500 44.883 2.617 25155 15956 1 19 . 1 1 117 117 GLY H H 117 9.838 9.838 9.365 0.473 25155 15957 1 19 . 1 1 118 118 TYR N N 118 120.380 120.380 119.560 0.820 25155 15958 1 19 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.550 0.420 25155 15959 1 19 . 1 1 118 118 TYR C C 118 177.630 177.630 174.630 3.000 25155 15960 1 19 . 1 1 118 118 TYR CA C 118 55.800 55.800 59.072 -3.272 25155 15961 1 19 . 1 1 118 118 TYR CB C 118 35.970 35.970 37.957 -1.987 25155 15962 1 19 . 1 1 118 118 TYR H H 118 8.652 8.652 8.556 0.096 25155 15963 1 19 . 1 1 119 119 TRP N N 119 126.040 126.040 118.956 7.084 25155 15964 1 19 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.014 1.007 25155 15965 1 19 . 1 1 119 119 TRP C C 119 173.000 173.000 173.936 -0.936 25155 15966 1 19 . 1 1 119 119 TRP CA C 119 53.820 53.820 55.258 -1.438 25155 15967 1 19 . 1 1 119 119 TRP CB C 119 36.050 36.050 33.679 2.371 25155 15968 1 19 . 1 1 119 119 TRP H H 119 8.070 8.070 8.219 -0.149 25155 15969 1 19 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.553 0.231 25155 15970 1 19 . 1 1 120 120 PRO C C 120 176.870 176.870 176.863 0.007 25155 15971 1 19 . 1 1 120 120 PRO CA C 120 63.780 63.780 62.760 1.020 25155 15972 1 19 . 1 1 120 120 PRO CB C 120 31.990 31.990 31.885 0.105 25155 15973 1 19 . 1 1 121 121 THR N N 121 109.310 109.310 114.968 -5.658 25155 15974 1 19 . 1 1 121 121 THR HA H 121 4.073 4.073 3.118 0.955 25155 15975 1 19 . 1 1 121 121 THR C C 121 176.324 176.324 174.962 1.362 25155 15976 1 19 . 1 1 121 121 THR CA C 121 61.250 61.250 63.580 -2.330 25155 15977 1 19 . 1 1 121 121 THR CB C 121 69.730 69.730 68.417 1.313 25155 15978 1 19 . 1 1 121 121 THR H H 121 7.370 7.370 8.022 -0.652 25155 15979 1 19 . 1 1 122 122 GLU N N 122 123.937 123.937 121.215 2.722 25155 15980 1 19 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.048 0.176 25155 15981 1 19 . 1 1 122 122 GLU C C 122 177.737 177.737 177.747 -0.010 25155 15982 1 19 . 1 1 122 122 GLU CA C 122 58.200 58.200 57.865 0.335 25155 15983 1 19 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.439 0.361 25155 15984 1 19 . 1 1 123 123 GLY N N 123 114.563 114.563 111.589 2.974 25155 15985 1 19 . 1 1 123 123 GLY C C 123 173.783 173.783 173.803 -0.020 25155 15986 1 19 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.252 0.129 25155 15987 1 19 . 1 1 123 123 GLY H H 123 9.144 9.144 8.895 0.249 25155 15988 1 19 . 1 1 124 124 TYR N N 124 118.800 118.800 119.788 -0.988 25155 15989 1 19 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.838 0.380 25155 15990 1 19 . 1 1 124 124 TYR C C 124 175.673 175.673 175.782 -0.109 25155 15991 1 19 . 1 1 124 124 TYR CA C 124 56.950 56.950 57.353 -0.403 25155 15992 1 19 . 1 1 124 124 TYR CB C 124 41.100 41.100 40.623 0.477 25155 15993 1 19 . 1 1 124 124 TYR H H 124 7.895 7.895 8.019 -0.124 25155 15994 1 19 . 1 1 125 125 GLU N N 125 124.790 124.790 120.644 4.146 25155 15995 1 19 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.443 0.242 25155 15996 1 19 . 1 1 125 125 GLU C C 125 172.877 172.877 175.537 -2.660 25155 15997 1 19 . 1 1 125 125 GLU CA C 125 55.700 55.700 55.370 0.330 25155 15998 1 19 . 1 1 125 125 GLU CB C 125 31.340 31.340 31.481 -0.141 25155 15999 1 19 . 1 1 126 126 PHE N N 126 118.670 118.670 118.658 0.012 25155 16000 1 19 . 1 1 126 126 PHE HA H 126 4.841 4.841 5.147 -0.306 25155 16001 1 19 . 1 1 126 126 PHE C C 126 173.800 173.800 175.816 -2.016 25155 16002 1 19 . 1 1 126 126 PHE CA C 126 56.950 56.950 58.273 -1.323 25155 16003 1 19 . 1 1 126 126 PHE CB C 126 40.300 40.300 40.716 -0.416 25155 16004 1 19 . 1 1 126 126 PHE H H 126 7.645 7.645 8.125 -0.480 25155 16005 1 19 . 1 1 127 127 THR N N 127 107.038 107.038 114.122 -7.084 25155 16006 1 19 . 1 1 127 127 THR HA H 127 4.370 4.370 3.506 0.864 25155 16007 1 19 . 1 1 127 127 THR C C 127 175.100 175.100 175.379 -0.279 25155 16008 1 19 . 1 1 127 127 THR CA C 127 61.080 61.080 64.954 -3.874 25155 16009 1 19 . 1 1 127 127 THR CB C 127 70.500 70.500 67.736 2.764 25155 16010 1 19 . 1 1 127 127 THR H H 127 7.306 7.306 7.707 -0.401 25155 16011 1 19 . 1 1 128 128 SER N N 128 118.150 118.150 118.202 -0.052 25155 16012 1 19 . 1 1 128 128 SER HA H 128 4.650 4.650 4.654 -0.004 25155 16013 1 19 . 1 1 128 128 SER C C 128 175.760 175.760 173.815 1.945 25155 16014 1 19 . 1 1 128 128 SER CA C 128 55.813 55.813 57.446 -1.633 25155 16015 1 19 . 1 1 128 128 SER CB C 128 65.300 65.300 63.855 1.445 25155 16016 1 19 . 1 1 128 128 SER H H 128 7.354 7.354 8.197 -0.843 25155 16017 1 19 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.477 0.287 25155 16018 1 19 . 1 1 129 129 PRO C C 129 178.860 178.860 178.630 0.230 25155 16019 1 19 . 1 1 129 129 PRO CA C 129 62.728 62.728 64.101 -1.373 25155 16020 1 19 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.455 -0.055 25155 16021 1 19 . 1 1 130 130 LYS N N 130 122.158 122.158 120.103 2.055 25155 16022 1 19 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.128 0.082 25155 16023 1 19 . 1 1 130 130 LYS C C 130 176.890 176.890 176.068 0.822 25155 16024 1 19 . 1 1 130 130 LYS CA C 130 61.375 61.375 61.112 0.263 25155 16025 1 19 . 1 1 130 130 LYS CB C 130 30.350 30.350 31.081 -0.731 25155 16026 1 19 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.421 0.112 25155 16027 1 19 . 1 1 131 131 PRO C C 131 173.810 173.810 175.695 -1.885 25155 16028 1 19 . 1 1 131 131 PRO CA C 131 64.510 64.510 63.766 0.744 25155 16029 1 19 . 1 1 131 131 PRO CB C 131 31.745 31.745 31.646 0.099 25155 16030 1 19 . 1 1 132 132 VAL N N 132 114.480 114.480 112.521 1.959 25155 16031 1 19 . 1 1 132 132 VAL HA H 132 5.158 5.158 4.921 0.237 25155 16032 1 19 . 1 1 132 132 VAL C C 132 175.137 175.137 174.542 0.595 25155 16033 1 19 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.235 0.565 25155 16034 1 19 . 1 1 132 132 VAL CB C 132 34.780 34.780 35.102 -0.322 25155 16035 1 19 . 1 1 132 132 VAL H H 132 6.716 6.716 7.643 -0.927 25155 16036 1 19 . 1 1 133 133 ILE N N 133 120.670 120.670 116.318 4.352 25155 16037 1 19 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.400 -0.008 25155 16038 1 19 . 1 1 133 133 ILE C C 133 175.485 175.485 175.807 -0.322 25155 16039 1 19 . 1 1 133 133 ILE CA C 133 60.000 60.000 60.555 -0.555 25155 16040 1 19 . 1 1 133 133 ILE CB C 133 42.020 42.020 38.579 3.441 25155 16041 1 19 . 1 1 133 133 ILE H H 133 8.740 8.740 8.261 0.479 25155 16042 1 19 . 1 1 134 134 ALA N N 134 122.454 122.454 123.587 -1.133 25155 16043 1 19 . 1 1 134 134 ALA HA H 134 3.953 3.953 3.984 -0.031 25155 16044 1 19 . 1 1 134 134 ALA C C 134 178.387 178.387 177.698 0.689 25155 16045 1 19 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.455 -0.405 25155 16046 1 19 . 1 1 134 134 ALA CB C 134 16.982 16.982 17.997 -1.015 25155 16047 1 19 . 1 1 134 134 ALA H H 134 8.490 8.490 8.600 -0.110 25155 16048 1 19 . 1 1 135 135 ASP N N 135 117.310 117.310 123.246 -5.936 25155 16049 1 19 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.555 -0.311 25155 16050 1 19 . 1 1 135 135 ASP C C 135 176.390 176.390 176.421 -0.031 25155 16051 1 19 . 1 1 135 135 ASP CA C 135 55.120 55.120 53.071 2.049 25155 16052 1 19 . 1 1 135 135 ASP CB C 135 39.865 39.865 39.101 0.764 25155 16053 1 19 . 1 1 136 136 GLY N N 136 104.336 104.336 110.957 -6.621 25155 16054 1 19 . 1 1 136 136 GLY C C 136 174.940 174.940 175.492 -0.552 25155 16055 1 19 . 1 1 136 136 GLY CA C 136 45.150 45.150 45.921 -0.771 25155 16056 1 19 . 1 1 136 136 GLY H H 136 7.592 7.592 8.172 -0.580 25155 16057 1 19 . 1 1 137 137 GLN N N 137 118.675 118.675 117.643 1.032 25155 16058 1 19 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.489 -0.427 25155 16059 1 19 . 1 1 137 137 GLN C C 137 176.420 176.420 175.258 1.162 25155 16060 1 19 . 1 1 137 137 GLN CA C 137 57.760 57.760 57.353 0.407 25155 16061 1 19 . 1 1 137 137 GLN CB C 137 30.400 30.400 30.279 0.121 25155 16062 1 19 . 1 1 137 137 GLN H H 137 7.843 7.843 8.290 -0.447 25155 16063 1 19 . 1 1 138 138 LEU N N 138 118.160 118.160 117.954 0.206 25155 16064 1 19 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.835 0.126 25155 16065 1 19 . 1 1 138 138 LEU C C 138 175.700 175.700 176.211 -0.511 25155 16066 1 19 . 1 1 138 138 LEU CA C 138 53.705 53.705 53.208 0.497 25155 16067 1 19 . 1 1 138 138 LEU CB C 138 46.480 46.480 44.842 1.638 25155 16068 1 19 . 1 1 138 138 LEU H H 138 7.356 7.356 7.166 0.190 25155 16069 1 19 . 1 1 139 139 PHE N N 139 119.060 119.060 122.866 -3.806 25155 16070 1 19 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.479 0.865 25155 16071 1 19 . 1 1 139 139 PHE C C 139 178.850 178.850 176.070 2.780 25155 16072 1 19 . 1 1 139 139 PHE CA C 139 56.670 56.670 58.624 -1.954 25155 16073 1 19 . 1 1 139 139 PHE CB C 139 43.652 43.652 38.069 5.582 25155 16074 1 19 . 1 1 139 139 PHE H H 139 10.026 10.026 8.570 1.456 25155 16075 1 19 . 1 1 140 140 VAL N N 140 109.905 109.905 114.009 -4.104 25155 16076 1 19 . 1 1 140 140 VAL HA H 140 3.500 3.500 2.580 0.920 25155 16077 1 19 . 1 1 140 140 VAL C C 140 172.860 172.860 174.771 -1.911 25155 16078 1 19 . 1 1 140 140 VAL CA C 140 61.812 61.812 62.940 -1.128 25155 16079 1 19 . 1 1 140 140 VAL CB C 140 30.250 30.250 29.898 0.352 25155 16080 1 19 . 1 1 140 140 VAL H H 140 7.550 7.550 6.955 0.595 25155 16081 1 19 . 1 1 141 141 GLY N N 141 106.600 106.600 105.636 0.964 25155 16082 1 19 . 1 1 141 141 GLY C C 141 171.350 171.350 172.947 -1.597 25155 16083 1 19 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.652 0.808 25155 16084 1 19 . 1 1 141 141 GLY H H 141 7.052 7.052 7.329 -0.277 25155 16085 1 19 . 1 1 142 142 LEU N N 142 117.820 117.820 119.431 -1.611 25155 16086 1 19 . 1 1 142 142 LEU HA H 142 4.962 4.962 4.201 0.761 25155 16087 1 19 . 1 1 142 142 LEU CA C 142 55.600 55.600 54.001 1.599 25155 16088 1 19 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.939 -5.009 25155 16089 1 19 . 1 1 142 142 LEU H H 142 7.643 7.643 8.066 -0.423 25155 16090 1 19 . 1 1 143 143 ALA HA H 143 4.220 4.220 4.135 0.085 25155 16091 1 19 . 1 1 143 143 ALA C C 143 175.505 175.505 175.746 -0.241 25155 16092 1 19 . 1 1 143 143 ALA CA C 143 49.600 49.600 50.494 -0.894 25155 16093 1 19 . 1 1 143 143 ALA CB C 143 23.330 23.330 18.926 4.404 25155 16094 1 19 . 1 1 144 144 LEU N N 144 124.960 124.960 122.001 2.959 25155 16095 1 19 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.541 0.239 25155 16096 1 19 . 1 1 144 144 LEU C C 144 174.700 174.700 175.065 -0.365 25155 16097 1 19 . 1 1 144 144 LEU CA C 144 52.790 52.790 53.591 -0.801 25155 16098 1 19 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.111 0.189 25155 16099 1 19 . 1 1 144 144 LEU H H 144 8.583 8.583 7.735 0.848 25155 16100 1 19 . 1 1 145 145 ASP N N 145 119.100 119.100 119.551 -0.451 25155 16101 1 19 . 1 1 145 145 ASP HA H 145 5.422 5.422 5.479 -0.057 25155 16102 1 19 . 1 1 145 145 ASP C C 145 176.180 176.180 175.289 0.891 25155 16103 1 19 . 1 1 145 145 ASP CA C 145 53.600 53.600 52.205 1.395 25155 16104 1 19 . 1 1 145 145 ASP CB C 145 43.180 43.180 44.351 -1.171 25155 16105 1 19 . 1 1 147 147 THR HA H 147 4.093 4.093 4.334 -0.241 25155 16106 1 19 . 1 1 147 147 THR C C 147 175.858 175.858 176.310 -0.452 25155 16107 1 19 . 1 1 147 147 THR CA C 147 66.400 66.400 65.104 1.296 25155 16108 1 19 . 1 1 147 147 THR CB C 147 69.400 69.400 69.061 0.339 25155 16109 1 19 . 1 1 147 147 THR H H 147 8.745 8.745 8.319 0.426 25155 16110 1 19 . 1 1 148 148 ASN N N 148 115.408 115.408 118.693 -3.285 25155 16111 1 19 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.721 0.289 25155 16112 1 19 . 1 1 148 148 ASN C C 148 175.750 175.750 174.799 0.951 25155 16113 1 19 . 1 1 148 148 ASN CA C 148 53.400 53.400 54.814 -1.414 25155 16114 1 19 . 1 1 148 148 ASN CB C 148 41.900 41.900 39.978 1.922 25155 16115 1 19 . 1 1 148 148 ASN H H 148 8.975 8.975 8.853 0.122 25155 16116 1 19 . 1 1 149 149 GLN N N 149 117.900 117.900 114.627 3.273 25155 16117 1 19 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.448 0.488 25155 16118 1 19 . 1 1 149 149 GLN C C 149 178.280 178.280 173.627 4.653 25155 16119 1 19 . 1 1 149 149 GLN CA C 149 53.730 53.730 55.418 -1.688 25155 16120 1 19 . 1 1 149 149 GLN CB C 149 29.790 29.790 30.660 -0.869 25155 16121 1 19 . 1 1 149 149 GLN H H 149 7.430 7.430 7.657 -0.228 25155 16122 1 19 . 1 1 150 150 TYR N N 150 121.060 121.060 116.713 4.347 25155 16123 1 19 . 1 1 150 150 TYR HA H 150 4.671 4.671 5.060 -0.389 25155 16124 1 19 . 1 1 150 150 TYR C C 150 178.680 178.680 176.419 2.261 25155 16125 1 19 . 1 1 150 150 TYR CA C 150 57.930 57.930 57.604 0.326 25155 16126 1 19 . 1 1 150 150 TYR CB C 150 38.860 38.860 39.344 -0.485 25155 16127 1 19 . 1 1 150 150 TYR H H 150 8.115 8.115 8.048 0.067 25155 16128 1 19 . 1 1 151 151 ASP N N 151 121.175 121.175 121.864 -0.689 25155 16129 1 19 . 1 1 151 151 ASP CA C 151 57.000 57.000 56.489 0.511 25155 16130 1 19 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.324 1.676 25155 16131 1 19 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.322 0.268 25155 16132 1 19 . 1 1 152 152 LEU C C 152 178.300 178.300 178.261 0.039 25155 16133 1 19 . 1 1 152 152 LEU CA C 152 54.788 54.788 56.106 -1.318 25155 16134 1 19 . 1 1 152 152 LEU CB C 152 42.200 42.200 40.947 1.253 25155 16135 1 19 . 1 1 153 153 SER N N 153 116.170 116.170 116.797 -0.627 25155 16136 1 19 . 1 1 153 153 SER HA H 153 3.911 3.911 4.053 -0.142 25155 16137 1 19 . 1 1 153 153 SER CA C 153 63.400 63.400 62.021 1.379 25155 16138 1 19 . 1 1 153 153 SER CB C 153 63.200 63.200 62.986 0.214 25155 16139 1 19 . 1 1 153 153 SER H H 153 7.378 7.378 7.705 -0.327 25155 16140 1 19 . 1 1 154 154 ASP N N 154 121.640 121.640 120.933 0.707 25155 16141 1 19 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.346 -0.106 25155 16142 1 19 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.804 1.496 25155 16143 1 19 . 1 1 154 154 ASP CB C 154 40.000 40.000 40.932 -0.932 25155 16144 1 19 . 1 1 155 155 GLU HA H 155 4.170 4.170 4.076 0.094 25155 16145 1 19 . 1 1 155 155 GLU C C 155 179.420 179.420 179.050 0.370 25155 16146 1 19 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.167 0.033 25155 16147 1 19 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.455 0.025 25155 16148 1 19 . 1 1 156 156 ARG N N 156 121.230 121.230 119.562 1.668 25155 16149 1 19 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.302 -0.026 25155 16150 1 19 . 1 1 156 156 ARG C C 156 177.350 177.350 179.502 -2.152 25155 16151 1 19 . 1 1 156 156 ARG CA C 156 59.950 59.950 59.045 0.905 25155 16152 1 19 . 1 1 156 156 ARG CB C 156 31.100 31.100 29.839 1.261 25155 16153 1 19 . 1 1 157 157 ILE N N 157 118.190 118.190 119.881 -1.691 25155 16154 1 19 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.707 -0.277 25155 16155 1 19 . 1 1 157 157 ILE C C 157 178.480 178.480 177.911 0.569 25155 16156 1 19 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.529 1.030 25155 16157 1 19 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.852 0.628 25155 16158 1 19 . 1 1 157 157 ILE H H 157 8.705 8.705 8.475 0.230 25155 16159 1 19 . 1 1 158 158 GLN N N 158 119.975 119.975 120.635 -0.660 25155 16160 1 19 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.903 0.053 25155 16161 1 19 . 1 1 158 158 GLN C C 158 178.730 178.730 178.280 0.450 25155 16162 1 19 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.311 1.389 25155 16163 1 19 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.289 0.193 25155 16164 1 19 . 1 1 158 158 GLN H H 158 8.262 8.262 8.493 -0.231 25155 16165 1 19 . 1 1 159 159 SER N N 159 115.466 115.466 115.389 0.077 25155 16166 1 19 . 1 1 159 159 SER HA H 159 4.446 4.446 4.288 0.158 25155 16167 1 19 . 1 1 159 159 SER C C 159 177.320 177.320 176.845 0.475 25155 16168 1 19 . 1 1 159 159 SER CA C 159 63.500 63.500 61.133 2.366 25155 16169 1 19 . 1 1 159 159 SER CB C 159 63.818 63.818 63.234 0.584 25155 16170 1 19 . 1 1 159 159 SER H H 159 8.440 8.440 8.112 0.328 25155 16171 1 19 . 1 1 160 160 TRP N N 160 126.784 126.784 124.896 1.888 25155 16172 1 19 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.450 0.004 25155 16173 1 19 . 1 1 160 160 TRP C C 160 177.934 177.934 177.803 0.131 25155 16174 1 19 . 1 1 160 160 TRP CA C 160 62.745 62.745 62.205 0.540 25155 16175 1 19 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.463 -0.113 25155 16176 1 19 . 1 1 160 160 TRP H H 160 9.243 9.243 7.746 1.497 25155 16177 1 19 . 1 1 161 161 CYS N N 161 116.395 116.395 118.835 -2.440 25155 16178 1 19 . 1 1 161 161 CYS HA H 161 3.886 3.886 3.835 0.051 25155 16179 1 19 . 1 1 161 161 CYS C C 161 176.245 176.245 177.014 -0.769 25155 16180 1 19 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.843 0.457 25155 16181 1 19 . 1 1 161 161 CYS CB C 161 27.723 27.723 27.058 0.665 25155 16182 1 19 . 1 1 161 161 CYS H H 161 8.845 8.845 9.100 -0.255 25155 16183 1 19 . 1 1 162 162 GLU N N 162 118.030 118.030 119.492 -1.462 25155 16184 1 19 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.874 0.046 25155 16185 1 19 . 1 1 162 162 GLU C C 162 178.700 178.700 178.748 -0.048 25155 16186 1 19 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.540 0.260 25155 16187 1 19 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.254 0.246 25155 16188 1 19 . 1 1 163 163 GLN N N 163 120.650 120.650 119.611 1.039 25155 16189 1 19 . 1 1 163 163 GLN HA H 163 4.173 4.173 4.027 0.146 25155 16190 1 19 . 1 1 163 163 GLN C C 163 179.700 179.700 178.456 1.244 25155 16191 1 19 . 1 1 163 163 GLN CA C 163 59.688 59.688 58.970 0.718 25155 16192 1 19 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.745 0.155 25155 16193 1 19 . 1 1 163 163 GLN H H 163 8.148 8.148 7.798 0.350 25155 16194 1 19 . 1 1 164 164 ILE N N 164 114.836 114.836 117.148 -2.312 25155 16195 1 19 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.594 0.466 25155 16196 1 19 . 1 1 164 164 ILE C C 164 178.676 178.676 177.704 0.972 25155 16197 1 19 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.456 1.704 25155 16198 1 19 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.333 0.297 25155 16199 1 19 . 1 1 164 164 ILE H H 164 8.958 8.958 8.272 0.686 25155 16200 1 19 . 1 1 165 165 LEU N N 165 123.700 123.700 119.832 3.868 25155 16201 1 19 . 1 1 165 165 LEU HA H 165 4.100 4.100 4.073 0.027 25155 16202 1 19 . 1 1 165 165 LEU C C 165 180.548 180.548 178.476 2.072 25155 16203 1 19 . 1 1 165 165 LEU CA C 165 58.150 58.150 58.262 -0.112 25155 16204 1 19 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.499 -0.369 25155 16205 1 19 . 1 1 165 165 LEU H H 165 7.830 7.830 7.911 -0.081 25155 16206 1 19 . 1 1 166 166 ASN N N 166 120.160 120.160 118.420 1.740 25155 16207 1 19 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.367 0.203 25155 16208 1 19 . 1 1 166 166 ASN C C 166 175.690 175.690 177.414 -1.724 25155 16209 1 19 . 1 1 166 166 ASN CA C 166 55.946 55.946 56.880 -0.934 25155 16210 1 19 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.367 0.113 25155 16211 1 19 . 1 1 166 166 ASN H H 166 7.706 7.706 7.835 -0.129 25155 16212 1 19 . 1 1 167 167 GLU N N 167 121.286 121.286 121.313 -0.027 25155 16213 1 19 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.069 0.035 25155 16214 1 19 . 1 1 167 167 GLU C C 167 180.520 180.520 179.318 1.202 25155 16215 1 19 . 1 1 167 167 GLU CA C 167 59.920 59.920 59.255 0.665 25155 16216 1 19 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.764 1.161 25155 16217 1 19 . 1 1 168 168 MET N N 168 118.622 118.622 116.137 2.485 25155 16218 1 19 . 1 1 168 168 MET HA H 168 3.996 3.996 4.304 -0.308 25155 16219 1 19 . 1 1 168 168 MET C C 168 176.856 176.856 177.857 -1.001 25155 16220 1 19 . 1 1 168 168 MET CA C 168 59.500 59.500 59.109 0.391 25155 16221 1 19 . 1 1 168 168 MET CB C 168 33.700 33.700 32.534 1.166 25155 16222 1 19 . 1 1 168 168 MET H H 168 8.723 8.723 8.531 0.192 25155 16223 1 19 . 1 1 169 169 ALA N N 169 121.760 121.760 123.466 -1.706 25155 16224 1 19 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.005 0.151 25155 16225 1 19 . 1 1 169 169 ALA C C 169 179.790 179.790 179.429 0.361 25155 16226 1 19 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.634 0.166 25155 16227 1 19 . 1 1 169 169 ALA CB C 169 18.220 18.220 18.333 -0.113 25155 16228 1 19 . 1 1 169 169 ALA H H 169 7.494 7.494 7.511 -0.017 25155 16229 1 19 . 1 1 170 170 GLU N N 170 116.970 116.970 118.257 -1.287 25155 16230 1 19 . 1 1 170 170 GLU HA H 170 4.091 4.091 3.883 0.208 25155 16231 1 19 . 1 1 170 170 GLU C C 170 177.745 177.745 178.360 -0.615 25155 16232 1 19 . 1 1 170 170 GLU CA C 170 58.000 58.000 58.760 -0.760 25155 16233 1 19 . 1 1 170 170 GLU CB C 170 29.730 29.730 29.556 0.174 25155 16234 1 19 . 1 1 171 171 HIS N N 171 118.150 118.150 118.058 0.092 25155 16235 1 19 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.333 0.137 25155 16236 1 19 . 1 1 171 171 HIS C C 171 175.848 175.848 177.226 -1.378 25155 16237 1 19 . 1 1 171 171 HIS CA C 171 57.600 57.600 58.849 -1.249 25155 16238 1 19 . 1 1 171 171 HIS CB C 171 30.800 30.800 30.340 0.460 25155 16239 1 19 . 1 1 171 171 HIS H H 171 7.717 7.717 7.737 -0.020 25155 16240 1 19 . 1 1 172 172 TYR N N 172 119.483 119.483 118.371 1.112 25155 16241 1 19 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.401 0.190 25155 16242 1 19 . 1 1 172 172 TYR C C 172 174.590 174.590 176.051 -1.461 25155 16243 1 19 . 1 1 172 172 TYR CA C 172 57.813 57.813 57.882 -0.069 25155 16244 1 19 . 1 1 172 172 TYR CB C 172 38.900 38.900 38.572 0.328 25155 16245 1 19 . 1 1 172 172 TYR H H 172 7.778 7.778 8.035 -0.257 25155 16246 1 20 . 1 1 2 2 ASN N N 2 122.966 122.966 120.137 2.829 25155 16247 1 20 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.135 0.040 25155 16248 1 20 . 1 1 2 2 ASN C C 2 175.200 175.200 173.529 1.671 25155 16249 1 20 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.382 0.538 25155 16250 1 20 . 1 1 2 2 ASN CB C 2 40.000 40.000 40.697 -0.697 25155 16251 1 20 . 1 1 2 2 ASN H H 2 9.392 9.392 8.165 1.227 25155 16252 1 20 . 1 1 3 3 MET N N 3 120.660 120.660 117.183 3.477 25155 16253 1 20 . 1 1 3 3 MET HA H 3 5.565 5.565 5.144 0.421 25155 16254 1 20 . 1 1 3 3 MET C C 3 174.200 174.200 175.451 -1.251 25155 16255 1 20 . 1 1 3 3 MET CA C 3 54.550 54.550 54.694 -0.144 25155 16256 1 20 . 1 1 3 3 MET CB C 3 34.100 34.100 36.440 -2.340 25155 16257 1 20 . 1 1 3 3 MET H H 3 8.745 8.745 9.100 -0.355 25155 16258 1 20 . 1 1 4 4 GLY N N 4 115.792 115.792 110.342 5.450 25155 16259 1 20 . 1 1 4 4 GLY C C 4 170.444 170.444 171.893 -1.449 25155 16260 1 20 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.809 -0.922 25155 16261 1 20 . 1 1 4 4 GLY H H 4 8.989 8.989 9.153 -0.164 25155 16262 1 20 . 1 1 5 5 LEU N N 5 131.175 131.175 128.735 2.440 25155 16263 1 20 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.138 1.184 25155 16264 1 20 . 1 1 5 5 LEU C C 5 175.700 175.700 174.582 1.118 25155 16265 1 20 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.326 -0.006 25155 16266 1 20 . 1 1 5 5 LEU CB C 5 44.700 44.700 43.526 1.174 25155 16267 1 20 . 1 1 5 5 LEU H H 5 8.917 8.917 9.166 -0.249 25155 16268 1 20 . 1 1 6 6 PHE N N 6 125.990 125.990 125.106 0.884 25155 16269 1 20 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.204 0.534 25155 16270 1 20 . 1 1 6 6 PHE C C 6 174.358 174.358 173.463 0.895 25155 16271 1 20 . 1 1 6 6 PHE CA C 6 55.480 55.480 54.814 0.666 25155 16272 1 20 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.204 -0.154 25155 16273 1 20 . 1 1 6 6 PHE H H 6 9.225 9.225 9.018 0.207 25155 16274 1 20 . 1 1 7 7 TYR N N 7 118.040 118.040 117.658 0.382 25155 16275 1 20 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.779 0.150 25155 16276 1 20 . 1 1 7 7 TYR C C 7 171.690 171.690 173.984 -2.294 25155 16277 1 20 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.866 -1.406 25155 16278 1 20 . 1 1 7 7 TYR CB C 7 40.800 40.800 40.602 0.198 25155 16279 1 20 . 1 1 7 7 TYR H H 7 8.235 8.235 7.948 0.287 25155 16280 1 20 . 1 1 8 8 GLY N N 8 106.640 106.640 106.634 0.006 25155 16281 1 20 . 1 1 8 8 GLY C C 8 171.682 171.682 172.778 -1.096 25155 16282 1 20 . 1 1 8 8 GLY CA C 8 44.050 44.050 45.436 -1.386 25155 16283 1 20 . 1 1 8 8 GLY H H 8 6.996 6.996 8.481 -1.485 25155 16284 1 20 . 1 1 9 9 SER N N 9 118.164 118.164 113.767 4.397 25155 16285 1 20 . 1 1 9 9 SER C C 9 174.560 174.560 173.764 0.796 25155 16286 1 20 . 1 1 9 9 SER CA C 9 57.140 57.140 58.810 -1.670 25155 16287 1 20 . 1 1 9 9 SER H H 9 9.680 9.680 8.679 1.001 25155 16288 1 20 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.847 -0.217 25155 16289 1 20 . 1 1 17 17 ALA C C 17 177.740 177.740 179.008 -1.268 25155 16290 1 20 . 1 1 17 17 ALA CA C 17 54.900 54.900 55.271 -0.371 25155 16291 1 20 . 1 1 17 17 ALA CB C 17 17.790 17.790 17.811 -0.021 25155 16292 1 20 . 1 1 17 17 ALA H H 17 8.055 8.055 8.214 -0.159 25155 16293 1 20 . 1 1 18 18 ALA N N 18 120.026 120.026 120.757 -0.731 25155 16294 1 20 . 1 1 18 18 ALA HA H 18 3.713 3.713 3.828 -0.115 25155 16295 1 20 . 1 1 18 18 ALA C C 18 179.040 179.040 179.663 -0.623 25155 16296 1 20 . 1 1 18 18 ALA CA C 18 54.860 54.860 54.875 -0.015 25155 16297 1 20 . 1 1 18 18 ALA CB C 18 18.200 18.200 17.602 0.598 25155 16298 1 20 . 1 1 18 18 ALA H H 18 7.015 7.015 8.091 -1.076 25155 16299 1 20 . 1 1 19 19 GLU N N 19 116.656 116.656 118.381 -1.725 25155 16300 1 20 . 1 1 19 19 GLU HA H 19 3.580 3.580 3.956 -0.376 25155 16301 1 20 . 1 1 19 19 GLU C C 19 178.487 178.487 179.275 -0.788 25155 16302 1 20 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.599 0.071 25155 16303 1 20 . 1 1 19 19 GLU CB C 19 29.400 29.400 29.354 0.046 25155 16304 1 20 . 1 1 20 20 LYS N N 20 120.100 120.100 119.705 0.395 25155 16305 1 20 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.043 0.303 25155 16306 1 20 . 1 1 20 20 LYS C C 20 175.330 175.330 179.231 -3.901 25155 16307 1 20 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.375 -2.275 25155 16308 1 20 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.481 0.519 25155 16309 1 20 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.710 -0.245 25155 16310 1 20 . 1 1 21 21 ILE C C 21 177.680 177.680 178.028 -0.348 25155 16311 1 20 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.542 0.098 25155 16312 1 20 . 1 1 21 21 ILE CB C 21 38.030 38.030 38.004 0.026 25155 16313 1 20 . 1 1 21 21 ILE H H 21 8.220 8.220 8.456 -0.236 25155 16314 1 20 . 1 1 22 22 ARG N N 22 119.433 119.433 118.573 0.860 25155 16315 1 20 . 1 1 22 22 ARG HA H 22 3.550 3.550 3.990 -0.440 25155 16316 1 20 . 1 1 22 22 ARG C C 22 177.268 177.268 178.332 -1.064 25155 16317 1 20 . 1 1 22 22 ARG CA C 22 59.760 59.760 59.286 0.474 25155 16318 1 20 . 1 1 22 22 ARG CB C 22 28.900 28.900 29.546 -0.646 25155 16319 1 20 . 1 1 23 23 ASP N N 23 118.945 118.945 120.006 -1.061 25155 16320 1 20 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.449 -0.107 25155 16321 1 20 . 1 1 23 23 ASP C C 23 178.470 178.470 178.665 -0.195 25155 16322 1 20 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.144 0.306 25155 16323 1 20 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.928 -0.558 25155 16324 1 20 . 1 1 24 24 ILE N N 24 121.200 121.200 119.523 1.677 25155 16325 1 20 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.851 -0.117 25155 16326 1 20 . 1 1 24 24 ILE C C 24 178.297 178.297 177.853 0.444 25155 16327 1 20 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.238 0.262 25155 16328 1 20 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.486 0.254 25155 16329 1 20 . 1 1 24 24 ILE H H 24 8.160 8.160 8.010 0.150 25155 16330 1 20 . 1 1 25 25 ILE N N 25 121.166 121.166 117.851 3.315 25155 16331 1 20 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.847 -0.204 25155 16332 1 20 . 1 1 25 25 ILE C C 25 176.825 176.825 176.767 0.058 25155 16333 1 20 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.249 2.641 25155 16334 1 20 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.744 -0.994 25155 16335 1 20 . 1 1 25 25 ILE H H 25 8.480 8.480 7.926 0.554 25155 16336 1 20 . 1 1 26 26 GLY N N 26 109.050 109.050 105.035 4.015 25155 16337 1 20 . 1 1 26 26 GLY C C 26 173.800 173.800 172.295 1.505 25155 16338 1 20 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.509 -0.109 25155 16339 1 20 . 1 1 26 26 GLY H H 26 7.945 7.945 7.741 0.204 25155 16340 1 20 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.482 -0.119 25155 16341 1 20 . 1 1 27 27 PRO C C 27 177.157 177.157 176.980 0.177 25155 16342 1 20 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.802 0.728 25155 16343 1 20 . 1 1 27 27 PRO CB C 27 32.000 32.000 32.094 -0.094 25155 16344 1 20 . 1 1 28 28 GLU N N 28 116.510 116.510 117.074 -0.564 25155 16345 1 20 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.222 0.038 25155 16346 1 20 . 1 1 28 28 GLU C C 28 177.000 177.000 177.105 -0.105 25155 16347 1 20 . 1 1 28 28 GLU CA C 28 57.680 57.680 58.031 -0.351 25155 16348 1 20 . 1 1 28 28 GLU CB C 28 28.620 28.620 29.238 -0.619 25155 16349 1 20 . 1 1 29 29 LEU N N 29 120.334 120.334 113.794 6.540 25155 16350 1 20 . 1 1 29 29 LEU HA H 29 4.650 4.650 4.732 -0.082 25155 16351 1 20 . 1 1 29 29 LEU C C 29 175.676 175.676 175.435 0.241 25155 16352 1 20 . 1 1 29 29 LEU CA C 29 55.924 55.924 55.175 0.749 25155 16353 1 20 . 1 1 29 29 LEU CB C 29 44.880 44.880 44.188 0.692 25155 16354 1 20 . 1 1 29 29 LEU H H 29 7.924 7.924 7.518 0.406 25155 16355 1 20 . 1 1 30 30 VAL N N 30 118.900 118.900 120.563 -1.663 25155 16356 1 20 . 1 1 30 30 VAL HA H 30 4.639 4.639 4.797 -0.158 25155 16357 1 20 . 1 1 30 30 VAL C C 30 174.368 174.368 175.965 -1.597 25155 16358 1 20 . 1 1 30 30 VAL CA C 30 61.110 61.110 61.662 -0.552 25155 16359 1 20 . 1 1 30 30 VAL CB C 30 34.500 34.500 33.593 0.907 25155 16360 1 20 . 1 1 30 30 VAL H H 30 7.486 7.486 7.555 -0.069 25155 16361 1 20 . 1 1 31 31 THR N N 31 124.000 124.000 120.813 3.187 25155 16362 1 20 . 1 1 31 31 THR HA H 31 4.331 4.331 4.783 -0.452 25155 16363 1 20 . 1 1 31 31 THR C C 31 172.670 172.670 173.076 -0.406 25155 16364 1 20 . 1 1 31 31 THR CA C 31 61.784 61.784 61.208 0.577 25155 16365 1 20 . 1 1 31 31 THR CB C 31 70.483 70.483 71.408 -0.925 25155 16366 1 20 . 1 1 31 31 THR H H 31 7.947 7.947 8.787 -0.840 25155 16367 1 20 . 1 1 32 32 LEU N N 32 127.408 127.408 125.283 2.125 25155 16368 1 20 . 1 1 32 32 LEU HA H 32 4.637 4.637 5.155 -0.518 25155 16369 1 20 . 1 1 32 32 LEU C C 32 176.425 176.425 177.143 -0.718 25155 16370 1 20 . 1 1 32 32 LEU CA C 32 54.760 54.760 54.258 0.502 25155 16371 1 20 . 1 1 32 32 LEU CB C 32 43.809 43.809 43.533 0.276 25155 16372 1 20 . 1 1 32 32 LEU H H 32 8.614 8.614 8.622 -0.008 25155 16373 1 20 . 1 1 33 33 HIS N N 33 120.230 120.230 120.541 -0.311 25155 16374 1 20 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.907 -0.487 25155 16375 1 20 . 1 1 33 33 HIS C C 33 171.914 171.914 174.070 -2.156 25155 16376 1 20 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.948 0.352 25155 16377 1 20 . 1 1 33 33 HIS CB C 33 32.050 32.050 32.290 -0.240 25155 16378 1 20 . 1 1 33 33 HIS H H 33 9.130 9.130 8.933 0.197 25155 16379 1 20 . 1 1 34 34 ASN N N 34 123.987 123.987 121.992 1.995 25155 16380 1 20 . 1 1 34 34 ASN HA H 34 3.600 3.600 4.758 -1.158 25155 16381 1 20 . 1 1 34 34 ASN C C 34 177.930 177.930 175.523 2.407 25155 16382 1 20 . 1 1 34 34 ASN CA C 34 51.730 51.730 51.225 0.505 25155 16383 1 20 . 1 1 34 34 ASN CB C 34 38.747 38.747 38.842 -0.095 25155 16384 1 20 . 1 1 34 34 ASN H H 34 8.759 8.759 9.308 -0.549 25155 16385 1 20 . 1 1 35 35 LEU N N 35 128.751 128.751 126.013 2.738 25155 16386 1 20 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.423 -0.133 25155 16387 1 20 . 1 1 35 35 LEU C C 35 177.363 177.363 178.186 -0.823 25155 16388 1 20 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.175 0.375 25155 16389 1 20 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.603 1.159 25155 16390 1 20 . 1 1 35 35 LEU H H 35 8.758 8.758 8.029 0.729 25155 16391 1 20 . 1 1 36 36 LYS N N 36 120.870 120.870 118.742 2.128 25155 16392 1 20 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.119 -0.186 25155 16393 1 20 . 1 1 36 36 LYS C C 36 176.540 176.540 176.931 -0.391 25155 16394 1 20 . 1 1 36 36 LYS CA C 36 59.260 59.260 58.315 0.945 25155 16395 1 20 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.620 0.180 25155 16396 1 20 . 1 1 37 37 ASP N N 37 115.288 115.288 116.353 -1.065 25155 16397 1 20 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.757 -0.010 25155 16398 1 20 . 1 1 37 37 ASP C C 37 175.500 175.500 176.050 -0.550 25155 16399 1 20 . 1 1 37 37 ASP CA C 37 54.805 54.805 54.645 0.160 25155 16400 1 20 . 1 1 37 37 ASP CB C 37 44.650 44.650 43.438 1.212 25155 16401 1 20 . 1 1 38 38 ASP N N 38 121.550 121.550 122.091 -0.541 25155 16402 1 20 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.778 0.087 25155 16403 1 20 . 1 1 38 38 ASP C C 38 174.895 174.895 176.223 -1.328 25155 16404 1 20 . 1 1 38 38 ASP CA C 38 52.840 52.840 54.862 -2.022 25155 16405 1 20 . 1 1 38 38 ASP CB C 38 42.240 42.240 41.646 0.594 25155 16406 1 20 . 1 1 39 39 SER N N 39 115.170 115.170 119.513 -4.343 25155 16407 1 20 . 1 1 39 39 SER HA H 39 4.600 4.600 4.609 -0.009 25155 16408 1 20 . 1 1 39 39 SER C C 39 174.930 174.930 174.624 0.306 25155 16409 1 20 . 1 1 39 39 SER CA C 39 54.786 54.786 56.842 -2.056 25155 16410 1 20 . 1 1 39 39 SER CB C 39 64.840 64.840 63.317 1.523 25155 16411 1 20 . 1 1 39 39 SER H H 39 8.330 8.330 8.629 -0.299 25155 16412 1 20 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.285 -0.285 25155 16413 1 20 . 1 1 40 40 PRO C C 40 176.620 176.620 178.127 -1.507 25155 16414 1 20 . 1 1 40 40 PRO CA C 40 63.870 63.870 64.749 -0.879 25155 16415 1 20 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.799 -0.439 25155 16416 1 20 . 1 1 41 41 LYS N N 41 120.913 120.913 118.241 2.672 25155 16417 1 20 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.077 -0.181 25155 16418 1 20 . 1 1 41 41 LYS C C 41 179.580 179.580 178.752 0.828 25155 16419 1 20 . 1 1 41 41 LYS CA C 41 58.000 58.000 59.091 -1.091 25155 16420 1 20 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.157 0.943 25155 16421 1 20 . 1 1 42 42 LEU N N 42 118.206 118.206 120.237 -2.031 25155 16422 1 20 . 1 1 42 42 LEU HA H 42 4.025 4.025 4.079 -0.054 25155 16423 1 20 . 1 1 42 42 LEU C C 42 178.630 178.630 178.688 -0.058 25155 16424 1 20 . 1 1 42 42 LEU CA C 42 57.030 57.030 57.757 -0.727 25155 16425 1 20 . 1 1 42 42 LEU CB C 42 41.820 41.820 41.160 0.660 25155 16426 1 20 . 1 1 42 42 LEU H H 42 7.598 7.598 7.769 -0.171 25155 16427 1 20 . 1 1 43 43 MET N N 43 118.913 118.913 116.912 2.001 25155 16428 1 20 . 1 1 43 43 MET HA H 43 3.760 3.760 4.282 -0.522 25155 16429 1 20 . 1 1 43 43 MET C C 43 177.710 177.710 178.672 -0.962 25155 16430 1 20 . 1 1 43 43 MET CA C 43 59.864 59.864 58.975 0.889 25155 16431 1 20 . 1 1 43 43 MET CB C 43 32.680 32.680 31.948 0.732 25155 16432 1 20 . 1 1 43 43 MET H H 43 8.180 8.180 8.203 -0.023 25155 16433 1 20 . 1 1 44 44 GLU N N 44 110.906 110.906 119.747 -8.841 25155 16434 1 20 . 1 1 44 44 GLU HA H 44 3.732 3.732 4.094 -0.362 25155 16435 1 20 . 1 1 44 44 GLU C C 44 178.120 178.120 179.234 -1.114 25155 16436 1 20 . 1 1 44 44 GLU CA C 44 59.450 59.450 59.269 0.181 25155 16437 1 20 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.251 0.549 25155 16438 1 20 . 1 1 45 45 GLN N N 45 115.770 115.770 117.081 -1.311 25155 16439 1 20 . 1 1 45 45 GLN HA H 45 4.190 4.190 4.048 0.142 25155 16440 1 20 . 1 1 45 45 GLN C C 45 175.480 175.480 176.716 -1.236 25155 16441 1 20 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.015 -0.915 25155 16442 1 20 . 1 1 45 45 GLN CB C 45 28.490 28.490 29.036 -0.546 25155 16443 1 20 . 1 1 45 45 GLN H H 45 7.517 7.517 7.706 -0.189 25155 16444 1 20 . 1 1 46 46 TYR N N 46 117.840 117.840 118.573 -0.733 25155 16445 1 20 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.569 0.091 25155 16446 1 20 . 1 1 46 46 TYR C C 46 175.480 175.480 176.031 -0.551 25155 16447 1 20 . 1 1 46 46 TYR CA C 46 58.827 58.827 58.667 0.160 25155 16448 1 20 . 1 1 46 46 TYR CB C 46 41.720 41.720 39.019 2.701 25155 16449 1 20 . 1 1 46 46 TYR H H 46 6.955 6.955 7.534 -0.579 25155 16450 1 20 . 1 1 47 47 ASP N N 47 121.540 121.540 122.591 -1.051 25155 16451 1 20 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.513 0.183 25155 16452 1 20 . 1 1 47 47 ASP C C 47 175.677 175.677 176.059 -0.382 25155 16453 1 20 . 1 1 47 47 ASP CA C 47 56.812 56.812 57.174 -0.362 25155 16454 1 20 . 1 1 47 47 ASP CB C 47 42.978 42.978 41.694 1.284 25155 16455 1 20 . 1 1 48 48 VAL N N 48 118.666 118.666 116.924 1.742 25155 16456 1 20 . 1 1 48 48 VAL HA H 48 5.057 5.057 4.871 0.186 25155 16457 1 20 . 1 1 48 48 VAL C C 48 174.180 174.180 174.457 -0.277 25155 16458 1 20 . 1 1 48 48 VAL CA C 48 60.000 60.000 61.227 -1.227 25155 16459 1 20 . 1 1 48 48 VAL CB C 48 36.200 36.200 33.733 2.467 25155 16460 1 20 . 1 1 48 48 VAL H H 48 7.631 7.631 7.944 -0.313 25155 16461 1 20 . 1 1 49 49 LEU N N 49 128.300 128.300 126.696 1.604 25155 16462 1 20 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.500 0.100 25155 16463 1 20 . 1 1 49 49 LEU C C 49 174.810 174.810 174.824 -0.014 25155 16464 1 20 . 1 1 49 49 LEU CA C 49 52.230 52.230 53.112 -0.882 25155 16465 1 20 . 1 1 49 49 LEU CB C 49 45.400 45.400 46.919 -1.519 25155 16466 1 20 . 1 1 49 49 LEU H H 49 9.469 9.469 8.936 0.533 25155 16467 1 20 . 1 1 50 50 ILE N N 50 124.400 124.400 123.627 0.773 25155 16468 1 20 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.698 0.952 25155 16469 1 20 . 1 1 50 50 ILE C C 50 175.286 175.286 173.793 1.493 25155 16470 1 20 . 1 1 50 50 ILE CA C 50 59.900 59.900 60.453 -0.553 25155 16471 1 20 . 1 1 50 50 ILE CB C 50 40.200 40.200 41.750 -1.550 25155 16472 1 20 . 1 1 50 50 ILE H H 50 9.213 9.213 9.076 0.137 25155 16473 1 20 . 1 1 51 51 LEU N N 51 127.410 127.410 127.588 -0.178 25155 16474 1 20 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.030 2.040 25155 16475 1 20 . 1 1 51 51 LEU C C 51 174.540 174.540 175.254 -0.714 25155 16476 1 20 . 1 1 51 51 LEU CA C 51 52.950 52.950 53.039 -0.089 25155 16477 1 20 . 1 1 51 51 LEU CB C 51 43.190 43.190 43.990 -0.800 25155 16478 1 20 . 1 1 51 51 LEU H H 51 9.256 9.256 8.625 0.631 25155 16479 1 20 . 1 1 52 52 GLY N N 52 108.290 108.290 110.333 -2.043 25155 16480 1 20 . 1 1 52 52 GLY C C 52 174.330 174.330 171.504 2.826 25155 16481 1 20 . 1 1 52 52 GLY CA C 52 44.040 44.040 43.577 0.463 25155 16482 1 20 . 1 1 52 52 GLY H H 52 8.949 8.949 7.935 1.014 25155 16483 1 20 . 1 1 53 53 ILE N N 53 124.912 124.912 120.752 4.160 25155 16484 1 20 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.323 -0.148 25155 16485 1 20 . 1 1 53 53 ILE C C 53 174.470 174.470 172.920 1.550 25155 16486 1 20 . 1 1 53 53 ILE CA C 53 55.850 55.850 57.716 -1.866 25155 16487 1 20 . 1 1 53 53 ILE CB C 53 42.800 42.800 41.532 1.268 25155 16488 1 20 . 1 1 53 53 ILE H H 53 8.612 8.612 7.357 1.255 25155 16489 1 20 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.809 0.003 25155 16490 1 20 . 1 1 54 54 PRO C C 54 174.565 174.565 176.206 -1.641 25155 16491 1 20 . 1 1 54 54 PRO CA C 54 61.850 61.850 61.837 0.013 25155 16492 1 20 . 1 1 54 54 PRO CB C 54 32.400 32.400 31.947 0.453 25155 16493 1 20 . 1 1 55 55 THR N N 55 116.040 116.040 118.907 -2.867 25155 16494 1 20 . 1 1 55 55 THR HA H 55 4.522 4.522 4.310 0.212 25155 16495 1 20 . 1 1 55 55 THR C C 55 173.990 173.990 173.500 0.490 25155 16496 1 20 . 1 1 55 55 THR CA C 55 62.845 62.845 63.231 -0.386 25155 16497 1 20 . 1 1 55 55 THR CB C 55 70.795 70.795 70.228 0.567 25155 16498 1 20 . 1 1 55 55 THR H H 55 7.663 7.663 8.679 -1.016 25155 16499 1 20 . 1 1 56 56 TRP N N 56 130.540 130.540 128.089 2.451 25155 16500 1 20 . 1 1 56 56 TRP CA C 56 54.800 54.800 55.630 -0.830 25155 16501 1 20 . 1 1 56 56 TRP H H 56 9.075 9.075 8.316 0.759 25155 16502 1 20 . 1 1 58 58 PHE HA H 58 4.540 4.540 3.963 0.577 25155 16503 1 20 . 1 1 58 58 PHE C C 58 177.070 177.070 175.821 1.249 25155 16504 1 20 . 1 1 58 58 PHE CA C 58 55.460 55.460 59.469 -4.009 25155 16505 1 20 . 1 1 58 58 PHE CB C 58 41.200 41.200 38.757 2.443 25155 16506 1 20 . 1 1 59 59 GLY N N 59 109.796 109.796 103.207 6.589 25155 16507 1 20 . 1 1 59 59 GLY CA C 59 45.763 45.763 44.014 1.749 25155 16508 1 20 . 1 1 59 59 GLY H H 59 8.392 8.392 6.320 2.072 25155 16509 1 20 . 1 1 60 60 GLU C C 60 175.660 175.660 175.561 0.099 25155 16510 1 20 . 1 1 61 61 ILE N N 61 122.380 122.380 120.744 1.636 25155 16511 1 20 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.515 0.925 25155 16512 1 20 . 1 1 61 61 ILE CA C 61 62.100 62.100 62.757 -0.657 25155 16513 1 20 . 1 1 61 61 ILE CB C 61 38.750 38.750 37.076 1.674 25155 16514 1 20 . 1 1 61 61 ILE H H 61 8.436 8.436 8.258 0.178 25155 16515 1 20 . 1 1 62 62 GLN CB C 62 30.570 30.570 29.253 1.317 25155 16516 1 20 . 1 1 63 63 GLU HA H 63 4.030 4.030 3.873 0.157 25155 16517 1 20 . 1 1 63 63 GLU C C 63 177.134 177.134 177.662 -0.528 25155 16518 1 20 . 1 1 63 63 GLU CA C 63 60.520 60.520 60.796 -0.276 25155 16519 1 20 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.533 0.117 25155 16520 1 20 . 1 1 64 64 ASP N N 64 119.630 119.630 117.826 1.804 25155 16521 1 20 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.478 0.114 25155 16522 1 20 . 1 1 64 64 ASP C C 64 178.680 178.680 177.216 1.464 25155 16523 1 20 . 1 1 64 64 ASP CA C 64 57.823 57.823 56.529 1.294 25155 16524 1 20 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.235 0.865 25155 16525 1 20 . 1 1 65 65 TRP N N 65 120.535 120.535 121.384 -0.849 25155 16526 1 20 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.593 -0.268 25155 16527 1 20 . 1 1 65 65 TRP C C 65 178.684 178.684 177.679 1.005 25155 16528 1 20 . 1 1 65 65 TRP CA C 65 60.500 60.500 61.306 -0.805 25155 16529 1 20 . 1 1 65 65 TRP CB C 65 30.100 30.100 31.064 -0.964 25155 16530 1 20 . 1 1 65 65 TRP H H 65 7.416 7.416 7.865 -0.449 25155 16531 1 20 . 1 1 66 66 GLU N N 66 120.760 120.760 120.756 0.004 25155 16532 1 20 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.124 -0.304 25155 16533 1 20 . 1 1 66 66 GLU C C 66 178.860 178.860 178.916 -0.056 25155 16534 1 20 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.731 0.369 25155 16535 1 20 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.550 -0.540 25155 16536 1 20 . 1 1 67 67 ALA N N 67 118.972 118.972 121.773 -2.801 25155 16537 1 20 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.185 0.062 25155 16538 1 20 . 1 1 67 67 ALA C C 67 179.610 179.610 178.897 0.713 25155 16539 1 20 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.892 -0.292 25155 16540 1 20 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.910 -0.122 25155 16541 1 20 . 1 1 67 67 ALA H H 67 7.690 7.690 8.456 -0.766 25155 16542 1 20 . 1 1 68 68 VAL N N 68 107.530 107.530 110.468 -2.938 25155 16543 1 20 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.361 0.349 25155 16544 1 20 . 1 1 68 68 VAL C C 68 176.800 176.800 177.183 -0.383 25155 16545 1 20 . 1 1 68 68 VAL CA C 68 60.060 60.060 62.370 -2.310 25155 16546 1 20 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.401 0.199 25155 16547 1 20 . 1 1 68 68 VAL H H 68 7.240 7.240 7.543 -0.303 25155 16548 1 20 . 1 1 69 69 TRP N N 69 126.960 126.960 125.575 1.385 25155 16549 1 20 . 1 1 69 69 TRP HA H 69 4.182 4.182 4.063 0.119 25155 16550 1 20 . 1 1 69 69 TRP C C 69 178.640 178.640 176.793 1.847 25155 16551 1 20 . 1 1 69 69 TRP CA C 69 61.300 61.300 63.242 -1.942 25155 16552 1 20 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.655 1.915 25155 16553 1 20 . 1 1 69 69 TRP H H 69 7.810 7.810 8.215 -0.405 25155 16554 1 20 . 1 1 70 70 ASP N N 70 114.644 114.644 116.817 -2.173 25155 16555 1 20 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.164 0.355 25155 16556 1 20 . 1 1 70 70 ASP C C 70 178.685 178.685 178.006 0.679 25155 16557 1 20 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.467 -0.467 25155 16558 1 20 . 1 1 70 70 ASP CB C 70 39.810 39.810 40.987 -1.177 25155 16559 1 20 . 1 1 71 71 GLN N N 71 120.100 120.100 117.104 2.996 25155 16560 1 20 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.197 -0.007 25155 16561 1 20 . 1 1 71 71 GLN C C 71 178.870 178.870 177.733 1.137 25155 16562 1 20 . 1 1 71 71 GLN CA C 71 57.617 57.617 57.007 0.610 25155 16563 1 20 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.570 -0.750 25155 16564 1 20 . 1 1 71 71 GLN H H 71 7.980 7.980 7.764 0.216 25155 16565 1 20 . 1 1 72 72 LEU N N 72 117.535 117.535 118.741 -1.206 25155 16566 1 20 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.861 -0.064 25155 16567 1 20 . 1 1 72 72 LEU C C 72 178.308 178.308 177.766 0.542 25155 16568 1 20 . 1 1 72 72 LEU CA C 72 57.340 57.340 57.124 0.216 25155 16569 1 20 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.616 0.084 25155 16570 1 20 . 1 1 72 72 LEU H H 72 7.435 7.435 7.416 0.019 25155 16571 1 20 . 1 1 73 73 ASP N N 73 115.534 115.534 116.213 -0.679 25155 16572 1 20 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.340 -0.190 25155 16573 1 20 . 1 1 73 73 ASP C C 73 177.553 177.553 176.979 0.574 25155 16574 1 20 . 1 1 73 73 ASP CA C 73 57.350 57.350 56.172 1.178 25155 16575 1 20 . 1 1 73 73 ASP CB C 73 40.040 40.040 41.304 -1.264 25155 16576 1 20 . 1 1 74 74 ASP N N 74 117.300 117.300 119.994 -2.694 25155 16577 1 20 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.497 0.209 25155 16578 1 20 . 1 1 74 74 ASP C C 74 176.424 176.424 177.196 -0.772 25155 16579 1 20 . 1 1 74 74 ASP CA C 74 54.170 54.170 55.233 -1.063 25155 16580 1 20 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.398 0.422 25155 16581 1 20 . 1 1 75 75 LEU N N 75 118.500 118.500 120.502 -2.002 25155 16582 1 20 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.183 0.112 25155 16583 1 20 . 1 1 75 75 LEU C C 75 176.800 176.800 176.315 0.485 25155 16584 1 20 . 1 1 75 75 LEU CA C 75 54.400 54.400 55.155 -0.755 25155 16585 1 20 . 1 1 75 75 LEU CB C 75 43.280 43.280 41.892 1.388 25155 16586 1 20 . 1 1 75 75 LEU H H 75 6.966 6.966 7.528 -0.562 25155 16587 1 20 . 1 1 76 76 ASN N N 76 123.040 123.040 119.795 3.245 25155 16588 1 20 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.744 0.118 25155 16589 1 20 . 1 1 76 76 ASN C C 76 174.927 174.927 174.111 0.816 25155 16590 1 20 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.216 -1.335 25155 16591 1 20 . 1 1 76 76 ASN CB C 76 37.510 37.510 39.635 -2.125 25155 16592 1 20 . 1 1 76 76 ASN H H 76 9.882 9.882 9.090 0.792 25155 16593 1 20 . 1 1 77 77 LEU N N 77 123.614 123.614 123.495 0.119 25155 16594 1 20 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.615 -0.245 25155 16595 1 20 . 1 1 77 77 LEU C C 77 175.110 175.110 176.133 -1.023 25155 16596 1 20 . 1 1 77 77 LEU CA C 77 52.200 52.200 53.204 -1.004 25155 16597 1 20 . 1 1 77 77 LEU CB C 77 42.786 42.786 42.958 -0.172 25155 16598 1 20 . 1 1 77 77 LEU H H 77 8.700 8.700 8.689 0.011 25155 16599 1 20 . 1 1 78 78 GLU N N 78 120.822 120.822 121.603 -0.781 25155 16600 1 20 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.098 -0.198 25155 16601 1 20 . 1 1 78 78 GLU C C 78 178.670 178.670 177.982 0.688 25155 16602 1 20 . 1 1 78 78 GLU CA C 78 58.700 58.700 57.998 0.702 25155 16603 1 20 . 1 1 78 78 GLU CB C 78 29.467 29.467 29.366 0.101 25155 16604 1 20 . 1 1 79 79 GLY N N 79 113.160 113.160 112.762 0.398 25155 16605 1 20 . 1 1 79 79 GLY C C 79 174.523 174.523 174.091 0.432 25155 16606 1 20 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.480 -0.060 25155 16607 1 20 . 1 1 79 79 GLY H H 79 8.450 8.450 8.516 -0.066 25155 16608 1 20 . 1 1 80 80 LYS N N 80 120.283 120.283 120.487 -0.204 25155 16609 1 20 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.329 0.029 25155 16610 1 20 . 1 1 80 80 LYS C C 80 175.304 175.304 176.052 -0.748 25155 16611 1 20 . 1 1 80 80 LYS CA C 80 56.890 56.890 56.265 0.625 25155 16612 1 20 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.803 -0.683 25155 16613 1 20 . 1 1 81 81 ILE N N 81 122.288 122.288 122.514 -0.226 25155 16614 1 20 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.527 0.279 25155 16615 1 20 . 1 1 81 81 ILE C C 81 174.750 174.750 175.350 -0.600 25155 16616 1 20 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.810 -1.990 25155 16617 1 20 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.511 0.339 25155 16618 1 20 . 1 1 81 81 ILE H H 81 7.405 7.405 7.958 -0.553 25155 16619 1 20 . 1 1 82 82 VAL N N 82 127.793 127.793 127.237 0.556 25155 16620 1 20 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.030 0.250 25155 16621 1 20 . 1 1 82 82 VAL C C 82 172.680 172.680 174.346 -1.666 25155 16622 1 20 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.759 -0.659 25155 16623 1 20 . 1 1 82 82 VAL CB C 82 35.280 35.280 35.289 -0.009 25155 16624 1 20 . 1 1 82 82 VAL H H 82 8.800 8.800 9.147 -0.347 25155 16625 1 20 . 1 1 83 83 ALA N N 83 130.911 130.911 129.760 1.151 25155 16626 1 20 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.720 -0.331 25155 16627 1 20 . 1 1 83 83 ALA C C 83 175.870 175.870 176.328 -0.458 25155 16628 1 20 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.631 0.369 25155 16629 1 20 . 1 1 83 83 ALA CB C 83 23.722 23.722 21.682 2.040 25155 16630 1 20 . 1 1 83 83 ALA H H 83 9.252 9.252 9.162 0.090 25155 16631 1 20 . 1 1 84 84 LEU N N 84 124.269 124.269 122.381 1.888 25155 16632 1 20 . 1 1 84 84 LEU HA H 84 5.508 5.508 5.126 0.382 25155 16633 1 20 . 1 1 84 84 LEU C C 84 175.490 175.490 175.631 -0.141 25155 16634 1 20 . 1 1 84 84 LEU CA C 84 53.670 53.670 54.298 -0.628 25155 16635 1 20 . 1 1 84 84 LEU CB C 84 45.000 45.000 45.211 -0.211 25155 16636 1 20 . 1 1 84 84 LEU H H 84 10.378 10.378 8.628 1.750 25155 16637 1 20 . 1 1 85 85 TYR N N 85 115.826 115.826 119.858 -4.032 25155 16638 1 20 . 1 1 85 85 TYR HA H 85 4.950 4.950 5.335 -0.385 25155 16639 1 20 . 1 1 85 85 TYR C C 85 172.661 172.661 173.885 -1.224 25155 16640 1 20 . 1 1 85 85 TYR CA C 85 55.853 55.853 55.112 0.741 25155 16641 1 20 . 1 1 85 85 TYR CB C 85 43.200 43.200 41.560 1.640 25155 16642 1 20 . 1 1 85 85 TYR H H 85 9.200 9.200 8.826 0.374 25155 16643 1 20 . 1 1 86 86 GLY N N 86 106.802 106.802 105.930 0.872 25155 16644 1 20 . 1 1 86 86 GLY C C 86 170.348 170.348 171.332 -0.984 25155 16645 1 20 . 1 1 86 86 GLY CA C 86 44.687 44.687 45.009 -0.322 25155 16646 1 20 . 1 1 86 86 GLY H H 86 8.752 8.752 8.217 0.535 25155 16647 1 20 . 1 1 87 87 LEU N N 87 120.860 120.860 118.206 2.654 25155 16648 1 20 . 1 1 87 87 LEU HA H 87 5.476 5.476 5.170 0.306 25155 16649 1 20 . 1 1 87 87 LEU C C 87 177.720 177.720 176.455 1.265 25155 16650 1 20 . 1 1 87 87 LEU CA C 87 52.630 52.630 53.093 -0.462 25155 16651 1 20 . 1 1 87 87 LEU CB C 87 45.900 45.900 44.992 0.908 25155 16652 1 20 . 1 1 87 87 LEU H H 87 6.320 6.320 8.202 -1.882 25155 16653 1 20 . 1 1 88 88 GLY N N 88 109.910 109.910 106.587 3.323 25155 16654 1 20 . 1 1 88 88 GLY C C 88 171.386 171.386 171.582 -0.196 25155 16655 1 20 . 1 1 88 88 GLY CA C 88 45.710 45.710 45.944 -0.234 25155 16656 1 20 . 1 1 88 88 GLY H H 88 8.320 8.320 7.977 0.343 25155 16657 1 20 . 1 1 89 89 ASP N N 89 121.580 121.580 119.704 1.876 25155 16658 1 20 . 1 1 89 89 ASP HA H 89 5.190 5.190 5.382 -0.192 25155 16659 1 20 . 1 1 89 89 ASP C C 89 176.608 176.608 176.261 0.347 25155 16660 1 20 . 1 1 89 89 ASP CA C 89 52.200 52.200 52.786 -0.586 25155 16661 1 20 . 1 1 89 89 ASP CB C 89 41.900 41.900 41.868 0.032 25155 16662 1 20 . 1 1 90 90 GLN N N 90 123.900 123.900 125.367 -1.467 25155 16663 1 20 . 1 1 90 90 GLN HA H 90 3.645 3.645 4.173 -0.528 25155 16664 1 20 . 1 1 90 90 GLN C C 90 173.523 173.523 176.288 -2.765 25155 16665 1 20 . 1 1 90 90 GLN CA C 90 58.706 58.706 57.734 0.972 25155 16666 1 20 . 1 1 90 90 GLN CB C 90 28.800 28.800 28.951 -0.151 25155 16667 1 20 . 1 1 90 90 GLN H H 90 8.726 8.726 9.319 -0.593 25155 16668 1 20 . 1 1 91 91 LEU N N 91 117.080 117.080 119.017 -1.937 25155 16669 1 20 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.212 0.258 25155 16670 1 20 . 1 1 91 91 LEU C C 91 179.840 179.840 178.273 1.567 25155 16671 1 20 . 1 1 91 91 LEU CA C 91 55.800 55.800 55.961 -0.161 25155 16672 1 20 . 1 1 91 91 LEU CB C 91 41.640 41.640 42.191 -0.551 25155 16673 1 20 . 1 1 91 91 LEU H H 91 7.092 7.092 8.714 -1.622 25155 16674 1 20 . 1 1 92 92 GLY N N 92 110.460 110.460 106.376 4.084 25155 16675 1 20 . 1 1 92 92 GLY C C 92 174.824 174.824 175.128 -0.304 25155 16676 1 20 . 1 1 92 92 GLY CA C 92 46.390 46.390 46.678 -0.288 25155 16677 1 20 . 1 1 92 92 GLY H H 92 9.243 9.243 8.463 0.780 25155 16678 1 20 . 1 1 93 93 TYR N N 93 118.140 118.140 120.098 -1.958 25155 16679 1 20 . 1 1 93 93 TYR HA H 93 5.173 5.173 5.090 0.083 25155 16680 1 20 . 1 1 93 93 TYR C C 93 177.805 177.805 178.236 -0.431 25155 16681 1 20 . 1 1 93 93 TYR CA C 93 57.430 57.430 57.561 -0.131 25155 16682 1 20 . 1 1 93 93 TYR CB C 93 39.300 39.300 39.621 -0.321 25155 16683 1 20 . 1 1 93 93 TYR H H 93 7.252 7.252 7.748 -0.496 25155 16684 1 20 . 1 1 94 94 GLY N N 94 112.455 112.455 107.075 5.380 25155 16685 1 20 . 1 1 94 94 GLY C C 94 177.740 177.740 176.177 1.563 25155 16686 1 20 . 1 1 94 94 GLY CA C 94 49.880 49.880 46.878 3.002 25155 16687 1 20 . 1 1 94 94 GLY H H 94 8.154 8.154 8.436 -0.282 25155 16688 1 20 . 1 1 95 95 GLU N N 95 123.040 123.040 122.068 0.972 25155 16689 1 20 . 1 1 95 95 GLU HA H 95 4.000 4.000 3.953 0.047 25155 16690 1 20 . 1 1 95 95 GLU C C 95 175.145 175.145 176.552 -1.407 25155 16691 1 20 . 1 1 95 95 GLU CA C 95 57.950 57.950 58.544 -0.593 25155 16692 1 20 . 1 1 95 95 GLU CB C 95 27.400 27.400 29.209 -1.809 25155 16693 1 20 . 1 1 96 96 TRP N N 96 118.000 118.000 114.888 3.112 25155 16694 1 20 . 1 1 96 96 TRP HA H 96 5.213 5.213 5.061 0.152 25155 16695 1 20 . 1 1 96 96 TRP C C 96 176.616 176.616 175.484 1.132 25155 16696 1 20 . 1 1 96 96 TRP CA C 96 57.120 57.120 55.555 1.565 25155 16697 1 20 . 1 1 96 96 TRP CB C 96 29.970 29.970 28.848 1.123 25155 16698 1 20 . 1 1 96 96 TRP H H 96 7.785 7.785 7.974 -0.189 25155 16699 1 20 . 1 1 97 97 PHE N N 97 123.268 123.268 122.798 0.470 25155 16700 1 20 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.429 0.231 25155 16701 1 20 . 1 1 97 97 PHE CA C 97 58.742 58.742 59.976 -1.234 25155 16702 1 20 . 1 1 97 97 PHE CB C 97 40.835 40.835 39.824 1.011 25155 16703 1 20 . 1 1 97 97 PHE H H 97 7.054 7.054 7.650 -0.596 25155 16704 1 20 . 1 1 98 98 LEU HA H 98 3.440 3.440 3.558 -0.118 25155 16705 1 20 . 1 1 98 98 LEU C C 98 176.613 176.613 176.953 -0.340 25155 16706 1 20 . 1 1 98 98 LEU CA C 98 56.000 56.000 55.256 0.744 25155 16707 1 20 . 1 1 98 98 LEU CB C 98 38.600 38.600 39.291 -0.691 25155 16708 1 20 . 1 1 98 98 LEU H H 98 8.584 8.584 8.124 0.460 25155 16709 1 20 . 1 1 99 99 ASP N N 99 123.268 123.268 120.281 2.987 25155 16710 1 20 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.356 -0.391 25155 16711 1 20 . 1 1 99 99 ASP C C 99 178.876 178.876 177.021 1.855 25155 16712 1 20 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.561 1.699 25155 16713 1 20 . 1 1 99 99 ASP CB C 99 40.350 40.350 41.240 -0.891 25155 16714 1 20 . 1 1 100 100 ALA N N 100 119.124 119.124 121.155 -2.031 25155 16715 1 20 . 1 1 100 100 ALA HA H 100 3.822 3.822 4.213 -0.391 25155 16716 1 20 . 1 1 100 100 ALA C C 100 178.490 178.490 179.262 -0.772 25155 16717 1 20 . 1 1 100 100 ALA CA C 100 55.100 55.100 54.573 0.527 25155 16718 1 20 . 1 1 100 100 ALA CB C 100 19.700 19.700 18.246 1.454 25155 16719 1 20 . 1 1 100 100 ALA H H 100 8.400 8.400 7.768 0.632 25155 16720 1 20 . 1 1 101 101 LEU N N 101 118.687 118.687 120.687 -2.000 25155 16721 1 20 . 1 1 101 101 LEU HA H 101 3.674 3.674 4.022 -0.348 25155 16722 1 20 . 1 1 101 101 LEU C C 101 179.050 179.050 178.671 0.379 25155 16723 1 20 . 1 1 101 101 LEU CA C 101 57.800 57.800 57.264 0.536 25155 16724 1 20 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.611 1.039 25155 16725 1 20 . 1 1 101 101 LEU H H 101 6.518 6.518 7.538 -1.020 25155 16726 1 20 . 1 1 102 102 GLY N N 102 104.410 104.410 106.633 -2.223 25155 16727 1 20 . 1 1 102 102 GLY C C 102 176.056 176.056 176.017 0.039 25155 16728 1 20 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.240 0.510 25155 16729 1 20 . 1 1 102 102 GLY H H 102 7.712 7.712 8.050 -0.338 25155 16730 1 20 . 1 1 103 103 MET N N 103 120.550 120.550 121.817 -1.267 25155 16731 1 20 . 1 1 103 103 MET HA H 103 4.256 4.256 4.331 -0.075 25155 16732 1 20 . 1 1 103 103 MET C C 103 179.650 179.650 178.500 1.150 25155 16733 1 20 . 1 1 103 103 MET CA C 103 59.450 59.450 59.595 -0.145 25155 16734 1 20 . 1 1 103 103 MET CB C 103 32.300 32.300 32.794 -0.494 25155 16735 1 20 . 1 1 103 103 MET H H 103 8.485 8.485 8.310 0.175 25155 16736 1 20 . 1 1 104 104 LEU N N 104 123.480 123.480 120.687 2.793 25155 16737 1 20 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.265 -0.204 25155 16738 1 20 . 1 1 104 104 LEU C C 104 177.750 177.750 178.824 -1.074 25155 16739 1 20 . 1 1 104 104 LEU CA C 104 58.100 58.100 57.704 0.396 25155 16740 1 20 . 1 1 104 104 LEU CB C 104 41.450 41.450 41.291 0.159 25155 16741 1 20 . 1 1 104 104 LEU H H 104 8.392 8.392 8.340 0.052 25155 16742 1 20 . 1 1 105 105 HIS N N 105 119.570 119.570 119.881 -0.311 25155 16743 1 20 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.150 -0.298 25155 16744 1 20 . 1 1 105 105 HIS C C 105 177.550 177.550 177.009 0.541 25155 16745 1 20 . 1 1 105 105 HIS CA C 105 61.000 61.000 60.566 0.434 25155 16746 1 20 . 1 1 105 105 HIS CB C 105 28.820 28.820 29.913 -1.093 25155 16747 1 20 . 1 1 105 105 HIS H H 105 8.247 8.247 8.560 -0.313 25155 16748 1 20 . 1 1 106 106 ASP N N 106 119.780 119.780 119.372 0.408 25155 16749 1 20 . 1 1 106 106 ASP HA H 106 4.333 4.333 4.364 -0.031 25155 16750 1 20 . 1 1 106 106 ASP C C 106 179.410 179.410 178.447 0.963 25155 16751 1 20 . 1 1 106 106 ASP CA C 106 57.800 57.800 57.116 0.684 25155 16752 1 20 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.245 -0.645 25155 16753 1 20 . 1 1 107 107 LYS N N 107 121.660 121.660 118.550 3.110 25155 16754 1 20 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.038 0.062 25155 16755 1 20 . 1 1 107 107 LYS C C 107 178.316 178.316 178.376 -0.060 25155 16756 1 20 . 1 1 107 107 LYS CA C 107 58.750 58.750 58.953 -0.203 25155 16757 1 20 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.500 -0.650 25155 16758 1 20 . 1 1 108 108 LEU N N 108 116.050 116.050 117.690 -1.640 25155 16759 1 20 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.411 -0.401 25155 16760 1 20 . 1 1 108 108 LEU C C 108 179.050 179.050 178.906 0.144 25155 16761 1 20 . 1 1 108 108 LEU CA C 108 56.240 56.240 55.938 0.302 25155 16762 1 20 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.444 -0.644 25155 16763 1 20 . 1 1 108 108 LEU H H 108 8.072 8.072 7.640 0.432 25155 16764 1 20 . 1 1 109 109 SER N N 109 116.280 116.280 115.807 0.473 25155 16765 1 20 . 1 1 109 109 SER HA H 109 4.300 4.300 4.344 -0.044 25155 16766 1 20 . 1 1 109 109 SER C C 109 175.848 175.848 175.795 0.053 25155 16767 1 20 . 1 1 109 109 SER CA C 109 62.410 62.410 62.156 0.255 25155 16768 1 20 . 1 1 109 109 SER CB C 109 62.850 62.850 62.989 -0.139 25155 16769 1 20 . 1 1 109 109 SER H H 109 8.366 8.366 8.146 0.220 25155 16770 1 20 . 1 1 110 110 THR N N 110 110.416 110.416 110.206 0.210 25155 16771 1 20 . 1 1 110 110 THR HA H 110 4.614 4.614 4.362 0.252 25155 16772 1 20 . 1 1 110 110 THR C C 110 175.675 175.675 175.368 0.307 25155 16773 1 20 . 1 1 110 110 THR CA C 110 62.030 62.030 63.544 -1.514 25155 16774 1 20 . 1 1 110 110 THR CB C 110 68.810 68.810 68.798 0.012 25155 16775 1 20 . 1 1 110 110 THR H H 110 7.185 7.185 7.932 -0.747 25155 16776 1 20 . 1 1 111 111 LYS N N 111 120.090 120.090 120.921 -0.831 25155 16777 1 20 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.426 0.087 25155 16778 1 20 . 1 1 111 111 LYS C C 111 176.814 176.814 176.656 0.158 25155 16779 1 20 . 1 1 111 111 LYS CA C 111 55.730 55.730 55.705 0.025 25155 16780 1 20 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.464 -1.534 25155 16781 1 20 . 1 1 112 112 GLY N N 112 107.540 107.540 107.854 -0.314 25155 16782 1 20 . 1 1 112 112 GLY C C 112 176.223 176.223 174.225 1.998 25155 16783 1 20 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.320 1.606 25155 16784 1 20 . 1 1 112 112 GLY H H 112 8.315 8.315 7.595 0.720 25155 16785 1 20 . 1 1 113 113 VAL N N 113 113.536 113.536 114.657 -1.121 25155 16786 1 20 . 1 1 113 113 VAL HA H 113 4.494 4.494 4.238 0.256 25155 16787 1 20 . 1 1 113 113 VAL C C 113 174.560 174.560 174.766 -0.206 25155 16788 1 20 . 1 1 113 113 VAL CA C 113 59.550 59.550 60.947 -1.397 25155 16789 1 20 . 1 1 113 113 VAL CB C 113 32.800 32.800 32.221 0.579 25155 16790 1 20 . 1 1 113 113 VAL H H 113 6.835 6.835 7.012 -0.177 25155 16791 1 20 . 1 1 114 114 LYS N N 114 122.920 122.920 121.610 1.310 25155 16792 1 20 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.450 0.044 25155 16793 1 20 . 1 1 114 114 LYS C C 114 174.925 174.925 174.676 0.249 25155 16794 1 20 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.198 0.082 25155 16795 1 20 . 1 1 114 114 LYS CB C 114 33.630 33.630 34.535 -0.904 25155 16796 1 20 . 1 1 115 115 PHE N N 115 123.140 123.140 124.115 -0.975 25155 16797 1 20 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.501 0.199 25155 16798 1 20 . 1 1 115 115 PHE C C 115 177.580 177.580 176.130 1.450 25155 16799 1 20 . 1 1 115 115 PHE CA C 115 58.677 58.677 57.505 1.172 25155 16800 1 20 . 1 1 115 115 PHE CB C 115 41.120 41.120 40.374 0.746 25155 16801 1 20 . 1 1 115 115 PHE H H 115 8.506 8.506 8.622 -0.116 25155 16802 1 20 . 1 1 116 116 VAL N N 116 115.737 115.737 115.128 0.609 25155 16803 1 20 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.435 0.043 25155 16804 1 20 . 1 1 116 116 VAL C C 116 175.300 175.300 175.988 -0.688 25155 16805 1 20 . 1 1 116 116 VAL CA C 116 58.877 58.877 60.028 -1.151 25155 16806 1 20 . 1 1 116 116 VAL CB C 116 34.120 34.120 34.675 -0.555 25155 16807 1 20 . 1 1 116 116 VAL H H 116 8.860 8.860 8.897 -0.037 25155 16808 1 20 . 1 1 117 117 GLY N N 117 108.137 108.137 110.274 -2.137 25155 16809 1 20 . 1 1 117 117 GLY C C 117 176.110 176.110 175.106 1.004 25155 16810 1 20 . 1 1 117 117 GLY CA C 117 47.500 47.500 45.711 1.790 25155 16811 1 20 . 1 1 117 117 GLY H H 117 9.838 9.838 9.546 0.292 25155 16812 1 20 . 1 1 118 118 TYR N N 118 120.380 120.380 119.503 0.877 25155 16813 1 20 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.704 0.266 25155 16814 1 20 . 1 1 118 118 TYR C C 118 177.630 177.630 175.701 1.929 25155 16815 1 20 . 1 1 118 118 TYR CA C 118 55.800 55.800 57.806 -2.006 25155 16816 1 20 . 1 1 118 118 TYR CB C 118 35.970 35.970 38.748 -2.778 25155 16817 1 20 . 1 1 118 118 TYR H H 118 8.652 8.652 7.993 0.659 25155 16818 1 20 . 1 1 119 119 TRP N N 119 126.040 126.040 122.558 3.482 25155 16819 1 20 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.132 0.889 25155 16820 1 20 . 1 1 119 119 TRP C C 119 173.000 173.000 173.494 -0.494 25155 16821 1 20 . 1 1 119 119 TRP CA C 119 53.820 53.820 54.461 -0.641 25155 16822 1 20 . 1 1 119 119 TRP CB C 119 36.050 36.050 33.788 2.262 25155 16823 1 20 . 1 1 119 119 TRP H H 119 8.070 8.070 8.503 -0.433 25155 16824 1 20 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.522 0.262 25155 16825 1 20 . 1 1 120 120 PRO C C 120 176.870 176.870 176.613 0.257 25155 16826 1 20 . 1 1 120 120 PRO CA C 120 63.780 63.780 63.163 0.617 25155 16827 1 20 . 1 1 120 120 PRO CB C 120 31.990 31.990 31.857 0.133 25155 16828 1 20 . 1 1 121 121 THR N N 121 109.310 109.310 115.667 -6.357 25155 16829 1 20 . 1 1 121 121 THR HA H 121 4.073 4.073 3.838 0.235 25155 16830 1 20 . 1 1 121 121 THR C C 121 176.324 176.324 174.762 1.562 25155 16831 1 20 . 1 1 121 121 THR CA C 121 61.250 61.250 63.528 -2.278 25155 16832 1 20 . 1 1 121 121 THR CB C 121 69.730 69.730 68.805 0.925 25155 16833 1 20 . 1 1 121 121 THR H H 121 7.370 7.370 8.593 -1.223 25155 16834 1 20 . 1 1 122 122 GLU N N 122 123.937 123.937 122.297 1.640 25155 16835 1 20 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.122 0.102 25155 16836 1 20 . 1 1 122 122 GLU C C 122 177.737 177.737 177.522 0.215 25155 16837 1 20 . 1 1 122 122 GLU CA C 122 58.200 58.200 57.647 0.553 25155 16838 1 20 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.395 0.405 25155 16839 1 20 . 1 1 123 123 GLY N N 123 114.563 114.563 112.407 2.156 25155 16840 1 20 . 1 1 123 123 GLY C C 123 173.783 173.783 174.510 -0.727 25155 16841 1 20 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.308 0.072 25155 16842 1 20 . 1 1 123 123 GLY H H 123 9.144 9.144 8.797 0.347 25155 16843 1 20 . 1 1 124 124 TYR N N 124 118.800 118.800 120.724 -1.924 25155 16844 1 20 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.748 0.470 25155 16845 1 20 . 1 1 124 124 TYR C C 124 175.673 175.673 176.187 -0.514 25155 16846 1 20 . 1 1 124 124 TYR CA C 124 56.950 56.950 58.085 -1.135 25155 16847 1 20 . 1 1 124 124 TYR CB C 124 41.100 41.100 40.297 0.803 25155 16848 1 20 . 1 1 124 124 TYR H H 124 7.895 7.895 8.021 -0.126 25155 16849 1 20 . 1 1 125 125 GLU N N 125 124.790 124.790 122.428 2.362 25155 16850 1 20 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.503 0.182 25155 16851 1 20 . 1 1 125 125 GLU C C 125 172.877 172.877 175.224 -2.347 25155 16852 1 20 . 1 1 125 125 GLU CA C 125 55.700 55.700 55.323 0.377 25155 16853 1 20 . 1 1 125 125 GLU CB C 125 31.340 31.340 31.578 -0.238 25155 16854 1 20 . 1 1 126 126 PHE N N 126 118.670 118.670 119.789 -1.119 25155 16855 1 20 . 1 1 126 126 PHE HA H 126 4.841 4.841 5.272 -0.431 25155 16856 1 20 . 1 1 126 126 PHE C C 126 173.800 173.800 174.556 -0.756 25155 16857 1 20 . 1 1 126 126 PHE CA C 126 56.950 56.950 57.053 -0.103 25155 16858 1 20 . 1 1 126 126 PHE CB C 126 40.300 40.300 40.464 -0.164 25155 16859 1 20 . 1 1 126 126 PHE H H 126 7.645 7.645 7.963 -0.318 25155 16860 1 20 . 1 1 127 127 THR N N 127 107.038 107.038 117.087 -10.049 25155 16861 1 20 . 1 1 127 127 THR HA H 127 4.370 4.370 4.361 0.009 25155 16862 1 20 . 1 1 127 127 THR C C 127 175.100 175.100 175.470 -0.370 25155 16863 1 20 . 1 1 127 127 THR CA C 127 61.080 61.080 62.753 -1.673 25155 16864 1 20 . 1 1 127 127 THR CB C 127 70.500 70.500 69.570 0.930 25155 16865 1 20 . 1 1 127 127 THR H H 127 7.306 7.306 8.557 -1.251 25155 16866 1 20 . 1 1 128 128 SER N N 128 118.150 118.150 118.278 -0.128 25155 16867 1 20 . 1 1 128 128 SER HA H 128 4.650 4.650 4.655 -0.005 25155 16868 1 20 . 1 1 128 128 SER C C 128 175.760 175.760 173.677 2.083 25155 16869 1 20 . 1 1 128 128 SER CA C 128 55.813 55.813 57.344 -1.531 25155 16870 1 20 . 1 1 128 128 SER CB C 128 65.300 65.300 64.075 1.225 25155 16871 1 20 . 1 1 128 128 SER H H 128 7.354 7.354 7.842 -0.488 25155 16872 1 20 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.566 0.198 25155 16873 1 20 . 1 1 129 129 PRO C C 129 178.860 178.860 178.063 0.797 25155 16874 1 20 . 1 1 129 129 PRO CA C 129 62.728 62.728 63.841 -1.113 25155 16875 1 20 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.447 -0.047 25155 16876 1 20 . 1 1 130 130 LYS N N 130 122.158 122.158 120.235 1.923 25155 16877 1 20 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.103 0.107 25155 16878 1 20 . 1 1 130 130 LYS C C 130 176.890 176.890 175.526 1.364 25155 16879 1 20 . 1 1 130 130 LYS CA C 130 61.375 61.375 60.874 0.501 25155 16880 1 20 . 1 1 130 130 LYS CB C 130 30.350 30.350 31.089 -0.739 25155 16881 1 20 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.386 0.147 25155 16882 1 20 . 1 1 131 131 PRO C C 131 173.810 173.810 175.913 -2.103 25155 16883 1 20 . 1 1 131 131 PRO CA C 131 64.510 64.510 63.632 0.878 25155 16884 1 20 . 1 1 131 131 PRO CB C 131 31.745 31.745 31.511 0.234 25155 16885 1 20 . 1 1 132 132 VAL N N 132 114.480 114.480 112.463 2.017 25155 16886 1 20 . 1 1 132 132 VAL HA H 132 5.158 5.158 4.992 0.166 25155 16887 1 20 . 1 1 132 132 VAL C C 132 175.137 175.137 174.060 1.077 25155 16888 1 20 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.167 0.632 25155 16889 1 20 . 1 1 132 132 VAL CB C 132 34.780 34.780 35.687 -0.907 25155 16890 1 20 . 1 1 132 132 VAL H H 132 6.716 6.716 7.509 -0.793 25155 16891 1 20 . 1 1 133 133 ILE N N 133 120.670 120.670 113.910 6.760 25155 16892 1 20 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.531 -0.139 25155 16893 1 20 . 1 1 133 133 ILE C C 133 175.485 175.485 174.929 0.556 25155 16894 1 20 . 1 1 133 133 ILE CA C 133 60.000 60.000 59.422 0.578 25155 16895 1 20 . 1 1 133 133 ILE CB C 133 42.020 42.020 40.469 1.551 25155 16896 1 20 . 1 1 133 133 ILE H H 133 8.740 8.740 8.377 0.363 25155 16897 1 20 . 1 1 134 134 ALA N N 134 122.454 122.454 123.260 -0.806 25155 16898 1 20 . 1 1 134 134 ALA HA H 134 3.953 3.953 3.976 -0.023 25155 16899 1 20 . 1 1 134 134 ALA C C 134 178.387 178.387 177.808 0.579 25155 16900 1 20 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.468 -0.418 25155 16901 1 20 . 1 1 134 134 ALA CB C 134 16.982 16.982 18.400 -1.418 25155 16902 1 20 . 1 1 134 134 ALA H H 134 8.490 8.490 8.511 -0.021 25155 16903 1 20 . 1 1 135 135 ASP N N 135 117.310 117.310 123.071 -5.761 25155 16904 1 20 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.575 -0.331 25155 16905 1 20 . 1 1 135 135 ASP C C 135 176.390 176.390 176.944 -0.554 25155 16906 1 20 . 1 1 135 135 ASP CA C 135 55.120 55.120 53.174 1.946 25155 16907 1 20 . 1 1 135 135 ASP CB C 135 39.865 39.865 39.702 0.163 25155 16908 1 20 . 1 1 136 136 GLY N N 136 104.336 104.336 109.184 -4.848 25155 16909 1 20 . 1 1 136 136 GLY C C 136 174.940 174.940 175.581 -0.641 25155 16910 1 20 . 1 1 136 136 GLY CA C 136 45.150 45.150 46.083 -0.933 25155 16911 1 20 . 1 1 136 136 GLY H H 136 7.592 7.592 8.233 -0.641 25155 16912 1 20 . 1 1 137 137 GLN N N 137 118.675 118.675 117.961 0.714 25155 16913 1 20 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.366 -0.304 25155 16914 1 20 . 1 1 137 137 GLN C C 137 176.420 176.420 175.363 1.057 25155 16915 1 20 . 1 1 137 137 GLN CA C 137 57.760 57.760 56.531 1.229 25155 16916 1 20 . 1 1 137 137 GLN CB C 137 30.400 30.400 29.869 0.531 25155 16917 1 20 . 1 1 137 137 GLN H H 137 7.843 7.843 7.841 0.002 25155 16918 1 20 . 1 1 138 138 LEU N N 138 118.160 118.160 119.248 -1.088 25155 16919 1 20 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.492 0.469 25155 16920 1 20 . 1 1 138 138 LEU C C 138 175.700 175.700 174.156 1.544 25155 16921 1 20 . 1 1 138 138 LEU CA C 138 53.705 53.705 54.556 -0.851 25155 16922 1 20 . 1 1 138 138 LEU CB C 138 46.480 46.480 46.083 0.397 25155 16923 1 20 . 1 1 138 138 LEU H H 138 7.356 7.356 7.206 0.150 25155 16924 1 20 . 1 1 139 139 PHE N N 139 119.060 119.060 122.300 -3.240 25155 16925 1 20 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.759 0.585 25155 16926 1 20 . 1 1 139 139 PHE C C 139 178.850 178.850 177.467 1.383 25155 16927 1 20 . 1 1 139 139 PHE CA C 139 56.670 56.670 57.556 -0.886 25155 16928 1 20 . 1 1 139 139 PHE CB C 139 43.652 43.652 39.644 4.008 25155 16929 1 20 . 1 1 139 139 PHE H H 139 10.026 10.026 9.139 0.887 25155 16930 1 20 . 1 1 140 140 VAL N N 140 109.905 109.905 118.860 -8.955 25155 16931 1 20 . 1 1 140 140 VAL HA H 140 3.500 3.500 3.066 0.434 25155 16932 1 20 . 1 1 140 140 VAL C C 140 172.860 172.860 175.040 -2.180 25155 16933 1 20 . 1 1 140 140 VAL CA C 140 61.812 61.812 62.041 -0.229 25155 16934 1 20 . 1 1 140 140 VAL CB C 140 30.250 30.250 30.275 -0.025 25155 16935 1 20 . 1 1 140 140 VAL H H 140 7.550 7.550 8.475 -0.925 25155 16936 1 20 . 1 1 141 141 GLY N N 141 106.600 106.600 106.314 0.286 25155 16937 1 20 . 1 1 141 141 GLY C C 141 171.350 171.350 172.738 -1.388 25155 16938 1 20 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.167 1.293 25155 16939 1 20 . 1 1 141 141 GLY H H 141 7.052 7.052 7.302 -0.250 25155 16940 1 20 . 1 1 142 142 LEU N N 142 117.820 117.820 119.992 -2.172 25155 16941 1 20 . 1 1 142 142 LEU HA H 142 4.962 4.962 3.873 1.089 25155 16942 1 20 . 1 1 142 142 LEU CA C 142 55.600 55.600 54.410 1.190 25155 16943 1 20 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.099 -4.169 25155 16944 1 20 . 1 1 142 142 LEU H H 142 7.643 7.643 8.318 -0.675 25155 16945 1 20 . 1 1 143 143 ALA HA H 143 4.220 4.220 3.835 0.385 25155 16946 1 20 . 1 1 143 143 ALA C C 143 175.505 175.505 175.941 -0.436 25155 16947 1 20 . 1 1 143 143 ALA CA C 143 49.600 49.600 50.735 -1.135 25155 16948 1 20 . 1 1 143 143 ALA CB C 143 23.330 23.330 18.574 4.756 25155 16949 1 20 . 1 1 144 144 LEU N N 144 124.960 124.960 122.651 2.309 25155 16950 1 20 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.518 0.262 25155 16951 1 20 . 1 1 144 144 LEU C C 144 174.700 174.700 174.880 -0.180 25155 16952 1 20 . 1 1 144 144 LEU CA C 144 52.790 52.790 53.563 -0.773 25155 16953 1 20 . 1 1 144 144 LEU CB C 144 45.300 45.300 45.332 -0.032 25155 16954 1 20 . 1 1 144 144 LEU H H 144 8.583 8.583 7.484 1.099 25155 16955 1 20 . 1 1 145 145 ASP N N 145 119.100 119.100 121.164 -2.064 25155 16956 1 20 . 1 1 145 145 ASP HA H 145 5.422 5.422 5.300 0.122 25155 16957 1 20 . 1 1 145 145 ASP C C 145 176.180 176.180 175.913 0.267 25155 16958 1 20 . 1 1 145 145 ASP CA C 145 53.600 53.600 52.956 0.643 25155 16959 1 20 . 1 1 145 145 ASP CB C 145 43.180 43.180 43.987 -0.807 25155 16960 1 20 . 1 1 147 147 THR HA H 147 4.093 4.093 4.447 -0.354 25155 16961 1 20 . 1 1 147 147 THR C C 147 175.858 175.858 175.107 0.751 25155 16962 1 20 . 1 1 147 147 THR CA C 147 66.400 66.400 63.469 2.931 25155 16963 1 20 . 1 1 147 147 THR CB C 147 69.400 69.400 70.609 -1.209 25155 16964 1 20 . 1 1 147 147 THR H H 147 8.745 8.745 8.427 0.318 25155 16965 1 20 . 1 1 148 148 ASN N N 148 115.408 115.408 119.349 -3.941 25155 16966 1 20 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.616 0.394 25155 16967 1 20 . 1 1 148 148 ASN C C 148 175.750 175.750 174.887 0.863 25155 16968 1 20 . 1 1 148 148 ASN CA C 148 53.400 53.400 55.104 -1.704 25155 16969 1 20 . 1 1 148 148 ASN CB C 148 41.900 41.900 39.301 2.599 25155 16970 1 20 . 1 1 148 148 ASN H H 148 8.975 8.975 8.899 0.076 25155 16971 1 20 . 1 1 149 149 GLN N N 149 117.900 117.900 116.134 1.766 25155 16972 1 20 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.534 0.402 25155 16973 1 20 . 1 1 149 149 GLN C C 149 178.280 178.280 174.916 3.364 25155 16974 1 20 . 1 1 149 149 GLN CA C 149 53.730 53.730 55.044 -1.314 25155 16975 1 20 . 1 1 149 149 GLN CB C 149 29.790 29.790 32.353 -2.563 25155 16976 1 20 . 1 1 149 149 GLN H H 149 7.430 7.430 7.636 -0.206 25155 16977 1 20 . 1 1 150 150 TYR N N 150 121.060 121.060 121.736 -0.676 25155 16978 1 20 . 1 1 150 150 TYR HA H 150 4.671 4.671 4.463 0.208 25155 16979 1 20 . 1 1 150 150 TYR C C 150 178.680 178.680 175.726 2.954 25155 16980 1 20 . 1 1 150 150 TYR CA C 150 57.930 57.930 59.797 -1.867 25155 16981 1 20 . 1 1 150 150 TYR CB C 150 38.860 38.860 39.846 -0.986 25155 16982 1 20 . 1 1 150 150 TYR H H 150 8.115 8.115 8.644 -0.529 25155 16983 1 20 . 1 1 151 151 ASP N N 151 121.175 121.175 120.823 0.352 25155 16984 1 20 . 1 1 151 151 ASP CA C 151 57.000 57.000 56.711 0.289 25155 16985 1 20 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.648 1.352 25155 16986 1 20 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.654 -0.064 25155 16987 1 20 . 1 1 152 152 LEU C C 152 178.300 178.300 177.320 0.980 25155 16988 1 20 . 1 1 152 152 LEU CA C 152 54.788 54.788 55.374 -0.586 25155 16989 1 20 . 1 1 152 152 LEU CB C 152 42.200 42.200 41.953 0.247 25155 16990 1 20 . 1 1 153 153 SER N N 153 116.170 116.170 118.242 -2.072 25155 16991 1 20 . 1 1 153 153 SER HA H 153 3.911 3.911 4.011 -0.100 25155 16992 1 20 . 1 1 153 153 SER CA C 153 63.400 63.400 61.865 1.535 25155 16993 1 20 . 1 1 153 153 SER CB C 153 63.200 63.200 62.838 0.362 25155 16994 1 20 . 1 1 153 153 SER H H 153 7.378 7.378 7.572 -0.194 25155 16995 1 20 . 1 1 154 154 ASP N N 154 121.640 121.640 120.871 0.769 25155 16996 1 20 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.258 -0.018 25155 16997 1 20 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.578 1.722 25155 16998 1 20 . 1 1 154 154 ASP CB C 154 40.000 40.000 40.806 -0.806 25155 16999 1 20 . 1 1 155 155 GLU HA H 155 4.170 4.170 3.955 0.215 25155 17000 1 20 . 1 1 155 155 GLU C C 155 179.420 179.420 178.900 0.520 25155 17001 1 20 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.284 -0.084 25155 17002 1 20 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.602 -0.121 25155 17003 1 20 . 1 1 156 156 ARG N N 156 121.230 121.230 118.286 2.944 25155 17004 1 20 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.290 -0.014 25155 17005 1 20 . 1 1 156 156 ARG C C 156 177.350 177.350 179.416 -2.066 25155 17006 1 20 . 1 1 156 156 ARG CA C 156 59.950 59.950 58.129 1.821 25155 17007 1 20 . 1 1 156 156 ARG CB C 156 31.100 31.100 29.500 1.601 25155 17008 1 20 . 1 1 157 157 ILE N N 157 118.190 118.190 120.607 -2.417 25155 17009 1 20 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.699 -0.269 25155 17010 1 20 . 1 1 157 157 ILE C C 157 178.480 178.480 178.304 0.176 25155 17011 1 20 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.457 1.103 25155 17012 1 20 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.685 0.795 25155 17013 1 20 . 1 1 157 157 ILE H H 157 8.705 8.705 7.981 0.724 25155 17014 1 20 . 1 1 158 158 GLN N N 158 119.975 119.975 120.871 -0.896 25155 17015 1 20 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.903 0.053 25155 17016 1 20 . 1 1 158 158 GLN C C 158 178.730 178.730 178.322 0.408 25155 17017 1 20 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.582 1.118 25155 17018 1 20 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.354 0.129 25155 17019 1 20 . 1 1 158 158 GLN H H 158 8.262 8.262 8.541 -0.279 25155 17020 1 20 . 1 1 159 159 SER N N 159 115.466 115.466 114.735 0.731 25155 17021 1 20 . 1 1 159 159 SER HA H 159 4.446 4.446 4.247 0.199 25155 17022 1 20 . 1 1 159 159 SER C C 159 177.320 177.320 176.882 0.438 25155 17023 1 20 . 1 1 159 159 SER CA C 159 63.500 63.500 60.978 2.522 25155 17024 1 20 . 1 1 159 159 SER CB C 159 63.818 63.818 63.024 0.794 25155 17025 1 20 . 1 1 159 159 SER H H 159 8.440 8.440 8.009 0.431 25155 17026 1 20 . 1 1 160 160 TRP N N 160 126.784 126.784 124.903 1.881 25155 17027 1 20 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.418 0.036 25155 17028 1 20 . 1 1 160 160 TRP C C 160 177.934 177.934 177.624 0.310 25155 17029 1 20 . 1 1 160 160 TRP CA C 160 62.745 62.745 61.999 0.746 25155 17030 1 20 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.311 0.039 25155 17031 1 20 . 1 1 160 160 TRP H H 160 9.243 9.243 7.718 1.525 25155 17032 1 20 . 1 1 161 161 CYS N N 161 116.395 116.395 118.597 -2.202 25155 17033 1 20 . 1 1 161 161 CYS HA H 161 3.886 3.886 3.712 0.174 25155 17034 1 20 . 1 1 161 161 CYS C C 161 176.245 176.245 177.018 -0.773 25155 17035 1 20 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.626 0.673 25155 17036 1 20 . 1 1 161 161 CYS CB C 161 27.723 27.723 26.975 0.748 25155 17037 1 20 . 1 1 161 161 CYS H H 161 8.845 8.845 9.038 -0.193 25155 17038 1 20 . 1 1 162 162 GLU N N 162 118.030 118.030 119.549 -1.519 25155 17039 1 20 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.869 0.051 25155 17040 1 20 . 1 1 162 162 GLU C C 162 178.700 178.700 178.726 -0.026 25155 17041 1 20 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.519 0.281 25155 17042 1 20 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.232 0.268 25155 17043 1 20 . 1 1 163 163 GLN N N 163 120.650 120.650 119.634 1.016 25155 17044 1 20 . 1 1 163 163 GLN HA H 163 4.173 4.173 4.050 0.123 25155 17045 1 20 . 1 1 163 163 GLN C C 163 179.700 179.700 178.500 1.200 25155 17046 1 20 . 1 1 163 163 GLN CA C 163 59.688 59.688 58.967 0.722 25155 17047 1 20 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.817 0.083 25155 17048 1 20 . 1 1 163 163 GLN H H 163 8.148 8.148 7.739 0.409 25155 17049 1 20 . 1 1 164 164 ILE N N 164 114.836 114.836 117.066 -2.230 25155 17050 1 20 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.615 0.445 25155 17051 1 20 . 1 1 164 164 ILE C C 164 178.676 178.676 177.629 1.047 25155 17052 1 20 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.463 1.697 25155 17053 1 20 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.295 0.335 25155 17054 1 20 . 1 1 164 164 ILE H H 164 8.958 8.958 8.145 0.813 25155 17055 1 20 . 1 1 165 165 LEU N N 165 123.700 123.700 119.783 3.917 25155 17056 1 20 . 1 1 165 165 LEU HA H 165 4.100 4.100 4.019 0.081 25155 17057 1 20 . 1 1 165 165 LEU C C 165 180.548 180.548 178.420 2.128 25155 17058 1 20 . 1 1 165 165 LEU CA C 165 58.150 58.150 58.347 -0.197 25155 17059 1 20 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.406 -0.276 25155 17060 1 20 . 1 1 165 165 LEU H H 165 7.830 7.830 7.790 0.040 25155 17061 1 20 . 1 1 166 166 ASN N N 166 120.160 120.160 118.510 1.650 25155 17062 1 20 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.341 0.229 25155 17063 1 20 . 1 1 166 166 ASN C C 166 175.690 175.690 177.358 -1.668 25155 17064 1 20 . 1 1 166 166 ASN CA C 166 55.946 55.946 57.017 -1.071 25155 17065 1 20 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.311 0.169 25155 17066 1 20 . 1 1 166 166 ASN H H 166 7.706 7.706 7.791 -0.085 25155 17067 1 20 . 1 1 167 167 GLU N N 167 121.286 121.286 120.577 0.709 25155 17068 1 20 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.358 -0.254 25155 17069 1 20 . 1 1 167 167 GLU C C 167 180.520 180.520 178.405 2.115 25155 17070 1 20 . 1 1 167 167 GLU CA C 167 59.920 59.920 58.892 1.028 25155 17071 1 20 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.727 1.198 25155 17072 1 20 . 1 1 168 168 MET N N 168 118.622 118.622 116.303 2.319 25155 17073 1 20 . 1 1 168 168 MET HA H 168 3.996 3.996 4.962 -0.966 25155 17074 1 20 . 1 1 168 168 MET C C 168 176.856 176.856 178.422 -1.566 25155 17075 1 20 . 1 1 168 168 MET CA C 168 59.500 59.500 58.484 1.016 25155 17076 1 20 . 1 1 168 168 MET CB C 168 33.700 33.700 33.361 0.339 25155 17077 1 20 . 1 1 168 168 MET H H 168 8.723 8.723 8.384 0.339 25155 17078 1 20 . 1 1 169 169 ALA N N 169 121.760 121.760 123.600 -1.840 25155 17079 1 20 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.354 -0.198 25155 17080 1 20 . 1 1 169 169 ALA C C 169 179.790 179.790 178.808 0.982 25155 17081 1 20 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.288 0.512 25155 17082 1 20 . 1 1 169 169 ALA CB C 169 18.220 18.220 18.976 -0.756 25155 17083 1 20 . 1 1 169 169 ALA H H 169 7.494 7.494 7.897 -0.403 25155 17084 1 20 . 1 1 170 170 GLU N N 170 116.970 116.970 117.981 -1.011 25155 17085 1 20 . 1 1 170 170 GLU HA H 170 4.091 4.091 3.893 0.198 25155 17086 1 20 . 1 1 170 170 GLU C C 170 177.745 177.745 177.765 -0.020 25155 17087 1 20 . 1 1 170 170 GLU CA C 170 58.000 58.000 58.662 -0.662 25155 17088 1 20 . 1 1 170 170 GLU CB C 170 29.730 29.730 29.015 0.715 25155 17089 1 20 . 1 1 171 171 HIS N N 171 118.150 118.150 115.593 2.557 25155 17090 1 20 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.409 0.061 25155 17091 1 20 . 1 1 171 171 HIS C C 171 175.848 175.848 175.348 0.500 25155 17092 1 20 . 1 1 171 171 HIS CA C 171 57.600 57.600 57.275 0.325 25155 17093 1 20 . 1 1 171 171 HIS CB C 171 30.800 30.800 30.376 0.424 25155 17094 1 20 . 1 1 171 171 HIS H H 171 7.717 7.717 7.387 0.330 25155 17095 1 20 . 1 1 172 172 TYR N N 172 119.483 119.483 116.938 2.545 25155 17096 1 20 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.582 0.009 25155 17097 1 20 . 1 1 172 172 TYR C C 172 174.590 174.590 176.039 -1.449 25155 17098 1 20 . 1 1 172 172 TYR CA C 172 57.813 57.813 57.958 -0.145 25155 17099 1 20 . 1 1 172 172 TYR CB C 172 38.900 38.900 39.961 -1.061 25155 17100 1 20 . 1 1 172 172 TYR H H 172 7.778 7.778 7.995 -0.217 25155 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 145 3.000 -0.298 2.995 25155 2 1 1 "Average Difference" HA 173 0.434 -0.086 0.426 25155 3 1 1 "Average Difference" C 153 1.243 -0.066 1.245 25155 4 1 1 "Average Difference" CA 160 1.283 0.085 1.284 25155 5 1 1 "Average Difference" CB 143 1.223 -0.264 1.199 25155 6 1 1 "Average Difference" HN 113 0.597 0.026 0.599 25155 7 1 2 "Average Difference" N 145 2.633 -0.224 2.632 25155 8 1 2 "Average Difference" HA 173 0.460 -0.076 0.455 25155 9 1 2 "Average Difference" C 153 1.201 -0.145 1.196 25155 10 1 2 "Average Difference" CA 160 1.207 0.018 1.211 25155 11 1 2 "Average Difference" CB 143 1.304 -0.213 1.291 25155 12 1 2 "Average Difference" HN 113 0.643 -0.006 0.646 25155 13 1 3 "Average Difference" N 145 2.616 -0.305 2.607 25155 14 1 3 "Average Difference" HA 173 0.429 -0.065 0.426 25155 15 1 3 "Average Difference" C 153 1.174 -0.078 1.175 25155 16 1 3 "Average Difference" CA 160 1.086 -0.020 1.089 25155 17 1 3 "Average Difference" CB 143 1.135 -0.221 1.118 25155 18 1 3 "Average Difference" HN 113 0.624 -0.017 0.627 25155 19 1 4 "Average Difference" N 145 2.616 -0.317 2.606 25155 20 1 4 "Average Difference" HA 173 0.447 -0.060 0.444 25155 21 1 4 "Average Difference" C 153 1.249 -0.114 1.248 25155 22 1 4 "Average Difference" CA 160 1.123 -0.010 1.127 25155 23 1 4 "Average Difference" CB 143 1.312 -0.210 1.300 25155 24 1 4 "Average Difference" HN 113 0.653 -0.005 0.656 25155 25 1 5 "Average Difference" N 145 2.752 -0.072 2.760 25155 26 1 5 "Average Difference" HA 173 0.508 -0.068 0.505 25155 27 1 5 "Average Difference" C 153 1.275 -0.076 1.277 25155 28 1 5 "Average Difference" CA 160 1.244 -0.010 1.248 25155 29 1 5 "Average Difference" CB 143 1.333 -0.186 1.325 25155 30 1 5 "Average Difference" HN 113 0.616 0.001 0.619 25155 31 1 6 "Average Difference" N 145 2.786 -0.267 2.783 25155 32 1 6 "Average Difference" HA 173 0.441 -0.061 0.438 25155 33 1 6 "Average Difference" C 153 1.195 -0.113 1.194 25155 34 1 6 "Average Difference" CA 160 1.203 -0.024 1.207 25155 35 1 6 "Average Difference" CB 143 1.278 -0.226 1.262 25155 36 1 6 "Average Difference" HN 113 0.612 0.006 0.615 25155 37 1 7 "Average Difference" N 145 2.857 -0.350 2.845 25155 38 1 7 "Average Difference" HA 173 0.492 -0.061 0.489 25155 39 1 7 "Average Difference" C 153 1.218 -0.001 1.222 25155 40 1 7 "Average Difference" CA 160 1.255 0.116 1.254 25155 41 1 7 "Average Difference" CB 143 1.202 -0.209 1.188 25155 42 1 7 "Average Difference" HN 113 0.659 -0.015 0.661 25155 43 1 8 "Average Difference" N 145 2.744 -0.111 2.752 25155 44 1 8 "Average Difference" HA 173 0.437 -0.068 0.433 25155 45 1 8 "Average Difference" C 153 1.199 -0.099 1.199 25155 46 1 8 "Average Difference" CA 160 1.180 0.027 1.184 25155 47 1 8 "Average Difference" CB 143 1.207 -0.162 1.200 25155 48 1 8 "Average Difference" HN 113 0.635 -0.021 0.637 25155 49 1 9 "Average Difference" N 145 3.041 -0.430 3.021 25155 50 1 9 "Average Difference" HA 173 0.510 -0.080 0.505 25155 51 1 9 "Average Difference" C 153 1.249 -0.048 1.252 25155 52 1 9 "Average Difference" CA 160 1.194 0.042 1.197 25155 53 1 9 "Average Difference" CB 143 1.304 -0.259 1.282 25155 54 1 9 "Average Difference" HN 113 0.616 -0.029 0.618 25155 55 1 10 "Average Difference" N 145 3.080 -0.437 3.060 25155 56 1 10 "Average Difference" HA 173 0.463 -0.067 0.460 25155 57 1 10 "Average Difference" C 153 1.270 -0.143 1.266 25155 58 1 10 "Average Difference" CA 160 1.230 -0.028 1.234 25155 59 1 10 "Average Difference" CB 143 1.291 -0.298 1.260 25155 60 1 10 "Average Difference" HN 113 0.674 -0.040 0.676 25155 61 1 11 "Average Difference" N 145 2.628 -0.347 2.613 25155 62 1 11 "Average Difference" HA 173 0.416 -0.070 0.412 25155 63 1 11 "Average Difference" C 153 1.251 -0.097 1.251 25155 64 1 11 "Average Difference" CA 160 1.148 0.006 1.152 25155 65 1 11 "Average Difference" CB 143 1.263 -0.197 1.252 25155 66 1 11 "Average Difference" HN 113 0.591 -0.005 0.593 25155 67 1 12 "Average Difference" N 145 2.564 -0.183 2.567 25155 68 1 12 "Average Difference" HA 173 0.415 -0.062 0.411 25155 69 1 12 "Average Difference" C 153 1.192 -0.102 1.191 25155 70 1 12 "Average Difference" CA 160 1.102 -0.030 1.105 25155 71 1 12 "Average Difference" CB 143 1.183 -0.129 1.180 25155 72 1 12 "Average Difference" HN 113 0.643 -0.012 0.646 25155 73 1 13 "Average Difference" N 145 2.542 -0.386 2.521 25155 74 1 13 "Average Difference" HA 173 0.437 -0.075 0.432 25155 75 1 13 "Average Difference" C 153 1.271 -0.049 1.274 25155 76 1 13 "Average Difference" CA 160 1.229 0.022 1.233 25155 77 1 13 "Average Difference" CB 143 1.317 -0.251 1.297 25155 78 1 13 "Average Difference" HN 113 0.654 -0.042 0.655 25155 79 1 14 "Average Difference" N 145 2.799 -0.205 2.801 25155 80 1 14 "Average Difference" HA 173 0.452 -0.057 0.450 25155 81 1 14 "Average Difference" C 153 1.304 -0.113 1.303 25155 82 1 14 "Average Difference" CA 160 1.244 0.050 1.247 25155 83 1 14 "Average Difference" CB 143 1.344 -0.174 1.337 25155 84 1 14 "Average Difference" HN 113 0.657 0.037 0.659 25155 85 1 15 "Average Difference" N 145 2.745 -0.012 2.755 25155 86 1 15 "Average Difference" HA 173 0.415 -0.089 0.407 25155 87 1 15 "Average Difference" C 153 1.181 -0.062 1.183 25155 88 1 15 "Average Difference" CA 160 1.122 -0.022 1.125 25155 89 1 15 "Average Difference" CB 143 1.277 -0.260 1.255 25155 90 1 15 "Average Difference" HN 113 0.630 0.013 0.632 25155 91 1 16 "Average Difference" N 145 2.870 -0.090 2.879 25155 92 1 16 "Average Difference" HA 173 0.430 -0.061 0.427 25155 93 1 16 "Average Difference" C 153 1.215 -0.120 1.213 25155 94 1 16 "Average Difference" CA 160 1.113 -0.035 1.116 25155 95 1 16 "Average Difference" CB 143 1.222 -0.233 1.204 25155 96 1 16 "Average Difference" HN 113 0.627 0.014 0.629 25155 97 1 17 "Average Difference" N 145 2.673 -0.266 2.669 25155 98 1 17 "Average Difference" HA 173 0.439 -0.047 0.438 25155 99 1 17 "Average Difference" C 153 1.213 -0.174 1.204 25155 100 1 17 "Average Difference" CA 160 1.161 -0.063 1.163 25155 101 1 17 "Average Difference" CB 143 1.234 -0.092 1.235 25155 102 1 17 "Average Difference" HN 113 0.598 0.024 0.600 25155 103 1 18 "Average Difference" N 145 2.640 -0.346 2.626 25155 104 1 18 "Average Difference" HA 173 0.456 -0.053 0.455 25155 105 1 18 "Average Difference" C 153 1.163 -0.071 1.165 25155 106 1 18 "Average Difference" CA 160 1.138 -0.031 1.141 25155 107 1 18 "Average Difference" CB 143 1.268 -0.320 1.231 25155 108 1 18 "Average Difference" HN 113 0.653 -0.037 0.655 25155 109 1 19 "Average Difference" N 145 2.825 -0.272 2.821 25155 110 1 19 "Average Difference" HA 173 0.432 -0.064 0.429 25155 111 1 19 "Average Difference" C 153 1.274 -0.030 1.278 25155 112 1 19 "Average Difference" CA 160 1.309 0.074 1.311 25155 113 1 19 "Average Difference" CB 143 1.299 -0.240 1.282 25155 114 1 19 "Average Difference" HN 113 0.589 -0.016 0.591 25155 115 1 20 "Average Difference" N 145 2.761 -0.201 2.764 25155 116 1 20 "Average Difference" HA 173 0.449 -0.053 0.447 25155 117 1 20 "Average Difference" C 153 1.198 -0.067 1.200 25155 118 1 20 "Average Difference" CA 160 1.112 0.042 1.115 25155 119 1 20 "Average Difference" CB 143 1.190 -0.159 1.184 25155 120 1 20 "Average Difference" HN 113 0.659 0.008 0.662 25155 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 25155 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 ASN N N 2 122.966 122.966 119.938 3.028 25155 2 1 . 1 1 2 2 ASN HA H 2 5.175 5.175 5.187 -0.012 25155 3 1 . 1 1 2 2 ASN C C 2 175.200 175.200 173.747 1.453 25155 4 1 . 1 1 2 2 ASN CA C 2 52.920 52.920 52.564 0.356 25155 5 1 . 1 1 2 2 ASN CB C 2 40.000 40.000 41.568 -1.568 25155 6 1 . 1 1 2 2 ASN H H 2 9.392 9.392 8.393 0.999 25155 7 1 . 1 1 3 3 MET N N 3 120.660 120.660 119.360 1.300 25155 8 1 . 1 1 3 3 MET HA H 3 5.565 5.565 5.127 0.438 25155 9 1 . 1 1 3 3 MET C C 3 174.200 174.200 175.457 -1.257 25155 10 1 . 1 1 3 3 MET CA C 3 54.550 54.550 54.350 0.200 25155 11 1 . 1 1 3 3 MET CB C 3 34.100 34.100 35.552 -1.452 25155 12 1 . 1 1 3 3 MET H H 3 8.745 8.745 8.927 -0.182 25155 13 1 . 1 1 4 4 GLY N N 4 115.792 115.792 109.900 5.892 25155 14 1 . 1 1 4 4 GLY C C 4 170.444 170.444 171.920 -1.476 25155 15 1 . 1 1 4 4 GLY CA C 4 42.887 42.887 43.273 -0.386 25155 16 1 . 1 1 4 4 GLY H H 4 8.989 8.989 8.952 0.037 25155 17 1 . 1 1 5 5 LEU N N 5 131.175 131.175 125.643 5.532 25155 18 1 . 1 1 5 5 LEU HA H 5 6.322 6.322 5.295 1.027 25155 19 1 . 1 1 5 5 LEU C C 5 175.700 175.700 174.650 1.050 25155 20 1 . 1 1 5 5 LEU CA C 5 53.320 53.320 53.551 -0.231 25155 21 1 . 1 1 5 5 LEU CB C 5 44.700 44.700 43.775 0.925 25155 22 1 . 1 1 5 5 LEU H H 5 8.917 8.917 8.243 0.674 25155 23 1 . 1 1 6 6 PHE N N 6 125.990 125.990 125.160 0.830 25155 24 1 . 1 1 6 6 PHE HA H 6 5.738 5.738 5.636 0.102 25155 25 1 . 1 1 6 6 PHE C C 6 174.358 174.358 173.418 0.940 25155 26 1 . 1 1 6 6 PHE CA C 6 55.480 55.480 54.929 0.551 25155 27 1 . 1 1 6 6 PHE CB C 6 41.050 41.050 41.580 -0.530 25155 28 1 . 1 1 6 6 PHE H H 6 9.225 9.225 9.225 0.000 25155 29 1 . 1 1 7 7 TYR N N 7 118.040 118.040 117.356 0.684 25155 30 1 . 1 1 7 7 TYR HA H 7 5.929 5.929 5.571 0.358 25155 31 1 . 1 1 7 7 TYR C C 7 171.690 171.690 174.239 -2.549 25155 32 1 . 1 1 7 7 TYR CA C 7 55.460 55.460 56.449 -0.989 25155 33 1 . 1 1 7 7 TYR CB C 7 40.800 40.800 40.785 0.015 25155 34 1 . 1 1 7 7 TYR H H 7 8.235 8.235 8.052 0.183 25155 35 1 . 1 1 8 8 GLY N N 8 106.640 106.640 107.227 -0.587 25155 36 1 . 1 1 8 8 GLY C C 8 171.682 171.682 173.376 -1.694 25155 37 1 . 1 1 8 8 GLY CA C 8 44.050 44.050 44.767 -0.717 25155 38 1 . 1 1 8 8 GLY H H 8 6.996 6.996 8.761 -1.765 25155 39 1 . 1 1 9 9 SER N N 9 118.164 118.164 117.317 0.847 25155 40 1 . 1 1 9 9 SER C C 9 174.560 174.560 174.489 0.071 25155 41 1 . 1 1 9 9 SER CA C 9 57.140 57.140 58.436 -1.296 25155 42 1 . 1 1 9 9 SER H H 9 9.680 9.680 8.551 1.129 25155 43 1 . 1 1 17 17 ALA HA H 17 3.630 3.630 3.864 -0.234 25155 44 1 . 1 1 17 17 ALA C C 17 177.740 177.740 178.928 -1.188 25155 45 1 . 1 1 17 17 ALA CA C 17 54.900 54.900 55.075 -0.175 25155 46 1 . 1 1 17 17 ALA CB C 17 17.790 17.790 17.917 -0.127 25155 47 1 . 1 1 17 17 ALA H H 17 8.055 8.055 7.745 0.310 25155 48 1 . 1 1 18 18 ALA N N 18 120.026 120.026 120.991 -0.965 25155 49 1 . 1 1 18 18 ALA HA H 18 3.713 3.713 3.904 -0.191 25155 50 1 . 1 1 18 18 ALA C C 18 179.040 179.040 179.530 -0.490 25155 51 1 . 1 1 18 18 ALA CA C 18 54.860 54.860 55.112 -0.252 25155 52 1 . 1 1 18 18 ALA CB C 18 18.200 18.200 17.967 0.233 25155 53 1 . 1 1 18 18 ALA H H 18 7.015 7.015 7.945 -0.930 25155 54 1 . 1 1 19 19 GLU N N 19 116.656 116.656 118.314 -1.658 25155 55 1 . 1 1 19 19 GLU HA H 19 3.580 3.580 3.982 -0.402 25155 56 1 . 1 1 19 19 GLU C C 19 178.487 178.487 179.241 -0.754 25155 57 1 . 1 1 19 19 GLU CA C 19 59.670 59.670 59.534 0.137 25155 58 1 . 1 1 19 19 GLU CB C 19 29.400 29.400 29.292 0.108 25155 59 1 . 1 1 20 20 LYS N N 20 120.100 120.100 120.032 0.068 25155 60 1 . 1 1 20 20 LYS HA H 20 4.346 4.346 4.057 0.289 25155 61 1 . 1 1 20 20 LYS C C 20 175.330 175.330 179.121 -3.791 25155 62 1 . 1 1 20 20 LYS CA C 20 57.100 57.100 59.331 -2.231 25155 63 1 . 1 1 20 20 LYS CB C 20 33.000 33.000 32.458 0.542 25155 64 1 . 1 1 21 21 ILE HA H 21 3.465 3.465 3.695 -0.230 25155 65 1 . 1 1 21 21 ILE C C 21 177.680 177.680 178.012 -0.332 25155 66 1 . 1 1 21 21 ILE CA C 21 65.640 65.640 65.601 0.039 25155 67 1 . 1 1 21 21 ILE CB C 21 38.030 38.030 37.941 0.089 25155 68 1 . 1 1 21 21 ILE H H 21 8.220 8.220 8.568 -0.348 25155 69 1 . 1 1 22 22 ARG N N 22 119.433 119.433 118.948 0.485 25155 70 1 . 1 1 22 22 ARG HA H 22 3.550 3.550 3.975 -0.425 25155 71 1 . 1 1 22 22 ARG C C 22 177.268 177.268 178.271 -1.003 25155 72 1 . 1 1 22 22 ARG CA C 22 59.760 59.760 59.242 0.518 25155 73 1 . 1 1 22 22 ARG CB C 22 28.900 28.900 29.470 -0.570 25155 74 1 . 1 1 23 23 ASP N N 23 118.945 118.945 119.820 -0.875 25155 75 1 . 1 1 23 23 ASP HA H 23 4.342 4.342 4.440 -0.098 25155 76 1 . 1 1 23 23 ASP C C 23 178.470 178.470 178.704 -0.234 25155 77 1 . 1 1 23 23 ASP CA C 23 57.450 57.450 57.195 0.256 25155 78 1 . 1 1 23 23 ASP CB C 23 40.370 40.370 40.894 -0.524 25155 79 1 . 1 1 24 24 ILE N N 24 121.200 121.200 119.308 1.892 25155 80 1 . 1 1 24 24 ILE HA H 24 3.734 3.734 3.815 -0.081 25155 81 1 . 1 1 24 24 ILE C C 24 178.297 178.297 177.903 0.394 25155 82 1 . 1 1 24 24 ILE CA C 24 64.500 64.500 64.537 -0.037 25155 83 1 . 1 1 24 24 ILE CB C 24 38.740 38.740 38.503 0.237 25155 84 1 . 1 1 24 24 ILE H H 24 8.160 8.160 7.987 0.173 25155 85 1 . 1 1 25 25 ILE N N 25 121.166 121.166 117.713 3.453 25155 86 1 . 1 1 25 25 ILE HA H 25 3.643 3.643 3.863 -0.220 25155 87 1 . 1 1 25 25 ILE C C 25 176.825 176.825 176.715 0.110 25155 88 1 . 1 1 25 25 ILE CA C 25 65.890 65.890 63.230 2.660 25155 89 1 . 1 1 25 25 ILE CB C 25 37.750 37.750 38.810 -1.060 25155 90 1 . 1 1 25 25 ILE H H 25 8.480 8.480 8.029 0.451 25155 91 1 . 1 1 26 26 GLY N N 26 109.050 109.050 104.928 4.122 25155 92 1 . 1 1 26 26 GLY C C 26 173.800 173.800 172.516 1.284 25155 93 1 . 1 1 26 26 GLY CA C 26 44.400 44.400 44.500 -0.100 25155 94 1 . 1 1 26 26 GLY H H 26 7.945 7.945 7.750 0.195 25155 95 1 . 1 1 27 27 PRO HA H 27 4.363 4.363 4.440 -0.077 25155 96 1 . 1 1 27 27 PRO C C 27 177.157 177.157 177.103 0.054 25155 97 1 . 1 1 27 27 PRO CA C 27 64.530 64.530 63.848 0.682 25155 98 1 . 1 1 27 27 PRO CB C 27 32.000 32.000 32.092 -0.092 25155 99 1 . 1 1 28 28 GLU N N 28 116.510 116.510 117.036 -0.526 25155 100 1 . 1 1 28 28 GLU HA H 28 4.260 4.260 4.222 0.038 25155 101 1 . 1 1 28 28 GLU C C 28 177.000 177.000 176.979 0.021 25155 102 1 . 1 1 28 28 GLU CA C 28 57.680 57.680 57.914 -0.234 25155 103 1 . 1 1 28 28 GLU CB C 28 28.620 28.620 29.134 -0.514 25155 104 1 . 1 1 29 29 LEU N N 29 120.334 120.334 112.999 7.335 25155 105 1 . 1 1 29 29 LEU HA H 29 4.650 4.650 4.887 -0.237 25155 106 1 . 1 1 29 29 LEU C C 29 175.676 175.676 175.095 0.581 25155 107 1 . 1 1 29 29 LEU CA C 29 55.924 55.924 54.826 1.098 25155 108 1 . 1 1 29 29 LEU CB C 29 44.880 44.880 44.215 0.665 25155 109 1 . 1 1 29 29 LEU H H 29 7.924 7.924 7.521 0.403 25155 110 1 . 1 1 30 30 VAL N N 30 118.900 118.900 120.510 -1.610 25155 111 1 . 1 1 30 30 VAL HA H 30 4.639 4.639 4.919 -0.280 25155 112 1 . 1 1 30 30 VAL C C 30 174.368 174.368 175.770 -1.402 25155 113 1 . 1 1 30 30 VAL CA C 30 61.110 61.110 60.918 0.192 25155 114 1 . 1 1 30 30 VAL CB C 30 34.500 34.500 34.574 -0.074 25155 115 1 . 1 1 30 30 VAL H H 30 7.486 7.486 7.468 0.018 25155 116 1 . 1 1 31 31 THR N N 31 124.000 124.000 120.313 3.687 25155 117 1 . 1 1 31 31 THR HA H 31 4.331 4.331 4.707 -0.376 25155 118 1 . 1 1 31 31 THR C C 31 172.670 172.670 173.110 -0.440 25155 119 1 . 1 1 31 31 THR CA C 31 61.784 61.784 61.080 0.704 25155 120 1 . 1 1 31 31 THR CB C 31 70.483 70.483 71.271 -0.788 25155 121 1 . 1 1 31 31 THR H H 31 7.947 7.947 8.680 -0.733 25155 122 1 . 1 1 32 32 LEU N N 32 127.408 127.408 125.869 1.539 25155 123 1 . 1 1 32 32 LEU HA H 32 4.637 4.637 4.561 0.076 25155 124 1 . 1 1 32 32 LEU C C 32 176.425 176.425 176.798 -0.373 25155 125 1 . 1 1 32 32 LEU CA C 32 54.760 54.760 55.025 -0.265 25155 126 1 . 1 1 32 32 LEU CB C 32 43.809 43.809 43.032 0.777 25155 127 1 . 1 1 32 32 LEU H H 32 8.614 8.614 8.644 -0.030 25155 128 1 . 1 1 33 33 HIS N N 33 120.230 120.230 123.221 -2.991 25155 129 1 . 1 1 33 33 HIS HA H 33 4.420 4.420 4.838 -0.418 25155 130 1 . 1 1 33 33 HIS C C 33 171.914 171.914 173.901 -1.987 25155 131 1 . 1 1 33 33 HIS CA C 33 55.300 55.300 54.577 0.723 25155 132 1 . 1 1 33 33 HIS CB C 33 32.050 32.050 31.122 0.928 25155 133 1 . 1 1 33 33 HIS H H 33 9.130 9.130 9.002 0.128 25155 134 1 . 1 1 34 34 ASN N N 34 123.987 123.987 121.390 2.597 25155 135 1 . 1 1 34 34 ASN HA H 34 3.600 3.600 4.036 -0.436 25155 136 1 . 1 1 34 34 ASN C C 34 177.930 177.930 175.529 2.401 25155 137 1 . 1 1 34 34 ASN CA C 34 51.730 51.730 52.642 -0.912 25155 138 1 . 1 1 34 34 ASN CB C 34 38.747 38.747 38.529 0.218 25155 139 1 . 1 1 34 34 ASN H H 34 8.759 8.759 8.462 0.297 25155 140 1 . 1 1 35 35 LEU N N 35 128.751 128.751 125.920 2.831 25155 141 1 . 1 1 35 35 LEU HA H 35 4.290 4.290 4.184 0.106 25155 142 1 . 1 1 35 35 LEU C C 35 177.363 177.363 178.144 -0.781 25155 143 1 . 1 1 35 35 LEU CA C 35 56.550 56.550 56.463 0.087 25155 144 1 . 1 1 35 35 LEU CB C 35 42.762 42.762 41.697 1.065 25155 145 1 . 1 1 35 35 LEU H H 35 8.758 8.758 8.486 0.272 25155 146 1 . 1 1 36 36 LYS N N 36 120.870 120.870 118.374 2.497 25155 147 1 . 1 1 36 36 LYS HA H 36 3.933 3.933 4.117 -0.184 25155 148 1 . 1 1 36 36 LYS C C 36 176.540 176.540 177.141 -0.601 25155 149 1 . 1 1 36 36 LYS CA C 36 59.260 59.260 58.135 1.125 25155 150 1 . 1 1 36 36 LYS CB C 36 32.800 32.800 32.419 0.381 25155 151 1 . 1 1 37 37 ASP N N 37 115.288 115.288 116.650 -1.361 25155 152 1 . 1 1 37 37 ASP HA H 37 4.747 4.747 4.675 0.072 25155 153 1 . 1 1 37 37 ASP C C 37 175.500 175.500 176.127 -0.627 25155 154 1 . 1 1 37 37 ASP CA C 37 54.805 54.805 54.928 -0.123 25155 155 1 . 1 1 37 37 ASP CB C 37 44.650 44.650 42.977 1.673 25155 156 1 . 1 1 38 38 ASP N N 38 121.550 121.550 119.591 1.959 25155 157 1 . 1 1 38 38 ASP HA H 38 4.865 4.865 4.895 -0.030 25155 158 1 . 1 1 38 38 ASP C C 38 174.895 174.895 175.348 -0.453 25155 159 1 . 1 1 38 38 ASP CA C 38 52.840 52.840 53.584 -0.744 25155 160 1 . 1 1 38 38 ASP CB C 38 42.240 42.240 43.278 -1.038 25155 161 1 . 1 1 39 39 SER N N 39 115.170 115.170 117.547 -2.377 25155 162 1 . 1 1 39 39 SER HA H 39 4.600 4.600 4.695 -0.095 25155 163 1 . 1 1 39 39 SER C C 39 174.930 174.930 174.357 0.573 25155 164 1 . 1 1 39 39 SER CA C 39 54.786 54.786 56.925 -2.139 25155 165 1 . 1 1 39 39 SER CB C 39 64.840 64.840 63.350 1.490 25155 166 1 . 1 1 39 39 SER H H 39 8.330 8.330 8.633 -0.303 25155 167 1 . 1 1 40 40 PRO HA H 40 4.000 4.000 4.442 -0.442 25155 168 1 . 1 1 40 40 PRO C C 40 176.620 176.620 178.084 -1.464 25155 169 1 . 1 1 40 40 PRO CA C 40 63.870 63.870 64.905 -1.035 25155 170 1 . 1 1 40 40 PRO CB C 40 31.360 31.360 31.805 -0.445 25155 171 1 . 1 1 41 41 LYS N N 41 120.913 120.913 118.334 2.579 25155 172 1 . 1 1 41 41 LYS HA H 41 3.896 3.896 4.148 -0.252 25155 173 1 . 1 1 41 41 LYS C C 41 179.580 179.580 178.582 0.998 25155 174 1 . 1 1 41 41 LYS CA C 41 58.000 58.000 58.338 -0.338 25155 175 1 . 1 1 41 41 LYS CB C 41 32.100 32.100 31.219 0.881 25155 176 1 . 1 1 42 42 LEU N N 42 118.206 118.206 120.553 -2.347 25155 177 1 . 1 1 42 42 LEU HA H 42 4.025 4.025 3.950 0.075 25155 178 1 . 1 1 42 42 LEU C C 42 178.630 178.630 178.436 0.194 25155 179 1 . 1 1 42 42 LEU CA C 42 57.030 57.030 57.192 -0.162 25155 180 1 . 1 1 42 42 LEU CB C 42 41.820 41.820 40.915 0.905 25155 181 1 . 1 1 42 42 LEU H H 42 7.598 7.598 7.596 0.002 25155 182 1 . 1 1 43 43 MET N N 43 118.913 118.913 116.683 2.230 25155 183 1 . 1 1 43 43 MET HA H 43 3.760 3.760 4.112 -0.352 25155 184 1 . 1 1 43 43 MET C C 43 177.710 177.710 177.764 -0.054 25155 185 1 . 1 1 43 43 MET CA C 43 59.864 59.864 58.389 1.475 25155 186 1 . 1 1 43 43 MET CB C 43 32.680 32.680 31.944 0.736 25155 187 1 . 1 1 43 43 MET H H 43 8.180 8.180 8.046 0.134 25155 188 1 . 1 1 44 44 GLU N N 44 110.906 110.906 117.871 -6.965 25155 189 1 . 1 1 44 44 GLU HA H 44 3.732 3.732 4.049 -0.317 25155 190 1 . 1 1 44 44 GLU C C 44 178.120 178.120 179.090 -0.970 25155 191 1 . 1 1 44 44 GLU CA C 44 59.450 59.450 58.876 0.574 25155 192 1 . 1 1 44 44 GLU CB C 44 29.800 29.800 29.474 0.326 25155 193 1 . 1 1 45 45 GLN N N 45 115.770 115.770 117.808 -2.038 25155 194 1 . 1 1 45 45 GLN HA H 45 4.190 4.190 3.970 0.220 25155 195 1 . 1 1 45 45 GLN C C 45 175.480 175.480 176.502 -1.022 25155 196 1 . 1 1 45 45 GLN CA C 45 56.100 56.100 57.304 -1.204 25155 197 1 . 1 1 45 45 GLN CB C 45 28.490 28.490 28.793 -0.303 25155 198 1 . 1 1 45 45 GLN H H 45 7.517 7.517 7.404 0.113 25155 199 1 . 1 1 46 46 TYR N N 46 117.840 117.840 117.885 -0.045 25155 200 1 . 1 1 46 46 TYR HA H 46 4.660 4.660 4.456 0.204 25155 201 1 . 1 1 46 46 TYR C C 46 175.480 175.480 176.462 -0.982 25155 202 1 . 1 1 46 46 TYR CA C 46 58.827 58.827 58.028 0.799 25155 203 1 . 1 1 46 46 TYR CB C 46 41.720 41.720 38.500 3.220 25155 204 1 . 1 1 46 46 TYR H H 46 6.955 6.955 7.262 -0.307 25155 205 1 . 1 1 47 47 ASP N N 47 121.540 121.540 122.552 -1.012 25155 206 1 . 1 1 47 47 ASP HA H 47 4.696 4.696 4.607 0.089 25155 207 1 . 1 1 47 47 ASP C C 47 175.677 175.677 175.809 -0.132 25155 208 1 . 1 1 47 47 ASP CA C 47 56.812 56.812 57.014 -0.202 25155 209 1 . 1 1 47 47 ASP CB C 47 42.978 42.978 41.775 1.203 25155 210 1 . 1 1 48 48 VAL N N 48 118.666 118.666 117.139 1.527 25155 211 1 . 1 1 48 48 VAL HA H 48 5.057 5.057 4.968 0.089 25155 212 1 . 1 1 48 48 VAL C C 48 174.180 174.180 174.275 -0.095 25155 213 1 . 1 1 48 48 VAL CA C 48 60.000 60.000 60.815 -0.815 25155 214 1 . 1 1 48 48 VAL CB C 48 36.200 36.200 34.110 2.090 25155 215 1 . 1 1 48 48 VAL H H 48 7.631 7.631 7.917 -0.286 25155 216 1 . 1 1 49 49 LEU N N 49 128.300 128.300 127.775 0.525 25155 217 1 . 1 1 49 49 LEU HA H 49 5.600 5.600 5.173 0.427 25155 218 1 . 1 1 49 49 LEU C C 49 174.810 174.810 174.964 -0.154 25155 219 1 . 1 1 49 49 LEU CA C 49 52.230 52.230 53.895 -1.664 25155 220 1 . 1 1 49 49 LEU CB C 49 45.400 45.400 45.725 -0.326 25155 221 1 . 1 1 49 49 LEU H H 49 9.469 9.469 8.914 0.555 25155 222 1 . 1 1 50 50 ILE N N 50 124.400 124.400 126.716 -2.316 25155 223 1 . 1 1 50 50 ILE HA H 50 5.650 5.650 4.586 1.064 25155 224 1 . 1 1 50 50 ILE C C 50 175.286 175.286 174.242 1.044 25155 225 1 . 1 1 50 50 ILE CA C 50 59.900 59.900 61.185 -1.285 25155 226 1 . 1 1 50 50 ILE CB C 50 40.200 40.200 39.999 0.201 25155 227 1 . 1 1 50 50 ILE H H 50 9.213 9.213 9.205 0.008 25155 228 1 . 1 1 51 51 LEU N N 51 127.410 127.410 128.330 -0.920 25155 229 1 . 1 1 51 51 LEU HA H 51 6.070 6.070 4.287 1.783 25155 230 1 . 1 1 51 51 LEU C C 51 174.540 174.540 175.390 -0.850 25155 231 1 . 1 1 51 51 LEU CA C 51 52.950 52.950 53.120 -0.170 25155 232 1 . 1 1 51 51 LEU CB C 51 43.190 43.190 43.759 -0.569 25155 233 1 . 1 1 51 51 LEU H H 51 9.256 9.256 8.800 0.456 25155 234 1 . 1 1 52 52 GLY N N 52 108.290 108.290 111.158 -2.868 25155 235 1 . 1 1 52 52 GLY C C 52 174.330 174.330 171.495 2.835 25155 236 1 . 1 1 52 52 GLY CA C 52 44.040 44.040 43.479 0.561 25155 237 1 . 1 1 52 52 GLY H H 52 8.949 8.949 8.332 0.617 25155 238 1 . 1 1 53 53 ILE N N 53 124.912 124.912 121.814 3.098 25155 239 1 . 1 1 53 53 ILE HA H 53 4.175 4.175 4.472 -0.297 25155 240 1 . 1 1 53 53 ILE C C 53 174.470 174.470 172.839 1.631 25155 241 1 . 1 1 53 53 ILE CA C 53 55.850 55.850 57.831 -1.981 25155 242 1 . 1 1 53 53 ILE CB C 53 42.800 42.800 42.057 0.743 25155 243 1 . 1 1 53 53 ILE H H 53 8.612 8.612 7.482 1.130 25155 244 1 . 1 1 54 54 PRO HA H 54 4.812 4.812 4.621 0.191 25155 245 1 . 1 1 54 54 PRO C C 54 174.565 174.565 175.983 -1.418 25155 246 1 . 1 1 54 54 PRO CA C 54 61.850 61.850 62.247 -0.397 25155 247 1 . 1 1 54 54 PRO CB C 54 32.400 32.400 31.733 0.667 25155 248 1 . 1 1 55 55 THR N N 55 116.040 116.040 116.947 -0.907 25155 249 1 . 1 1 55 55 THR HA H 55 4.522 4.522 4.244 0.278 25155 250 1 . 1 1 55 55 THR C C 55 173.990 173.990 173.503 0.487 25155 251 1 . 1 1 55 55 THR CA C 55 62.845 62.845 62.718 0.127 25155 252 1 . 1 1 55 55 THR CB C 55 70.795 70.795 69.947 0.848 25155 253 1 . 1 1 55 55 THR H H 55 7.663 7.663 8.241 -0.578 25155 254 1 . 1 1 56 56 TRP N N 56 130.540 130.540 125.023 5.517 25155 255 1 . 1 1 56 56 TRP CA C 56 54.800 54.800 56.821 -2.021 25155 256 1 . 1 1 56 56 TRP H H 56 9.075 9.075 8.301 0.774 25155 257 1 . 1 1 58 58 PHE HA H 58 4.540 4.540 4.119 0.421 25155 258 1 . 1 1 58 58 PHE C C 58 177.070 177.070 175.354 1.716 25155 259 1 . 1 1 58 58 PHE CA C 58 55.460 55.460 57.885 -2.425 25155 260 1 . 1 1 58 58 PHE CB C 58 41.200 41.200 39.083 2.117 25155 261 1 . 1 1 59 59 GLY N N 59 109.796 109.796 107.896 1.900 25155 262 1 . 1 1 59 59 GLY CA C 59 45.763 45.763 44.862 0.901 25155 263 1 . 1 1 59 59 GLY H H 59 8.392 8.392 7.653 0.739 25155 264 1 . 1 1 60 60 GLU C C 60 175.660 175.660 175.671 -0.011 25155 265 1 . 1 1 61 61 ILE N N 61 122.380 122.380 121.155 1.225 25155 266 1 . 1 1 61 61 ILE HA H 61 4.440 4.440 3.495 0.945 25155 267 1 . 1 1 61 61 ILE CA C 61 62.100 62.100 62.183 -0.083 25155 268 1 . 1 1 61 61 ILE CB C 61 38.750 38.750 37.344 1.406 25155 269 1 . 1 1 61 61 ILE H H 61 8.436 8.436 8.225 0.211 25155 270 1 . 1 1 62 62 GLN CB C 62 30.570 30.570 29.645 0.925 25155 271 1 . 1 1 63 63 GLU HA H 63 4.030 4.030 3.965 0.065 25155 272 1 . 1 1 63 63 GLU C C 63 177.134 177.134 177.946 -0.812 25155 273 1 . 1 1 63 63 GLU CA C 63 60.520 60.520 60.150 0.370 25155 274 1 . 1 1 63 63 GLU CB C 63 29.650 29.650 29.660 -0.010 25155 275 1 . 1 1 64 64 ASP N N 64 119.630 119.630 117.935 1.695 25155 276 1 . 1 1 64 64 ASP HA H 64 4.592 4.592 4.488 0.104 25155 277 1 . 1 1 64 64 ASP C C 64 178.680 178.680 177.258 1.422 25155 278 1 . 1 1 64 64 ASP CA C 64 57.823 57.823 56.699 1.124 25155 279 1 . 1 1 64 64 ASP CB C 64 41.100 41.100 40.521 0.579 25155 280 1 . 1 1 65 65 TRP N N 65 120.535 120.535 121.348 -0.813 25155 281 1 . 1 1 65 65 TRP HA H 65 4.325 4.325 4.614 -0.289 25155 282 1 . 1 1 65 65 TRP C C 65 178.684 178.684 177.563 1.121 25155 283 1 . 1 1 65 65 TRP CA C 65 60.500 60.500 60.122 0.378 25155 284 1 . 1 1 65 65 TRP CB C 65 30.100 30.100 31.426 -1.326 25155 285 1 . 1 1 65 65 TRP H H 65 7.416 7.416 7.806 -0.390 25155 286 1 . 1 1 66 66 GLU N N 66 120.760 120.760 120.828 -0.068 25155 287 1 . 1 1 66 66 GLU HA H 66 3.820 3.820 4.237 -0.417 25155 288 1 . 1 1 66 66 GLU C C 66 178.860 178.860 178.873 -0.013 25155 289 1 . 1 1 66 66 GLU CA C 66 60.100 60.100 59.803 0.297 25155 290 1 . 1 1 66 66 GLU CB C 66 29.010 29.010 29.583 -0.573 25155 291 1 . 1 1 67 67 ALA N N 67 118.972 118.972 121.739 -2.767 25155 292 1 . 1 1 67 67 ALA HA H 67 4.247 4.247 4.214 0.033 25155 293 1 . 1 1 67 67 ALA C C 67 179.610 179.610 178.973 0.637 25155 294 1 . 1 1 67 67 ALA CA C 67 54.600 54.600 54.888 -0.288 25155 295 1 . 1 1 67 67 ALA CB C 67 18.788 18.788 18.868 -0.080 25155 296 1 . 1 1 67 67 ALA H H 67 7.690 7.690 8.478 -0.787 25155 297 1 . 1 1 68 68 VAL N N 68 107.530 107.530 111.036 -3.506 25155 298 1 . 1 1 68 68 VAL HA H 68 4.710 4.710 4.309 0.401 25155 299 1 . 1 1 68 68 VAL C C 68 176.800 176.800 177.121 -0.321 25155 300 1 . 1 1 68 68 VAL CA C 68 60.060 60.060 62.619 -2.559 25155 301 1 . 1 1 68 68 VAL CB C 68 32.600 32.600 32.448 0.152 25155 302 1 . 1 1 68 68 VAL H H 68 7.240 7.240 7.515 -0.275 25155 303 1 . 1 1 69 69 TRP N N 69 126.960 126.960 125.183 1.777 25155 304 1 . 1 1 69 69 TRP HA H 69 4.182 4.182 4.078 0.104 25155 305 1 . 1 1 69 69 TRP C C 69 178.640 178.640 176.841 1.799 25155 306 1 . 1 1 69 69 TRP CA C 69 61.300 61.300 62.542 -1.242 25155 307 1 . 1 1 69 69 TRP CB C 69 31.570 31.570 29.404 2.166 25155 308 1 . 1 1 69 69 TRP H H 69 7.810 7.810 8.153 -0.343 25155 309 1 . 1 1 70 70 ASP N N 70 114.644 114.644 116.509 -1.865 25155 310 1 . 1 1 70 70 ASP HA H 70 4.519 4.519 4.217 0.302 25155 311 1 . 1 1 70 70 ASP C C 70 178.685 178.685 178.117 0.568 25155 312 1 . 1 1 70 70 ASP CA C 70 56.000 56.000 56.423 -0.423 25155 313 1 . 1 1 70 70 ASP CB C 70 39.810 39.810 41.022 -1.212 25155 314 1 . 1 1 71 71 GLN N N 71 120.100 120.100 117.125 2.975 25155 315 1 . 1 1 71 71 GLN HA H 71 4.190 4.190 4.236 -0.046 25155 316 1 . 1 1 71 71 GLN C C 71 178.870 178.870 178.092 0.778 25155 317 1 . 1 1 71 71 GLN CA C 71 57.617 57.617 57.176 0.441 25155 318 1 . 1 1 71 71 GLN CB C 71 28.820 28.820 29.556 -0.736 25155 319 1 . 1 1 71 71 GLN H H 71 7.980 7.980 7.897 0.083 25155 320 1 . 1 1 72 72 LEU N N 72 117.535 117.535 119.822 -2.287 25155 321 1 . 1 1 72 72 LEU HA H 72 3.797 3.797 3.943 -0.146 25155 322 1 . 1 1 72 72 LEU C C 72 178.308 178.308 178.112 0.196 25155 323 1 . 1 1 72 72 LEU CA C 72 57.340 57.340 57.178 0.162 25155 324 1 . 1 1 72 72 LEU CB C 72 41.700 41.700 41.511 0.189 25155 325 1 . 1 1 72 72 LEU H H 72 7.435 7.435 7.751 -0.316 25155 326 1 . 1 1 73 73 ASP N N 73 115.534 115.534 117.645 -2.111 25155 327 1 . 1 1 73 73 ASP HA H 73 4.150 4.150 4.391 -0.241 25155 328 1 . 1 1 73 73 ASP C C 73 177.553 177.553 176.908 0.645 25155 329 1 . 1 1 73 73 ASP CA C 73 57.350 57.350 56.276 1.074 25155 330 1 . 1 1 73 73 ASP CB C 73 40.040 40.040 41.388 -1.348 25155 331 1 . 1 1 74 74 ASP N N 74 117.300 117.300 119.955 -2.655 25155 332 1 . 1 1 74 74 ASP HA H 74 4.706 4.706 4.504 0.202 25155 333 1 . 1 1 74 74 ASP C C 74 176.424 176.424 177.191 -0.767 25155 334 1 . 1 1 74 74 ASP CA C 74 54.170 54.170 55.383 -1.213 25155 335 1 . 1 1 74 74 ASP CB C 74 41.820 41.820 41.374 0.446 25155 336 1 . 1 1 75 75 LEU N N 75 118.500 118.500 120.362 -1.862 25155 337 1 . 1 1 75 75 LEU HA H 75 4.295 4.295 4.156 0.139 25155 338 1 . 1 1 75 75 LEU C C 75 176.800 176.800 176.488 0.312 25155 339 1 . 1 1 75 75 LEU CA C 75 54.400 54.400 55.139 -0.739 25155 340 1 . 1 1 75 75 LEU CB C 75 43.280 43.280 41.861 1.419 25155 341 1 . 1 1 75 75 LEU H H 75 6.966 6.966 7.497 -0.531 25155 342 1 . 1 1 76 76 ASN N N 76 123.040 123.040 120.551 2.489 25155 343 1 . 1 1 76 76 ASN HA H 76 4.862 4.862 4.665 0.197 25155 344 1 . 1 1 76 76 ASN C C 76 174.927 174.927 174.479 0.448 25155 345 1 . 1 1 76 76 ASN CA C 76 51.881 51.881 53.543 -1.662 25155 346 1 . 1 1 76 76 ASN CB C 76 37.510 37.510 38.796 -1.286 25155 347 1 . 1 1 76 76 ASN H H 76 9.882 9.882 9.024 0.858 25155 348 1 . 1 1 77 77 LEU N N 77 123.614 123.614 122.563 1.051 25155 349 1 . 1 1 77 77 LEU HA H 77 4.370 4.370 4.585 -0.215 25155 350 1 . 1 1 77 77 LEU C C 77 175.110 175.110 176.014 -0.904 25155 351 1 . 1 1 77 77 LEU CA C 77 52.200 52.200 54.051 -1.851 25155 352 1 . 1 1 77 77 LEU CB C 77 42.786 42.786 43.011 -0.225 25155 353 1 . 1 1 77 77 LEU H H 77 8.700 8.700 8.177 0.523 25155 354 1 . 1 1 78 78 GLU N N 78 120.822 120.822 121.565 -0.743 25155 355 1 . 1 1 78 78 GLU HA H 78 3.900 3.900 4.339 -0.439 25155 356 1 . 1 1 78 78 GLU C C 78 178.670 178.670 177.854 0.816 25155 357 1 . 1 1 78 78 GLU CA C 78 58.700 58.700 57.538 1.162 25155 358 1 . 1 1 78 78 GLU CB C 78 29.467 29.467 29.964 -0.497 25155 359 1 . 1 1 79 79 GLY N N 79 113.160 113.160 113.331 -0.171 25155 360 1 . 1 1 79 79 GLY C C 79 174.523 174.523 173.801 0.722 25155 361 1 . 1 1 79 79 GLY CA C 79 45.420 45.420 45.541 -0.121 25155 362 1 . 1 1 79 79 GLY H H 79 8.450 8.450 8.623 -0.173 25155 363 1 . 1 1 80 80 LYS N N 80 120.283 120.283 119.926 0.357 25155 364 1 . 1 1 80 80 LYS HA H 80 4.358 4.358 4.351 0.007 25155 365 1 . 1 1 80 80 LYS C C 80 175.304 175.304 176.021 -0.717 25155 366 1 . 1 1 80 80 LYS CA C 80 56.890 56.890 56.035 0.854 25155 367 1 . 1 1 80 80 LYS CB C 80 33.120 33.120 33.732 -0.612 25155 368 1 . 1 1 81 81 ILE N N 81 122.288 122.288 121.665 0.623 25155 369 1 . 1 1 81 81 ILE HA H 81 4.806 4.806 4.394 0.412 25155 370 1 . 1 1 81 81 ILE C C 81 174.750 174.750 175.397 -0.647 25155 371 1 . 1 1 81 81 ILE CA C 81 59.820 59.820 61.559 -1.739 25155 372 1 . 1 1 81 81 ILE CB C 81 38.850 38.850 38.298 0.552 25155 373 1 . 1 1 81 81 ILE H H 81 7.405 7.405 8.140 -0.735 25155 374 1 . 1 1 82 82 VAL N N 82 127.793 127.793 126.135 1.658 25155 375 1 . 1 1 82 82 VAL HA H 82 5.280 5.280 5.139 0.141 25155 376 1 . 1 1 82 82 VAL C C 82 172.680 172.680 174.260 -1.580 25155 377 1 . 1 1 82 82 VAL CA C 82 60.100 60.100 60.277 -0.177 25155 378 1 . 1 1 82 82 VAL CB C 82 35.280 35.280 35.883 -0.603 25155 379 1 . 1 1 82 82 VAL H H 82 8.800 8.800 9.036 -0.236 25155 380 1 . 1 1 83 83 ALA N N 83 130.911 130.911 128.844 2.067 25155 381 1 . 1 1 83 83 ALA HA H 83 5.389 5.389 5.602 -0.213 25155 382 1 . 1 1 83 83 ALA C C 83 175.870 175.870 176.073 -0.203 25155 383 1 . 1 1 83 83 ALA CA C 83 50.000 50.000 49.514 0.486 25155 384 1 . 1 1 83 83 ALA CB C 83 23.722 23.722 22.482 1.240 25155 385 1 . 1 1 83 83 ALA H H 83 9.252 9.252 8.927 0.325 25155 386 1 . 1 1 84 84 LEU N N 84 124.269 124.269 122.070 2.199 25155 387 1 . 1 1 84 84 LEU HA H 84 5.508 5.508 5.278 0.229 25155 388 1 . 1 1 84 84 LEU C C 84 175.490 175.490 175.560 -0.070 25155 389 1 . 1 1 84 84 LEU CA C 84 53.670 53.670 54.217 -0.547 25155 390 1 . 1 1 84 84 LEU CB C 84 45.000 45.000 45.646 -0.646 25155 391 1 . 1 1 84 84 LEU H H 84 10.378 10.378 8.905 1.474 25155 392 1 . 1 1 85 85 TYR N N 85 115.826 115.826 119.512 -3.686 25155 393 1 . 1 1 85 85 TYR HA H 85 4.950 4.950 5.158 -0.208 25155 394 1 . 1 1 85 85 TYR C C 85 172.661 172.661 173.681 -1.020 25155 395 1 . 1 1 85 85 TYR CA C 85 55.853 55.853 55.603 0.250 25155 396 1 . 1 1 85 85 TYR CB C 85 43.200 43.200 41.343 1.857 25155 397 1 . 1 1 85 85 TYR H H 85 9.200 9.200 8.650 0.550 25155 398 1 . 1 1 86 86 GLY N N 86 106.802 106.802 105.575 1.227 25155 399 1 . 1 1 86 86 GLY C C 86 170.348 170.348 171.139 -0.791 25155 400 1 . 1 1 86 86 GLY CA C 86 44.687 44.687 44.696 -0.009 25155 401 1 . 1 1 86 86 GLY H H 86 8.752 8.752 8.212 0.540 25155 402 1 . 1 1 87 87 LEU N N 87 120.860 120.860 119.385 1.475 25155 403 1 . 1 1 87 87 LEU HA H 87 5.476 5.476 5.111 0.365 25155 404 1 . 1 1 87 87 LEU C C 87 177.720 177.720 175.246 2.474 25155 405 1 . 1 1 87 87 LEU CA C 87 52.630 52.630 52.485 0.145 25155 406 1 . 1 1 87 87 LEU CB C 87 45.900 45.900 44.954 0.946 25155 407 1 . 1 1 87 87 LEU H H 87 6.320 6.320 7.860 -1.540 25155 408 1 . 1 1 88 88 GLY N N 88 109.910 109.910 108.839 1.071 25155 409 1 . 1 1 88 88 GLY C C 88 171.386 171.386 171.637 -0.251 25155 410 1 . 1 1 88 88 GLY CA C 88 45.710 45.710 44.983 0.727 25155 411 1 . 1 1 88 88 GLY H H 88 8.320 8.320 8.157 0.163 25155 412 1 . 1 1 89 89 ASP N N 89 121.580 121.580 118.972 2.608 25155 413 1 . 1 1 89 89 ASP HA H 89 5.190 5.190 5.185 0.005 25155 414 1 . 1 1 89 89 ASP C C 89 176.608 176.608 176.443 0.165 25155 415 1 . 1 1 89 89 ASP CA C 89 52.200 52.200 52.893 -0.693 25155 416 1 . 1 1 89 89 ASP CB C 89 41.900 41.900 43.044 -1.144 25155 417 1 . 1 1 90 90 GLN N N 90 123.900 123.900 123.692 0.208 25155 418 1 . 1 1 90 90 GLN HA H 90 3.645 3.645 4.182 -0.537 25155 419 1 . 1 1 90 90 GLN C C 90 173.523 173.523 176.329 -2.806 25155 420 1 . 1 1 90 90 GLN CA C 90 58.706 58.706 57.469 1.237 25155 421 1 . 1 1 90 90 GLN CB C 90 28.800 28.800 28.774 0.026 25155 422 1 . 1 1 90 90 GLN H H 90 8.726 8.726 8.882 -0.156 25155 423 1 . 1 1 91 91 LEU N N 91 117.080 117.080 119.356 -2.276 25155 424 1 . 1 1 91 91 LEU HA H 91 4.470 4.470 4.176 0.294 25155 425 1 . 1 1 91 91 LEU C C 91 179.840 179.840 178.519 1.321 25155 426 1 . 1 1 91 91 LEU CA C 91 55.800 55.800 55.822 -0.022 25155 427 1 . 1 1 91 91 LEU CB C 91 41.640 41.640 42.016 -0.376 25155 428 1 . 1 1 91 91 LEU H H 91 7.092 7.092 8.617 -1.525 25155 429 1 . 1 1 92 92 GLY N N 92 110.460 110.460 105.992 4.468 25155 430 1 . 1 1 92 92 GLY C C 92 174.824 174.824 174.721 0.103 25155 431 1 . 1 1 92 92 GLY CA C 92 46.390 46.390 46.032 0.358 25155 432 1 . 1 1 92 92 GLY H H 92 9.243 9.243 8.486 0.757 25155 433 1 . 1 1 93 93 TYR N N 93 118.140 118.140 119.073 -0.933 25155 434 1 . 1 1 93 93 TYR HA H 93 5.173 5.173 4.433 0.740 25155 435 1 . 1 1 93 93 TYR C C 93 177.805 177.805 176.658 1.147 25155 436 1 . 1 1 93 93 TYR CA C 93 57.430 57.430 58.306 -0.876 25155 437 1 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.202 1.098 25155 438 1 . 1 1 93 93 TYR H H 93 7.252 7.252 7.808 -0.556 25155 439 1 . 1 1 94 94 GLY N N 94 112.455 112.455 106.939 5.516 25155 440 1 . 1 1 94 94 GLY C C 94 177.740 177.740 175.598 2.142 25155 441 1 . 1 1 94 94 GLY CA C 94 49.880 49.880 46.136 3.744 25155 442 1 . 1 1 94 94 GLY H H 94 8.154 8.154 8.400 -0.246 25155 443 1 . 1 1 95 95 GLU N N 95 123.040 123.040 121.032 2.008 25155 444 1 . 1 1 95 95 GLU HA H 95 4.000 4.000 4.168 -0.168 25155 445 1 . 1 1 95 95 GLU C C 95 175.145 175.145 177.206 -2.061 25155 446 1 . 1 1 95 95 GLU CA C 95 57.950 57.950 58.389 -0.439 25155 447 1 . 1 1 95 95 GLU CB C 95 27.400 27.400 29.555 -2.155 25155 448 1 . 1 1 96 96 TRP N N 96 118.000 118.000 117.107 0.893 25155 449 1 . 1 1 96 96 TRP HA H 96 5.213 5.213 4.895 0.318 25155 450 1 . 1 1 96 96 TRP C C 96 176.616 176.616 175.929 0.687 25155 451 1 . 1 1 96 96 TRP CA C 96 57.120 57.120 55.464 1.656 25155 452 1 . 1 1 96 96 TRP CB C 96 29.970 29.970 28.869 1.101 25155 453 1 . 1 1 96 96 TRP H H 96 7.785 7.785 7.767 0.018 25155 454 1 . 1 1 97 97 PHE N N 97 123.268 123.268 121.765 1.503 25155 455 1 . 1 1 97 97 PHE HA H 97 4.660 4.660 4.402 0.258 25155 456 1 . 1 1 97 97 PHE CA C 97 58.742 58.742 59.225 -0.483 25155 457 1 . 1 1 97 97 PHE CB C 97 40.835 40.835 39.728 1.107 25155 458 1 . 1 1 97 97 PHE H H 97 7.054 7.054 7.847 -0.793 25155 459 1 . 1 1 98 98 LEU HA H 98 3.440 3.440 3.580 -0.140 25155 460 1 . 1 1 98 98 LEU C C 98 176.613 176.613 176.968 -0.355 25155 461 1 . 1 1 98 98 LEU CA C 98 56.000 56.000 54.990 1.010 25155 462 1 . 1 1 98 98 LEU CB C 98 38.600 38.600 39.385 -0.785 25155 463 1 . 1 1 98 98 LEU H H 98 8.584 8.584 8.252 0.332 25155 464 1 . 1 1 99 99 ASP N N 99 123.268 123.268 120.475 2.793 25155 465 1 . 1 1 99 99 ASP HA H 99 3.965 3.965 4.275 -0.310 25155 466 1 . 1 1 99 99 ASP C C 99 178.876 178.876 176.975 1.901 25155 467 1 . 1 1 99 99 ASP CA C 99 59.260 59.260 57.467 1.793 25155 468 1 . 1 1 99 99 ASP CB C 99 40.350 40.350 41.062 -0.712 25155 469 1 . 1 1 100 100 ALA N N 100 119.124 119.124 120.944 -1.820 25155 470 1 . 1 1 100 100 ALA HA H 100 3.822 3.822 4.054 -0.232 25155 471 1 . 1 1 100 100 ALA C C 100 178.490 178.490 179.193 -0.703 25155 472 1 . 1 1 100 100 ALA CA C 100 55.100 55.100 54.481 0.619 25155 473 1 . 1 1 100 100 ALA CB C 100 19.700 19.700 18.176 1.524 25155 474 1 . 1 1 100 100 ALA H H 100 8.400 8.400 7.635 0.765 25155 475 1 . 1 1 101 101 LEU N N 101 118.687 118.687 120.285 -1.598 25155 476 1 . 1 1 101 101 LEU HA H 101 3.674 3.674 3.972 -0.298 25155 477 1 . 1 1 101 101 LEU C C 101 179.050 179.050 178.720 0.330 25155 478 1 . 1 1 101 101 LEU CA C 101 57.800 57.800 57.304 0.496 25155 479 1 . 1 1 101 101 LEU CB C 101 42.650 42.650 41.562 1.088 25155 480 1 . 1 1 101 101 LEU H H 101 6.518 6.518 7.519 -1.001 25155 481 1 . 1 1 102 102 GLY N N 102 104.410 104.410 106.509 -2.099 25155 482 1 . 1 1 102 102 GLY C C 102 176.056 176.056 175.973 0.083 25155 483 1 . 1 1 102 102 GLY CA C 102 47.750 47.750 47.225 0.525 25155 484 1 . 1 1 102 102 GLY H H 102 7.712 7.712 7.941 -0.229 25155 485 1 . 1 1 103 103 MET N N 103 120.550 120.550 121.681 -1.131 25155 486 1 . 1 1 103 103 MET HA H 103 4.256 4.256 4.349 -0.093 25155 487 1 . 1 1 103 103 MET C C 103 179.650 179.650 178.381 1.269 25155 488 1 . 1 1 103 103 MET CA C 103 59.450 59.450 59.408 0.042 25155 489 1 . 1 1 103 103 MET CB C 103 32.300 32.300 32.742 -0.442 25155 490 1 . 1 1 103 103 MET H H 103 8.485 8.485 8.026 0.459 25155 491 1 . 1 1 104 104 LEU N N 104 123.480 123.480 120.082 3.398 25155 492 1 . 1 1 104 104 LEU HA H 104 4.061 4.061 4.315 -0.254 25155 493 1 . 1 1 104 104 LEU C C 104 177.750 177.750 178.760 -1.010 25155 494 1 . 1 1 104 104 LEU CA C 104 58.100 58.100 57.612 0.487 25155 495 1 . 1 1 104 104 LEU CB C 104 41.450 41.450 41.206 0.244 25155 496 1 . 1 1 104 104 LEU H H 104 8.392 8.392 7.998 0.394 25155 497 1 . 1 1 105 105 HIS N N 105 119.570 119.570 120.240 -0.670 25155 498 1 . 1 1 105 105 HIS HA H 105 3.852 3.852 4.175 -0.323 25155 499 1 . 1 1 105 105 HIS C C 105 177.550 177.550 177.081 0.469 25155 500 1 . 1 1 105 105 HIS CA C 105 61.000 61.000 60.700 0.300 25155 501 1 . 1 1 105 105 HIS CB C 105 28.820 28.820 29.979 -1.159 25155 502 1 . 1 1 105 105 HIS H H 105 8.247 8.247 8.490 -0.243 25155 503 1 . 1 1 106 106 ASP N N 106 119.780 119.780 119.446 0.334 25155 504 1 . 1 1 106 106 ASP HA H 106 4.333 4.333 4.295 0.038 25155 505 1 . 1 1 106 106 ASP C C 106 179.410 179.410 178.345 1.065 25155 506 1 . 1 1 106 106 ASP CA C 106 57.800 57.800 57.249 0.551 25155 507 1 . 1 1 106 106 ASP CB C 106 40.600 40.600 41.131 -0.531 25155 508 1 . 1 1 107 107 LYS N N 107 121.660 121.660 118.925 2.735 25155 509 1 . 1 1 107 107 LYS HA H 107 4.100 4.100 4.068 0.032 25155 510 1 . 1 1 107 107 LYS C C 107 178.316 178.316 178.539 -0.223 25155 511 1 . 1 1 107 107 LYS CA C 107 58.750 58.750 58.937 -0.187 25155 512 1 . 1 1 107 107 LYS CB C 107 31.850 31.850 32.548 -0.698 25155 513 1 . 1 1 108 108 LEU N N 108 116.050 116.050 117.696 -1.646 25155 514 1 . 1 1 108 108 LEU HA H 108 4.010 4.010 4.387 -0.377 25155 515 1 . 1 1 108 108 LEU C C 108 179.050 179.050 178.670 0.380 25155 516 1 . 1 1 108 108 LEU CA C 108 56.240 56.240 56.157 0.083 25155 517 1 . 1 1 108 108 LEU CB C 108 41.800 41.800 42.376 -0.576 25155 518 1 . 1 1 108 108 LEU H H 108 8.072 8.072 7.851 0.221 25155 519 1 . 1 1 109 109 SER N N 109 116.280 116.280 115.814 0.466 25155 520 1 . 1 1 109 109 SER HA H 109 4.300 4.300 4.346 -0.046 25155 521 1 . 1 1 109 109 SER C C 109 175.848 175.848 176.110 -0.262 25155 522 1 . 1 1 109 109 SER CA C 109 62.410 62.410 61.853 0.557 25155 523 1 . 1 1 109 109 SER CB C 109 62.850 62.850 63.126 -0.276 25155 524 1 . 1 1 109 109 SER H H 109 8.366 8.366 8.211 0.155 25155 525 1 . 1 1 110 110 THR N N 110 110.416 110.416 111.277 -0.861 25155 526 1 . 1 1 110 110 THR HA H 110 4.614 4.614 4.342 0.272 25155 527 1 . 1 1 110 110 THR C C 110 175.675 175.675 175.467 0.208 25155 528 1 . 1 1 110 110 THR CA C 110 62.030 62.030 63.815 -1.785 25155 529 1 . 1 1 110 110 THR CB C 110 68.810 68.810 68.824 -0.014 25155 530 1 . 1 1 110 110 THR H H 110 7.185 7.185 7.925 -0.740 25155 531 1 . 1 1 111 111 LYS N N 111 120.090 120.090 120.638 -0.548 25155 532 1 . 1 1 111 111 LYS HA H 111 4.513 4.513 4.417 0.096 25155 533 1 . 1 1 111 111 LYS C C 111 176.814 176.814 176.677 0.137 25155 534 1 . 1 1 111 111 LYS CA C 111 55.730 55.730 55.706 0.024 25155 535 1 . 1 1 111 111 LYS CB C 111 30.930 30.930 32.420 -1.490 25155 536 1 . 1 1 112 112 GLY N N 112 107.540 107.540 107.926 -0.386 25155 537 1 . 1 1 112 112 GLY C C 112 176.223 176.223 174.291 1.932 25155 538 1 . 1 1 112 112 GLY CA C 112 46.926 46.926 45.413 1.513 25155 539 1 . 1 1 112 112 GLY H H 112 8.315 8.315 7.605 0.710 25155 540 1 . 1 1 113 113 VAL N N 113 113.536 113.536 115.328 -1.792 25155 541 1 . 1 1 113 113 VAL HA H 113 4.494 4.494 4.273 0.221 25155 542 1 . 1 1 113 113 VAL C C 113 174.560 174.560 174.796 -0.236 25155 543 1 . 1 1 113 113 VAL CA C 113 59.550 59.550 61.010 -1.460 25155 544 1 . 1 1 113 113 VAL CB C 113 32.800 32.800 32.191 0.609 25155 545 1 . 1 1 113 113 VAL H H 113 6.835 6.835 7.029 -0.193 25155 546 1 . 1 1 114 114 LYS N N 114 122.920 122.920 121.536 1.384 25155 547 1 . 1 1 114 114 LYS HA H 114 4.494 4.494 4.401 0.093 25155 548 1 . 1 1 114 114 LYS C C 114 174.925 174.925 174.760 0.165 25155 549 1 . 1 1 114 114 LYS CA C 114 54.280 54.280 54.221 0.059 25155 550 1 . 1 1 114 114 LYS CB C 114 33.630 33.630 34.187 -0.557 25155 551 1 . 1 1 115 115 PHE N N 115 123.140 123.140 123.864 -0.724 25155 552 1 . 1 1 115 115 PHE HA H 115 5.700 5.700 5.417 0.283 25155 553 1 . 1 1 115 115 PHE C C 115 177.580 177.580 176.249 1.331 25155 554 1 . 1 1 115 115 PHE CA C 115 58.677 58.677 56.975 1.702 25155 555 1 . 1 1 115 115 PHE CB C 115 41.120 41.120 40.255 0.865 25155 556 1 . 1 1 115 115 PHE H H 115 8.506 8.506 8.522 -0.016 25155 557 1 . 1 1 116 116 VAL N N 116 115.737 115.737 116.881 -1.144 25155 558 1 . 1 1 116 116 VAL HA H 116 4.478 4.478 4.526 -0.048 25155 559 1 . 1 1 116 116 VAL C C 116 175.300 175.300 175.681 -0.381 25155 560 1 . 1 1 116 116 VAL CA C 116 58.877 58.877 59.870 -0.993 25155 561 1 . 1 1 116 116 VAL CB C 116 34.120 34.120 34.420 -0.300 25155 562 1 . 1 1 116 116 VAL H H 116 8.860 8.860 8.811 0.048 25155 563 1 . 1 1 117 117 GLY N N 117 108.137 108.137 110.596 -2.459 25155 564 1 . 1 1 117 117 GLY C C 117 176.110 176.110 174.647 1.462 25155 565 1 . 1 1 117 117 GLY CA C 117 47.500 47.500 45.361 2.139 25155 566 1 . 1 1 117 117 GLY H H 117 9.838 9.838 9.302 0.536 25155 567 1 . 1 1 118 118 TYR N N 118 120.380 120.380 119.929 0.451 25155 568 1 . 1 1 118 118 TYR HA H 118 4.970 4.970 4.593 0.377 25155 569 1 . 1 1 118 118 TYR C C 118 177.630 177.630 175.263 2.367 25155 570 1 . 1 1 118 118 TYR CA C 118 55.800 55.800 58.782 -2.982 25155 571 1 . 1 1 118 118 TYR CB C 118 35.970 35.970 38.347 -2.378 25155 572 1 . 1 1 118 118 TYR H H 118 8.652 8.652 8.116 0.536 25155 573 1 . 1 1 119 119 TRP N N 119 126.040 126.040 120.549 5.491 25155 574 1 . 1 1 119 119 TRP HA H 119 6.021 6.021 5.126 0.895 25155 575 1 . 1 1 119 119 TRP C C 119 173.000 173.000 173.794 -0.794 25155 576 1 . 1 1 119 119 TRP CA C 119 53.820 53.820 55.014 -1.194 25155 577 1 . 1 1 119 119 TRP CB C 119 36.050 36.050 33.448 2.602 25155 578 1 . 1 1 119 119 TRP H H 119 8.070 8.070 8.457 -0.387 25155 579 1 . 1 1 120 120 PRO HA H 120 4.784 4.784 4.549 0.235 25155 580 1 . 1 1 120 120 PRO C C 120 176.870 176.870 176.577 0.293 25155 581 1 . 1 1 120 120 PRO CA C 120 63.780 63.780 63.116 0.664 25155 582 1 . 1 1 120 120 PRO CB C 120 31.990 31.990 32.088 -0.098 25155 583 1 . 1 1 121 121 THR N N 121 109.310 109.310 113.942 -4.632 25155 584 1 . 1 1 121 121 THR HA H 121 4.073 4.073 3.861 0.212 25155 585 1 . 1 1 121 121 THR C C 121 176.324 176.324 175.205 1.119 25155 586 1 . 1 1 121 121 THR CA C 121 61.250 61.250 63.180 -1.930 25155 587 1 . 1 1 121 121 THR CB C 121 69.730 69.730 68.834 0.896 25155 588 1 . 1 1 121 121 THR H H 121 7.370 7.370 8.366 -0.995 25155 589 1 . 1 1 122 122 GLU N N 122 123.937 123.937 121.785 2.152 25155 590 1 . 1 1 122 122 GLU HA H 122 4.224 4.224 4.095 0.129 25155 591 1 . 1 1 122 122 GLU C C 122 177.737 177.737 177.686 0.051 25155 592 1 . 1 1 122 122 GLU CA C 122 58.200 58.200 57.755 0.445 25155 593 1 . 1 1 122 122 GLU CB C 122 29.800 29.800 29.463 0.337 25155 594 1 . 1 1 123 123 GLY N N 123 114.563 114.563 111.873 2.690 25155 595 1 . 1 1 123 123 GLY C C 123 173.783 173.783 173.948 -0.165 25155 596 1 . 1 1 123 123 GLY CA C 123 45.380 45.380 45.308 0.072 25155 597 1 . 1 1 123 123 GLY H H 123 9.144 9.144 8.854 0.290 25155 598 1 . 1 1 124 124 TYR N N 124 118.800 118.800 120.676 -1.876 25155 599 1 . 1 1 124 124 TYR HA H 124 5.218 5.218 4.641 0.577 25155 600 1 . 1 1 124 124 TYR C C 124 175.673 175.673 175.259 0.414 25155 601 1 . 1 1 124 124 TYR CA C 124 56.950 56.950 57.796 -0.846 25155 602 1 . 1 1 124 124 TYR CB C 124 41.100 41.100 40.217 0.884 25155 603 1 . 1 1 124 124 TYR H H 124 7.895 7.895 7.885 0.010 25155 604 1 . 1 1 125 125 GLU N N 125 124.790 124.790 122.816 1.974 25155 605 1 . 1 1 125 125 GLU HA H 125 4.685 4.685 4.478 0.207 25155 606 1 . 1 1 125 125 GLU C C 125 172.877 172.877 175.099 -2.222 25155 607 1 . 1 1 125 125 GLU CA C 125 55.700 55.700 55.448 0.252 25155 608 1 . 1 1 125 125 GLU CB C 125 31.340 31.340 30.902 0.438 25155 609 1 . 1 1 126 126 PHE N N 126 118.670 118.670 119.045 -0.375 25155 610 1 . 1 1 126 126 PHE HA H 126 4.841 4.841 4.927 -0.086 25155 611 1 . 1 1 126 126 PHE C C 126 173.800 173.800 174.364 -0.564 25155 612 1 . 1 1 126 126 PHE CA C 126 56.950 56.950 57.259 -0.309 25155 613 1 . 1 1 126 126 PHE CB C 126 40.300 40.300 40.550 -0.250 25155 614 1 . 1 1 126 126 PHE H H 126 7.645 7.645 7.909 -0.264 25155 615 1 . 1 1 127 127 THR N N 127 107.038 107.038 114.624 -7.586 25155 616 1 . 1 1 127 127 THR HA H 127 4.370 4.370 4.260 0.110 25155 617 1 . 1 1 127 127 THR C C 127 175.100 175.100 174.600 0.500 25155 618 1 . 1 1 127 127 THR CA C 127 61.080 61.080 61.868 -0.788 25155 619 1 . 1 1 127 127 THR CB C 127 70.500 70.500 69.570 0.930 25155 620 1 . 1 1 127 127 THR H H 127 7.306 7.306 8.610 -1.304 25155 621 1 . 1 1 128 128 SER N N 128 118.150 118.150 119.349 -1.199 25155 622 1 . 1 1 128 128 SER HA H 128 4.650 4.650 4.658 -0.008 25155 623 1 . 1 1 128 128 SER C C 128 175.760 175.760 173.904 1.856 25155 624 1 . 1 1 128 128 SER CA C 128 55.813 55.813 57.622 -1.809 25155 625 1 . 1 1 128 128 SER CB C 128 65.300 65.300 63.886 1.414 25155 626 1 . 1 1 128 128 SER H H 128 7.354 7.354 8.082 -0.728 25155 627 1 . 1 1 129 129 PRO HA H 129 4.764 4.764 4.535 0.229 25155 628 1 . 1 1 129 129 PRO C C 129 178.860 178.860 178.215 0.645 25155 629 1 . 1 1 129 129 PRO CA C 129 62.728 62.728 64.171 -1.443 25155 630 1 . 1 1 129 129 PRO CB C 129 32.400 32.400 32.468 -0.068 25155 631 1 . 1 1 130 130 LYS N N 130 122.158 122.158 119.753 2.405 25155 632 1 . 1 1 130 130 LYS HA H 130 4.210 4.210 4.136 0.074 25155 633 1 . 1 1 130 130 LYS C C 130 176.890 176.890 175.683 1.207 25155 634 1 . 1 1 130 130 LYS CA C 130 61.375 61.375 60.636 0.739 25155 635 1 . 1 1 130 130 LYS CB C 130 30.350 30.350 31.053 -0.703 25155 636 1 . 1 1 131 131 PRO HA H 131 4.533 4.533 4.414 0.119 25155 637 1 . 1 1 131 131 PRO C C 131 173.810 173.810 175.645 -1.835 25155 638 1 . 1 1 131 131 PRO CA C 131 64.510 64.510 63.324 1.186 25155 639 1 . 1 1 131 131 PRO CB C 131 31.745 31.745 31.394 0.351 25155 640 1 . 1 1 132 132 VAL N N 132 114.480 114.480 113.243 1.237 25155 641 1 . 1 1 132 132 VAL HA H 132 5.158 5.158 5.017 0.141 25155 642 1 . 1 1 132 132 VAL C C 132 175.137 175.137 174.336 0.801 25155 643 1 . 1 1 132 132 VAL CA C 132 59.800 59.800 59.270 0.530 25155 644 1 . 1 1 132 132 VAL CB C 132 34.780 34.780 35.513 -0.733 25155 645 1 . 1 1 132 132 VAL H H 132 6.716 6.716 7.549 -0.833 25155 646 1 . 1 1 133 133 ILE N N 133 120.670 120.670 114.364 6.306 25155 647 1 . 1 1 133 133 ILE HA H 133 4.392 4.392 4.499 -0.107 25155 648 1 . 1 1 133 133 ILE C C 133 175.485 175.485 175.306 0.179 25155 649 1 . 1 1 133 133 ILE CA C 133 60.000 60.000 59.594 0.406 25155 650 1 . 1 1 133 133 ILE CB C 133 42.020 42.020 40.419 1.601 25155 651 1 . 1 1 133 133 ILE H H 133 8.740 8.740 8.288 0.452 25155 652 1 . 1 1 134 134 ALA N N 134 122.454 122.454 123.211 -0.757 25155 653 1 . 1 1 134 134 ALA HA H 134 3.953 3.953 3.954 -0.001 25155 654 1 . 1 1 134 134 ALA C C 134 178.387 178.387 177.259 1.128 25155 655 1 . 1 1 134 134 ALA CA C 134 53.050 53.050 53.395 -0.345 25155 656 1 . 1 1 134 134 ALA CB C 134 16.982 16.982 17.387 -0.405 25155 657 1 . 1 1 134 134 ALA H H 134 8.490 8.490 8.576 -0.086 25155 658 1 . 1 1 135 135 ASP N N 135 117.310 117.310 118.578 -1.268 25155 659 1 . 1 1 135 135 ASP HA H 135 4.244 4.244 4.383 -0.139 25155 660 1 . 1 1 135 135 ASP C C 135 176.390 176.390 176.509 -0.119 25155 661 1 . 1 1 135 135 ASP CA C 135 55.120 55.120 54.201 0.919 25155 662 1 . 1 1 135 135 ASP CB C 135 39.865 39.865 39.836 0.029 25155 663 1 . 1 1 136 136 GLY N N 136 104.336 104.336 106.022 -1.686 25155 664 1 . 1 1 136 136 GLY C C 136 174.940 174.940 175.248 -0.308 25155 665 1 . 1 1 136 136 GLY CA C 136 45.150 45.150 45.455 -0.305 25155 666 1 . 1 1 136 136 GLY H H 136 7.592 7.592 7.972 -0.379 25155 667 1 . 1 1 137 137 GLN N N 137 118.675 118.675 118.785 -0.110 25155 668 1 . 1 1 137 137 GLN HA H 137 4.062 4.062 4.420 -0.358 25155 669 1 . 1 1 137 137 GLN C C 137 176.420 176.420 175.167 1.253 25155 670 1 . 1 1 137 137 GLN CA C 137 57.760 57.760 56.793 0.967 25155 671 1 . 1 1 137 137 GLN CB C 137 30.400 30.400 30.264 0.136 25155 672 1 . 1 1 137 137 GLN H H 137 7.843 7.843 7.967 -0.124 25155 673 1 . 1 1 138 138 LEU N N 138 118.160 118.160 118.628 -0.468 25155 674 1 . 1 1 138 138 LEU HA H 138 4.961 4.961 4.669 0.292 25155 675 1 . 1 1 138 138 LEU C C 138 175.700 175.700 174.834 0.866 25155 676 1 . 1 1 138 138 LEU CA C 138 53.705 53.705 53.962 -0.257 25155 677 1 . 1 1 138 138 LEU CB C 138 46.480 46.480 45.699 0.781 25155 678 1 . 1 1 138 138 LEU H H 138 7.356 7.356 7.264 0.092 25155 679 1 . 1 1 139 139 PHE N N 139 119.060 119.060 121.850 -2.790 25155 680 1 . 1 1 139 139 PHE HA H 139 5.344 5.344 4.715 0.629 25155 681 1 . 1 1 139 139 PHE C C 139 178.850 178.850 177.185 1.665 25155 682 1 . 1 1 139 139 PHE CA C 139 56.670 56.670 58.069 -1.399 25155 683 1 . 1 1 139 139 PHE CB C 139 43.652 43.652 39.341 4.311 25155 684 1 . 1 1 139 139 PHE H H 139 10.026 10.026 9.067 0.959 25155 685 1 . 1 1 140 140 VAL N N 140 109.905 109.905 117.237 -7.332 25155 686 1 . 1 1 140 140 VAL HA H 140 3.500 3.500 3.103 0.397 25155 687 1 . 1 1 140 140 VAL C C 140 172.860 172.860 174.872 -2.012 25155 688 1 . 1 1 140 140 VAL CA C 140 61.812 61.812 62.332 -0.520 25155 689 1 . 1 1 140 140 VAL CB C 140 30.250 30.250 30.465 -0.215 25155 690 1 . 1 1 140 140 VAL H H 140 7.550 7.550 8.176 -0.626 25155 691 1 . 1 1 141 141 GLY N N 141 106.600 106.600 106.286 0.314 25155 692 1 . 1 1 141 141 GLY C C 141 171.350 171.350 172.707 -1.357 25155 693 1 . 1 1 141 141 GLY CA C 141 45.460 45.460 44.505 0.955 25155 694 1 . 1 1 141 141 GLY H H 141 7.052 7.052 7.279 -0.227 25155 695 1 . 1 1 142 142 LEU N N 142 117.820 117.820 120.011 -2.191 25155 696 1 . 1 1 142 142 LEU HA H 142 4.962 4.962 3.960 1.002 25155 697 1 . 1 1 142 142 LEU CA C 142 55.600 55.600 54.205 1.395 25155 698 1 . 1 1 142 142 LEU CB C 142 37.930 37.930 42.532 -4.602 25155 699 1 . 1 1 142 142 LEU H H 142 7.643 7.643 8.191 -0.548 25155 700 1 . 1 1 143 143 ALA HA H 143 4.220 4.220 3.932 0.288 25155 701 1 . 1 1 143 143 ALA C C 143 175.505 175.505 175.746 -0.241 25155 702 1 . 1 1 143 143 ALA CA C 143 49.600 49.600 50.330 -0.730 25155 703 1 . 1 1 143 143 ALA CB C 143 23.330 23.330 18.513 4.817 25155 704 1 . 1 1 144 144 LEU N N 144 124.960 124.960 123.555 1.405 25155 705 1 . 1 1 144 144 LEU HA H 144 4.780 4.780 4.445 0.335 25155 706 1 . 1 1 144 144 LEU C C 144 174.700 174.700 175.120 -0.420 25155 707 1 . 1 1 144 144 LEU CA C 144 52.790 52.790 53.703 -0.913 25155 708 1 . 1 1 144 144 LEU CB C 144 45.300 45.300 44.608 0.692 25155 709 1 . 1 1 144 144 LEU H H 144 8.583 8.583 7.969 0.614 25155 710 1 . 1 1 145 145 ASP N N 145 119.100 119.100 120.338 -1.238 25155 711 1 . 1 1 145 145 ASP HA H 145 5.422 5.422 5.227 0.195 25155 712 1 . 1 1 145 145 ASP C C 145 176.180 176.180 175.420 0.760 25155 713 1 . 1 1 145 145 ASP CA C 145 53.600 53.600 53.118 0.482 25155 714 1 . 1 1 145 145 ASP CB C 145 43.180 43.180 43.976 -0.796 25155 715 1 . 1 1 147 147 THR HA H 147 4.093 4.093 4.406 -0.313 25155 716 1 . 1 1 147 147 THR C C 147 175.858 175.858 175.492 0.366 25155 717 1 . 1 1 147 147 THR CA C 147 66.400 66.400 64.382 2.018 25155 718 1 . 1 1 147 147 THR CB C 147 69.400 69.400 70.009 -0.609 25155 719 1 . 1 1 147 147 THR H H 147 8.745 8.745 8.574 0.171 25155 720 1 . 1 1 148 148 ASN N N 148 115.408 115.408 118.488 -3.080 25155 721 1 . 1 1 148 148 ASN HA H 148 5.010 5.010 4.743 0.267 25155 722 1 . 1 1 148 148 ASN C C 148 175.750 175.750 175.143 0.608 25155 723 1 . 1 1 148 148 ASN CA C 148 53.400 53.400 54.675 -1.275 25155 724 1 . 1 1 148 148 ASN CB C 148 41.900 41.900 39.839 2.061 25155 725 1 . 1 1 148 148 ASN H H 148 8.975 8.975 8.779 0.196 25155 726 1 . 1 1 149 149 GLN N N 149 117.900 117.900 116.965 0.935 25155 727 1 . 1 1 149 149 GLN HA H 149 4.936 4.936 4.521 0.415 25155 728 1 . 1 1 149 149 GLN C C 149 178.280 178.280 175.037 3.243 25155 729 1 . 1 1 149 149 GLN CA C 149 53.730 53.730 55.049 -1.319 25155 730 1 . 1 1 149 149 GLN CB C 149 29.790 29.790 30.661 -0.871 25155 731 1 . 1 1 149 149 GLN H H 149 7.430 7.430 8.026 -0.596 25155 732 1 . 1 1 150 150 TYR N N 150 121.060 121.060 120.280 0.780 25155 733 1 . 1 1 150 150 TYR HA H 150 4.671 4.671 4.515 0.156 25155 734 1 . 1 1 150 150 TYR C C 150 178.680 178.680 176.631 2.049 25155 735 1 . 1 1 150 150 TYR CA C 150 57.930 57.930 59.569 -1.639 25155 736 1 . 1 1 150 150 TYR CB C 150 38.860 38.860 38.878 -0.018 25155 737 1 . 1 1 150 150 TYR H H 150 8.115 8.115 8.369 -0.254 25155 738 1 . 1 1 151 151 ASP N N 151 121.175 121.175 120.615 0.560 25155 739 1 . 1 1 151 151 ASP CA C 151 57.000 57.000 56.447 0.553 25155 740 1 . 1 1 151 151 ASP CB C 151 42.000 42.000 40.604 1.396 25155 741 1 . 1 1 152 152 LEU HA H 152 4.590 4.590 4.443 0.147 25155 742 1 . 1 1 152 152 LEU C C 152 178.300 178.300 177.762 0.538 25155 743 1 . 1 1 152 152 LEU CA C 152 54.788 54.788 55.714 -0.926 25155 744 1 . 1 1 152 152 LEU CB C 152 42.200 42.200 41.639 0.561 25155 745 1 . 1 1 153 153 SER N N 153 116.170 116.170 117.068 -0.898 25155 746 1 . 1 1 153 153 SER HA H 153 3.911 3.911 4.039 -0.128 25155 747 1 . 1 1 153 153 SER CA C 153 63.400 63.400 62.203 1.197 25155 748 1 . 1 1 153 153 SER CB C 153 63.200 63.200 62.855 0.345 25155 749 1 . 1 1 153 153 SER H H 153 7.378 7.378 7.864 -0.486 25155 750 1 . 1 1 154 154 ASP N N 154 121.640 121.640 121.151 0.489 25155 751 1 . 1 1 154 154 ASP HA H 154 4.240 4.240 4.329 -0.089 25155 752 1 . 1 1 154 154 ASP CA C 154 59.300 59.300 57.561 1.740 25155 753 1 . 1 1 154 154 ASP CB C 154 40.000 40.000 40.912 -0.912 25155 754 1 . 1 1 155 155 GLU HA H 155 4.170 4.170 4.009 0.161 25155 755 1 . 1 1 155 155 GLU C C 155 179.420 179.420 178.976 0.444 25155 756 1 . 1 1 155 155 GLU CA C 155 59.200 59.200 59.318 -0.118 25155 757 1 . 1 1 155 155 GLU CB C 155 29.480 29.480 29.569 -0.089 25155 758 1 . 1 1 156 156 ARG N N 156 121.230 121.230 118.939 2.291 25155 759 1 . 1 1 156 156 ARG HA H 156 4.276 4.276 4.259 0.017 25155 760 1 . 1 1 156 156 ARG C C 156 177.350 177.350 179.328 -1.978 25155 761 1 . 1 1 156 156 ARG CA C 156 59.950 59.950 59.130 0.820 25155 762 1 . 1 1 156 156 ARG CB C 156 31.100 31.100 29.990 1.110 25155 763 1 . 1 1 157 157 ILE N N 157 118.190 118.190 120.017 -1.827 25155 764 1 . 1 1 157 157 ILE HA H 157 3.430 3.430 3.685 -0.255 25155 765 1 . 1 1 157 157 ILE C C 157 178.480 178.480 178.027 0.453 25155 766 1 . 1 1 157 157 ILE CA C 157 66.560 66.560 65.419 1.141 25155 767 1 . 1 1 157 157 ILE CB C 157 38.480 38.480 37.826 0.654 25155 768 1 . 1 1 157 157 ILE H H 157 8.705 8.705 8.094 0.611 25155 769 1 . 1 1 158 158 GLN N N 158 119.975 119.975 120.628 -0.653 25155 770 1 . 1 1 158 158 GLN HA H 158 3.956 3.956 3.904 0.052 25155 771 1 . 1 1 158 158 GLN C C 158 178.730 178.730 178.289 0.441 25155 772 1 . 1 1 158 158 GLN CA C 158 60.700 60.700 59.339 1.361 25155 773 1 . 1 1 158 158 GLN CB C 158 28.482 28.482 28.341 0.141 25155 774 1 . 1 1 158 158 GLN H H 158 8.262 8.262 8.559 -0.297 25155 775 1 . 1 1 159 159 SER N N 159 115.466 115.466 115.244 0.222 25155 776 1 . 1 1 159 159 SER HA H 159 4.446 4.446 4.292 0.154 25155 777 1 . 1 1 159 159 SER C C 159 177.320 177.320 176.881 0.439 25155 778 1 . 1 1 159 159 SER CA C 159 63.500 63.500 61.236 2.264 25155 779 1 . 1 1 159 159 SER CB C 159 63.818 63.818 63.173 0.645 25155 780 1 . 1 1 159 159 SER H H 159 8.440 8.440 8.249 0.191 25155 781 1 . 1 1 160 160 TRP N N 160 126.784 126.784 125.011 1.773 25155 782 1 . 1 1 160 160 TRP HA H 160 4.454 4.454 4.472 -0.018 25155 783 1 . 1 1 160 160 TRP C C 160 177.934 177.934 177.665 0.269 25155 784 1 . 1 1 160 160 TRP CA C 160 62.745 62.745 62.193 0.552 25155 785 1 . 1 1 160 160 TRP CB C 160 29.350 29.350 29.337 0.013 25155 786 1 . 1 1 160 160 TRP H H 160 9.243 9.243 7.868 1.375 25155 787 1 . 1 1 161 161 CYS N N 161 116.395 116.395 118.745 -2.350 25155 788 1 . 1 1 161 161 CYS HA H 161 3.886 3.886 3.764 0.122 25155 789 1 . 1 1 161 161 CYS C C 161 176.245 176.245 177.072 -0.827 25155 790 1 . 1 1 161 161 CYS CA C 161 65.300 65.300 64.645 0.655 25155 791 1 . 1 1 161 161 CYS CB C 161 27.723 27.723 27.120 0.603 25155 792 1 . 1 1 161 161 CYS H H 161 8.845 8.845 9.044 -0.199 25155 793 1 . 1 1 162 162 GLU N N 162 118.030 118.030 119.424 -1.394 25155 794 1 . 1 1 162 162 GLU HA H 162 3.920 3.920 3.870 0.050 25155 795 1 . 1 1 162 162 GLU C C 162 178.700 178.700 178.746 -0.046 25155 796 1 . 1 1 162 162 GLU CA C 162 59.800 59.800 59.511 0.289 25155 797 1 . 1 1 162 162 GLU CB C 162 29.500 29.500 29.247 0.253 25155 798 1 . 1 1 163 163 GLN N N 163 120.650 120.650 119.664 0.986 25155 799 1 . 1 1 163 163 GLN HA H 163 4.173 4.173 4.024 0.149 25155 800 1 . 1 1 163 163 GLN C C 163 179.700 179.700 178.446 1.254 25155 801 1 . 1 1 163 163 GLN CA C 163 59.688 59.688 59.034 0.654 25155 802 1 . 1 1 163 163 GLN CB C 163 28.900 28.900 28.793 0.107 25155 803 1 . 1 1 163 163 GLN H H 163 8.148 8.148 7.810 0.338 25155 804 1 . 1 1 164 164 ILE N N 164 114.836 114.836 117.054 -2.218 25155 805 1 . 1 1 164 164 ILE HA H 164 4.060 4.060 3.615 0.445 25155 806 1 . 1 1 164 164 ILE C C 164 178.676 178.676 177.660 1.016 25155 807 1 . 1 1 164 164 ILE CA C 164 66.160 66.160 64.424 1.736 25155 808 1 . 1 1 164 164 ILE CB C 164 37.630 37.630 37.321 0.309 25155 809 1 . 1 1 164 164 ILE H H 164 8.958 8.958 8.235 0.723 25155 810 1 . 1 1 165 165 LEU N N 165 123.700 123.700 119.943 3.757 25155 811 1 . 1 1 165 165 LEU HA H 165 4.100 4.100 4.046 0.054 25155 812 1 . 1 1 165 165 LEU C C 165 180.548 180.548 178.378 2.170 25155 813 1 . 1 1 165 165 LEU CA C 165 58.150 58.150 58.218 -0.068 25155 814 1 . 1 1 165 165 LEU CB C 165 41.130 41.130 41.417 -0.287 25155 815 1 . 1 1 165 165 LEU H H 165 7.830 7.830 7.822 0.008 25155 816 1 . 1 1 166 166 ASN N N 166 120.160 120.160 118.374 1.786 25155 817 1 . 1 1 166 166 ASN HA H 166 4.570 4.570 4.352 0.218 25155 818 1 . 1 1 166 166 ASN C C 166 175.690 175.690 177.333 -1.643 25155 819 1 . 1 1 166 166 ASN CA C 166 55.946 55.946 56.822 -0.876 25155 820 1 . 1 1 166 166 ASN CB C 166 38.480 38.480 38.385 0.095 25155 821 1 . 1 1 166 166 ASN H H 166 7.706 7.706 7.839 -0.133 25155 822 1 . 1 1 167 167 GLU N N 167 121.286 121.286 120.949 0.337 25155 823 1 . 1 1 167 167 GLU HA H 167 4.104 4.104 4.245 -0.141 25155 824 1 . 1 1 167 167 GLU C C 167 180.520 180.520 178.984 1.536 25155 825 1 . 1 1 167 167 GLU CA C 167 59.920 59.920 59.003 0.917 25155 826 1 . 1 1 167 167 GLU CB C 167 30.925 30.925 29.745 1.180 25155 827 1 . 1 1 168 168 MET N N 168 118.622 118.622 116.001 2.621 25155 828 1 . 1 1 168 168 MET HA H 168 3.996 3.996 4.490 -0.494 25155 829 1 . 1 1 168 168 MET C C 168 176.856 176.856 177.840 -0.984 25155 830 1 . 1 1 168 168 MET CA C 168 59.500 59.500 58.599 0.901 25155 831 1 . 1 1 168 168 MET CB C 168 33.700 33.700 32.871 0.829 25155 832 1 . 1 1 168 168 MET H H 168 8.723 8.723 8.366 0.357 25155 833 1 . 1 1 169 169 ALA N N 169 121.760 121.760 123.130 -1.370 25155 834 1 . 1 1 169 169 ALA HA H 169 4.156 4.156 4.253 -0.097 25155 835 1 . 1 1 169 169 ALA C C 169 179.790 179.790 179.653 0.137 25155 836 1 . 1 1 169 169 ALA CA C 169 54.800 54.800 54.448 0.352 25155 837 1 . 1 1 169 169 ALA CB C 169 18.220 18.220 18.769 -0.549 25155 838 1 . 1 1 169 169 ALA H H 169 7.494 7.494 7.661 -0.167 25155 839 1 . 1 1 170 170 GLU N N 170 116.970 116.970 118.565 -1.595 25155 840 1 . 1 1 170 170 GLU HA H 170 4.091 4.091 3.995 0.096 25155 841 1 . 1 1 170 170 GLU C C 170 177.745 177.745 178.409 -0.664 25155 842 1 . 1 1 170 170 GLU CA C 170 58.000 58.000 58.840 -0.840 25155 843 1 . 1 1 170 170 GLU CB C 170 29.730 29.730 29.293 0.437 25155 844 1 . 1 1 171 171 HIS N N 171 118.150 118.150 117.900 0.250 25155 845 1 . 1 1 171 171 HIS HA H 171 4.470 4.470 4.338 0.132 25155 846 1 . 1 1 171 171 HIS C C 171 175.848 175.848 176.246 -0.398 25155 847 1 . 1 1 171 171 HIS CA C 171 57.600 57.600 58.280 -0.680 25155 848 1 . 1 1 171 171 HIS CB C 171 30.800 30.800 29.969 0.831 25155 849 1 . 1 1 171 171 HIS H H 171 7.717 7.717 7.749 -0.032 25155 850 1 . 1 1 172 172 TYR N N 172 119.483 119.483 117.870 1.613 25155 851 1 . 1 1 172 172 TYR HA H 172 4.591 4.591 4.437 0.154 25155 852 1 . 1 1 172 172 TYR C C 172 174.590 174.590 175.902 -1.312 25155 853 1 . 1 1 172 172 TYR CA C 172 57.813 57.813 58.148 -0.335 25155 854 1 . 1 1 172 172 TYR CB C 172 38.900 38.900 38.833 0.067 25155 855 1 . 1 1 172 172 TYR H H 172 7.778 7.778 7.805 -0.027 25155 stop_ save_