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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | cing | stage | position | program | type |
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653072 |
6l7k ![]() ![]() |
cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ALA 1 H1 ALA 1 116.464 9.100 -5.190 2 H2 ALA 1 H2 ALA 1 117.971 8.606 -4.738 3 H3 ALA 1 H3 ALA 1 116.663 7.650 -4.431 4 HA ALA 1 HA ALA 1 117.693 8.338 -7.109 5 HB1 ALA 1 HB1 ALA 1 119.210 6.756 -6.236 6 HB2 ALA 1 HB2 ALA 1 117.944 5.916 -5.309 7 HB3 ALA 1 HB3 ALA 1 118.017 5.738 -7.078 8 H PHE 2 H PHE 2 116.739 5.735 -8.046 9 HA PHE 2 HA PHE 2 114.771 4.940 -9.090 10 HB2 PHE 2 HB2 PHE 2 114.424 4.730 -6.390 11 HB3 PHE 2 HB3 PHE 2 113.050 5.782 -6.799 12 HD1 PHE 2 HD1 PHE 2 114.719 2.912 -8.607 13 HD2 PHE 2 HD2 PHE 2 111.112 4.533 -6.926 14 HE1 PHE 2 HE1 PHE 2 113.442 0.961 -9.454 15 HE2 PHE 2 HE2 PHE 2 109.843 2.581 -7.769 16 HZ PHE 2 HZ PHE 2 111.006 0.799 -9.034 17 H ASP 3 H ASP 3 115.404 7.419 -10.002 18 HA ASP 3 HA ASP 3 113.000 9.169 -9.699 19 HB2 ASP 3 HB2 ASP 3 115.168 10.278 -9.790 20 HB3 ASP 3 HB3 ASP 3 115.577 9.444 -11.308 21 H SER 4 H SER 4 111.374 7.834 -10.686 22 HA SER 4 HA SER 4 110.807 8.283 -13.395 23 HB2 SER 4 HB2 SER 4 112.566 7.168 -14.384 24 HB3 SER 4 HB3 SER 4 112.788 6.071 -13.000 25 HG SER 4 HG SER 4 111.866 5.082 -14.946 26 H THR 5 H THR 5 109.683 5.867 -14.273 27 HA THR 5 HA THR 5 107.648 5.444 -12.091 28 HB THR 5 HB THR 5 107.558 4.948 -15.099 29 HG1 THR 5 HG1 THR 5 105.958 6.615 -14.926 30 HG21 THR 5 HG21 THR 5 105.061 4.538 -14.524 31 HG22 THR 5 HG22 THR 5 105.623 4.286 -12.855 32 HG23 THR 5 HG23 THR 5 106.210 3.229 -14.161 33 H TRP 6 H TRP 6 107.063 3.342 -11.448 34 HA TRP 6 HA TRP 6 108.512 1.034 -12.666 35 HB2 TRP 6 HB2 TRP 6 108.742 1.473 -9.679 36 HB3 TRP 6 HB3 TRP 6 109.681 0.379 -10.720 37 HD1 TRP 6 HD1 TRP 6 109.146 4.192 -10.234 38 HE1 TRP 6 HE1 TRP 6 111.360 5.408 -10.753 39 HE3 TRP 6 HE3 TRP 6 111.945 0.188 -11.706 40 HZ2 TRP 6 HZ2 TRP 6 114.000 4.710 -11.692 41 HZ3 TRP 6 HZ3 TRP 6 114.303 0.485 -12.399 42 HH2 TRP 6 HH2 TRP 6 115.335 2.740 -12.394 43 H LYS 7 H LYS 7 107.777 -1.058 -11.507 44 HA LYS 7 HA LYS 7 105.183 -0.764 -10.069 45 HB2 LYS 7 HB2 LYS 7 103.855 -1.940 -11.677 46 HB3 LYS 7 HB3 LYS 7 104.721 -0.686 -12.596 47 HG2 LYS 7 HG2 LYS 7 106.536 -2.514 -12.976 48 HG3 LYS 7 HG3 LYS 7 105.280 -3.665 -12.461 49 HD2 LYS 7 HD3 LYS 7 103.787 -2.909 -14.238 50 HD3 LYS 7 HD2 LYS 7 104.924 -1.617 -14.693 51 HE2 LYS 7 HE2 LYS 7 105.196 -3.489 -16.240 52 HE3 LYS 7 HE3 LYS 7 106.641 -3.384 -15.205 53 HZ1 LYS 7 HZ1 LYS 7 105.826 -5.641 -15.369 54 HZ2 LYS 7 HZ2 LYS 7 104.353 -5.199 -14.775 55 HZ3 LYS 7 HZ3 LYS 7 105.691 -5.101 -13.816 56 H VAL 8 H VAL 8 105.074 -2.339 -8.552 57 HA VAL 8 HA VAL 8 107.072 -4.121 -7.898 58 HB VAL 8 HB VAL 8 105.365 -4.203 -6.352 59 HG11 VAL 8 HG11 VAL 8 102.920 -4.558 -7.121 60 HG12 VAL 8 HG12 VAL 8 103.676 -2.992 -7.503 61 HG13 VAL 8 HG13 VAL 8 103.524 -4.239 -8.765 62 HG21 VAL 8 HG21 VAL 8 104.471 -6.412 -6.253 63 HG22 VAL 8 HG22 VAL 8 105.982 -6.574 -7.179 64 HG23 VAL 8 HG23 VAL 8 104.418 -6.556 -8.027 65 H ASP 9 H ASP 9 108.208 -5.313 -9.308 66 HA ASP 9 HA ASP 9 106.716 -6.884 -11.393 67 HB2 ASP 9 HB2 ASP 9 108.732 -5.504 -12.039 68 HB3 ASP 9 HB3 ASP 9 109.724 -6.546 -10.991 69 H ARG 10 H ARG 10 108.520 -7.168 -8.400 70 HA ARG 10 HA ARG 10 107.892 -10.109 -8.451 71 HB2 ARG 10 HB2 ARG 10 110.494 -9.477 -7.196 72 HB3 ARG 10 HB3 ARG 10 110.049 -10.809 -8.290 73 HG2 ARG 10 HG2 ARG 10 110.116 -9.221 -10.214 74 HG3 ARG 10 HG3 ARG 10 110.626 -7.924 -9.106 75 HD2 ARG 10 HD2 ARG 10 112.647 -8.771 -10.070 76 HD3 ARG 10 HD3 ARG 10 112.570 -9.475 -8.436 77 HE ARG 10 HE ARG 10 111.295 -11.384 -10.045 78 HH11 ARG 10 HH11 ARG 10 114.151 -12.880 -11.359 79 HH12 ARG 10 HH12 ARG 10 112.443 -13.063 -11.031 80 HH21 ARG 10 HH21 ARG 10 114.324 -9.664 -10.035 81 HH22 ARG 10 HH22 ARG 10 115.212 -10.964 -10.798 82 H SER 11 H SER 11 107.940 -11.083 -6.271 83 HA SER 11 HA SER 11 108.287 -9.547 -3.860 84 HB2 SER 11 HB3 SER 11 106.387 -8.203 -4.600 85 HB3 SER 11 HB2 SER 11 105.433 -9.669 -4.933 86 HG SER 11 HG SER 11 105.010 -9.849 -2.858 87 H GLU 12 H GLU 12 107.585 -10.810 -1.946 88 HA GLU 12 HA GLU 12 106.242 -13.388 -2.360 89 HB2 GLU 12 HB2 GLU 12 108.172 -14.839 -1.844 90 HB3 GLU 12 HB3 GLU 12 108.460 -13.919 -3.340 91 HG2 GLU 12 HG2 GLU 12 109.651 -12.181 -1.868 92 HG3 GLU 12 HG3 GLU 12 109.596 -13.395 -0.568 93 H ASN 13 H ASN 13 106.281 -14.714 -0.310 94 HA ASN 13 HA ASN 13 106.069 -14.859 2.036 95 HB2 ASN 13 HB2 ASN 13 108.400 -13.216 1.599 96 HB3 ASN 13 HB3 ASN 13 107.487 -12.554 2.975 97 HD21 ASN 13 HD21 ASN 13 107.940 -13.526 4.950 98 HD22 ASN 13 HD22 ASN 13 108.570 -15.146 5.139 99 H TYR 14 H TYR 14 105.076 -12.232 0.171 100 HA TYR 14 HA TYR 14 104.069 -10.323 1.978 101 HB2 TYR 14 HB2 TYR 14 103.727 -10.880 -0.718 102 HB3 TYR 14 HB3 TYR 14 102.088 -11.117 -0.069 103 HD1 TYR 14 HD1 TYR 14 104.836 -8.770 0.967 104 HD2 TYR 14 HD2 TYR 14 100.860 -9.196 -0.602 105 HE1 TYR 14 HE1 TYR 14 104.526 -6.311 1.081 106 HE2 TYR 14 HE2 TYR 14 100.550 -6.739 -0.486 107 HH TYR 14 HH TYR 14 101.939 -4.764 1.204 108 H ASP 15 H ASP 15 103.083 -13.662 1.623 109 HA ASP 15 HA ASP 15 100.459 -13.290 2.875 110 HB2 ASP 15 HB2 ASP 15 101.920 -15.891 3.176 111 HB3 ASP 15 HB3 ASP 15 100.237 -15.580 2.686 112 H LYS 16 H LYS 16 103.665 -14.386 4.071 113 HA LYS 16 HA LYS 16 102.846 -14.675 6.817 114 HB2 LYS 16 HB2 LYS 16 105.580 -13.642 5.999 115 HB3 LYS 16 HB3 LYS 16 105.157 -14.728 7.346 116 HG2 LYS 16 HG2 LYS 16 105.092 -15.368 4.366 117 HG3 LYS 16 HG3 LYS 16 106.161 -16.079 5.599 118 HD2 LYS 16 HD2 LYS 16 104.020 -16.869 6.785 119 HD3 LYS 16 HD3 LYS 16 103.155 -16.432 5.292 120 HE2 LYS 16 HE2 LYS 16 105.577 -18.276 5.330 121 HE3 LYS 16 HE3 LYS 16 103.903 -18.869 5.445 122 HZ1 LYS 16 HZ1 LYS 16 104.687 -18.849 3.171 123 HZ2 LYS 16 HZ2 LYS 16 104.996 -17.231 3.245 124 HZ3 LYS 16 HZ3 LYS 16 103.444 -17.779 3.350 125 H PHE 17 H PHE 17 103.899 -11.887 4.893 126 HA PHE 17 HA PHE 17 104.025 -10.016 7.119 127 HB2 PHE 17 HB2 PHE 17 104.977 -9.756 4.759 128 HB3 PHE 17 HB3 PHE 17 103.315 -9.427 4.218 129 HD1 PHE 17 HD1 PHE 17 105.833 -8.345 6.760 130 HD2 PHE 17 HD2 PHE 17 102.488 -7.233 4.315 131 HE1 PHE 17 HE1 PHE 17 106.105 -5.985 7.467 132 HE2 PHE 17 HE2 PHE 17 102.749 -4.871 5.029 133 HZ PHE 17 HZ PHE 17 104.560 -4.248 6.605 134 H MET 18 H MET 18 101.625 -10.268 4.481 135 HA MET 18 HA MET 18 99.635 -8.657 5.756 136 HB2 MET 18 HB2 MET 18 99.285 -10.998 3.830 137 HB3 MET 18 HB3 MET 18 98.023 -9.809 4.231 138 HG2 MET 18 HG3 MET 18 100.679 -8.737 3.347 139 HG3 MET 18 HG2 MET 18 99.662 -9.509 2.107 140 HE1 MET 18 HE1 MET 18 100.538 -6.894 4.316 141 HE2 MET 18 HE2 MET 18 99.343 -5.579 4.211 142 HE3 MET 18 HE3 MET 18 100.411 -5.922 2.830 143 H GLU 19 H GLU 19 100.623 -11.965 6.362 144 HA GLU 19 HA GLU 19 98.124 -12.607 7.827 145 HB2 GLU 19 HB2 GLU 19 99.262 -14.461 6.784 146 HB3 GLU 19 HB3 GLU 19 100.809 -14.016 7.544 147 HG2 GLU 19 HG3 GLU 19 99.565 -15.945 8.661 148 HG3 GLU 19 HG2 GLU 19 99.991 -14.593 9.738 149 H LYS 20 H LYS 20 101.250 -11.181 8.486 150 HA LYS 20 HA LYS 20 101.138 -11.668 11.382 151 HB2 LYS 20 HB2 LYS 20 103.146 -10.933 9.731 152 HB3 LYS 20 HB3 LYS 20 102.648 -9.320 10.294 153 HG2 LYS 20 HG2 LYS 20 104.224 -9.955 11.924 154 HG3 LYS 20 HG3 LYS 20 102.684 -10.429 12.681 155 HD2 LYS 20 HD2 LYS 20 102.985 -12.741 11.987 156 HD3 LYS 20 HD3 LYS 20 104.419 -12.311 11.024 157 HE2 LYS 20 HE3 LYS 20 104.334 -11.677 13.981 158 HE3 LYS 20 HE2 LYS 20 104.746 -13.319 13.432 159 HZ1 LYS 20 HZ1 LYS 20 106.758 -12.587 12.961 160 HZ2 LYS 20 HZ2 LYS 20 106.159 -11.485 11.890 161 HZ3 LYS 20 HZ3 LYS 20 106.376 -11.065 13.470 162 H MET 21 H MET 21 100.324 -8.921 9.220 163 HA MET 21 HA MET 21 99.543 -7.114 11.315 164 HB2 MET 21 HB2 MET 21 97.738 -6.751 9.127 165 HB3 MET 21 HB3 MET 21 99.201 -5.811 9.499 166 HG2 MET 21 HG3 MET 21 99.325 -8.468 8.027 167 HG3 MET 21 HG2 MET 21 99.090 -6.925 7.171 168 HE1 MET 21 HE1 MET 21 100.462 -4.827 7.876 169 HE2 MET 21 HE2 MET 21 101.040 -5.519 6.342 170 HE3 MET 21 HE3 MET 21 102.208 -4.941 7.554 171 H GLY 22 H GLY 22 98.186 -10.098 10.310 172 HA2 GLY 22 HA2 GLY 22 96.357 -11.235 11.347 173 HA3 GLY 22 HA3 GLY 22 95.984 -9.756 12.265 174 H VAL 23 H VAL 23 96.417 -9.742 8.765 175 HA VAL 23 HA VAL 23 93.703 -8.612 8.456 176 HB VAL 23 HB VAL 23 95.442 -9.513 6.152 177 HG11 VAL 23 HG11 VAL 23 93.673 -7.084 6.685 178 HG12 VAL 23 HG12 VAL 23 94.541 -7.415 5.167 179 HG13 VAL 23 HG13 VAL 23 93.234 -8.500 5.700 180 HG21 VAL 23 HG21 VAL 23 96.490 -7.131 6.432 181 HG22 VAL 23 HG22 VAL 23 97.114 -8.455 7.445 182 HG23 VAL 23 HG23 VAL 23 95.969 -7.276 8.128 183 H ASN 24 H ASN 24 91.909 -9.631 7.560 184 HA ASN 24 HA ASN 24 91.453 -12.363 7.934 185 HB2 ASN 24 HB3 ASN 24 90.366 -10.444 5.848 186 HB3 ASN 24 HB2 ASN 24 89.803 -12.130 5.941 187 HD21 ASN 24 HD21 ASN 24 90.752 -9.959 8.669 188 HD22 ASN 24 HD22 ASN 24 89.177 -9.988 9.431 189 H ILE 25 H ILE 25 91.143 -14.092 6.168 190 HA ILE 25 HA ILE 25 93.737 -14.374 4.779 191 HB ILE 25 HB ILE 25 91.295 -16.079 5.218 192 HG12 ILE 25 HG13 ILE 25 93.473 -15.911 6.661 193 HG13 ILE 25 HG12 ILE 25 92.830 -17.523 6.272 194 HG21 ILE 25 HG21 ILE 25 92.331 -17.797 3.666 195 HG22 ILE 25 HG22 ILE 25 93.390 -16.506 3.049 196 HG23 ILE 25 HG23 ILE 25 91.627 -16.386 2.840 197 HD11 ILE 25 HD11 ILE 25 95.390 -17.060 5.916 198 HD12 ILE 25 HD12 ILE 25 94.857 -16.208 4.448 199 HD13 ILE 25 HD13 ILE 25 94.491 -17.938 4.655 200 H VAL 26 H VAL 26 90.978 -12.741 4.115 201 HA VAL 26 HA VAL 26 90.782 -13.367 1.227 202 HB VAL 26 HB VAL 26 89.589 -11.098 2.884 203 HG11 VAL 26 HG11 VAL 26 89.740 -10.570 0.466 204 HG12 VAL 26 HG12 VAL 26 88.051 -10.844 0.957 205 HG13 VAL 26 HG13 VAL 26 88.940 -12.112 0.080 206 HG21 VAL 26 HG21 VAL 26 88.841 -13.357 3.586 207 HG22 VAL 26 HG22 VAL 26 87.526 -12.471 2.777 208 HG23 VAL 26 HG23 VAL 26 88.415 -13.739 1.900 209 H LYS 27 H LYS 27 91.609 -10.386 3.070 210 HA LYS 27 HA LYS 27 92.758 -9.052 0.778 211 HB2 LYS 27 HB3 LYS 27 92.311 -8.467 3.519 212 HB3 LYS 27 HB2 LYS 27 94.065 -8.295 3.272 213 HG2 LYS 27 HG2 LYS 27 93.158 -6.154 2.738 214 HG3 LYS 27 HG3 LYS 27 93.463 -6.927 1.164 215 HD2 LYS 27 HD2 LYS 27 90.980 -7.799 1.445 216 HD3 LYS 27 HD3 LYS 27 90.839 -6.432 2.575 217 HE2 LYS 27 HE3 LYS 27 91.388 -6.406 -0.396 218 HE3 LYS 27 HE2 LYS 27 90.232 -5.432 0.544 219 HZ1 LYS 27 HZ1 LYS 27 91.952 -3.983 0.094 220 HZ2 LYS 27 HZ2 LYS 27 93.138 -5.107 0.317 221 HZ3 LYS 27 HZ3 LYS 27 92.329 -4.492 1.616 222 H ARG 28 H ARG 28 93.941 -11.523 2.944 223 HA ARG 28 HA ARG 28 96.787 -11.100 2.368 224 HB2 ARG 28 HB3 ARG 28 96.069 -12.322 4.378 225 HB3 ARG 28 HB2 ARG 28 95.259 -13.545 3.372 226 HG2 ARG 28 HG2 ARG 28 97.418 -14.189 2.376 227 HG3 ARG 28 HG3 ARG 28 98.247 -12.927 3.318 228 HD2 ARG 28 HD3 ARG 28 97.304 -14.063 5.415 229 HD3 ARG 28 HD2 ARG 28 96.840 -15.418 4.358 230 HE ARG 28 HE ARG 28 99.695 -14.563 4.204 231 HH11 ARG 28 HH11 ARG 28 101.142 -16.204 4.774 232 HH12 ARG 28 HH12 ARG 28 100.551 -17.671 5.522 233 HH21 ARG 28 HH21 ARG 28 97.220 -16.659 5.478 234 HH22 ARG 28 HH22 ARG 28 98.342 -17.928 5.919 235 H LYS 29 H LYS 29 94.279 -13.371 1.142 236 HA LYS 29 HA LYS 29 96.089 -14.611 -0.782 237 HB2 LYS 29 HB2 LYS 29 93.093 -14.515 -0.392 238 HB3 LYS 29 HB3 LYS 29 93.769 -15.203 -1.888 239 HG2 LYS 29 HG3 LYS 29 95.187 -16.731 -0.514 240 HG3 LYS 29 HG2 LYS 29 94.435 -16.074 0.959 241 HD2 LYS 29 HD2 LYS 29 92.359 -17.050 0.496 242 HD3 LYS 29 HD3 LYS 29 92.678 -17.143 -1.253 243 HE2 LYS 29 HE3 LYS 29 94.379 -18.724 0.688 244 HE3 LYS 29 HE2 LYS 29 92.786 -19.342 0.187 245 HZ1 LYS 29 HZ1 LYS 29 94.538 -20.117 -1.266 246 HZ2 LYS 29 HZ2 LYS 29 93.500 -19.142 -2.099 247 HZ3 LYS 29 HZ3 LYS 29 94.976 -18.570 -1.636 248 H LEU 30 H LEU 30 93.942 -11.787 -0.858 249 HA LEU 30 HA LEU 30 94.381 -11.458 -3.784 250 HB2 LEU 30 HB3 LEU 30 92.932 -9.748 -1.721 251 HB3 LEU 30 HB2 LEU 30 93.029 -9.357 -3.455 252 HG LEU 30 HG LEU 30 92.093 -12.103 -2.630 253 HD11 LEU 30 HD11 LEU 30 90.787 -10.536 -1.219 254 HD12 LEU 30 HD12 LEU 30 89.768 -11.252 -2.490 255 HD13 LEU 30 HD13 LEU 30 90.367 -9.585 -2.664 256 HD21 LEU 30 HD21 LEU 30 92.487 -11.543 -5.015 257 HD22 LEU 30 HD22 LEU 30 91.360 -10.172 -4.878 258 HD23 LEU 30 HD23 LEU 30 90.759 -11.839 -4.705 259 H ALA 31 H ALA 31 95.939 -10.666 -0.913 260 HA ALA 31 HA ALA 31 97.117 -8.116 -1.806 261 HB1 ALA 31 HB1 ALA 31 98.772 -8.800 0.157 262 HB2 ALA 31 HB2 ALA 31 97.110 -8.279 0.521 263 HB3 ALA 31 HB3 ALA 31 97.516 -10.012 0.506 264 H ALA 32 H ALA 32 98.398 -11.463 -1.388 265 HA ALA 32 HA ALA 32 101.012 -11.138 -2.276 266 HB1 ALA 32 HB1 ALA 32 100.865 -13.408 -3.263 267 HB2 ALA 32 HB2 ALA 32 99.088 -13.313 -3.214 268 HB3 ALA 32 HB3 ALA 32 100.020 -13.334 -1.698 269 H HIS 33 H HIS 33 98.080 -10.794 -4.202 270 HA HIS 33 HA HIS 33 99.488 -10.840 -6.784 271 HB2 HIS 33 HB2 HIS 33 96.796 -9.578 -6.109 272 HB3 HIS 33 HB3 HIS 33 97.372 -10.084 -7.715 273 HD2 HIS 33 HD2 HIS 33 98.572 -13.004 -6.010 274 HE1 HIS 33 HE1 HIS 33 94.427 -13.804 -6.140 275 HE2 HIS 33 HE2 HIS 33 96.725 -14.854 -5.763 276 H ASP 34 H ASP 34 100.938 -9.172 -5.091 277 HA ASP 34 HA ASP 34 100.164 -6.378 -5.309 278 HB2 ASP 34 HB3 ASP 34 102.698 -6.024 -4.923 279 HB3 ASP 34 HB2 ASP 34 101.801 -6.904 -3.662 280 H ASN 35 H ASN 35 99.940 -5.306 -7.191 281 HA ASN 35 HA ASN 35 102.122 -5.542 -9.228 282 HB2 ASN 35 HB3 ASN 35 99.222 -6.299 -9.656 283 HB3 ASN 35 HB2 ASN 35 100.175 -5.621 -10.998 284 HD21 ASN 35 HD21 ASN 35 102.486 -6.745 -11.203 285 HD22 ASN 35 HD22 ASN 35 102.470 -8.487 -11.045 286 H LEU 36 H LEU 36 101.585 -3.426 -7.441 287 HA LEU 36 HA LEU 36 99.918 -1.461 -8.940 288 HB2 LEU 36 HB2 LEU 36 100.219 -0.010 -7.037 289 HB3 LEU 36 HB3 LEU 36 99.900 -1.644 -6.412 290 HG LEU 36 HG LEU 36 102.771 -0.974 -6.893 291 HD11 LEU 36 HD11 LEU 36 101.919 1.155 -5.947 292 HD12 LEU 36 HD12 LEU 36 101.171 0.257 -4.605 293 HD13 LEU 36 HD13 LEU 36 102.943 0.296 -4.771 294 HD21 LEU 36 HD21 LEU 36 101.594 -2.019 -4.325 295 HD22 LEU 36 HD22 LEU 36 103.105 -2.476 -5.147 296 HD23 LEU 36 HD23 LEU 36 101.542 -3.063 -5.766 297 H LYS 37 H LYS 37 100.780 0.737 -9.317 298 HA LYS 37 HA LYS 37 103.614 0.592 -10.363 299 HB2 LYS 37 HB2 LYS 37 101.133 1.451 -11.535 300 HB3 LYS 37 HB3 LYS 37 102.157 2.891 -11.330 301 HG2 LYS 37 HG2 LYS 37 104.052 1.447 -12.368 302 HG3 LYS 37 HG3 LYS 37 102.748 0.352 -12.886 303 HD2 LYS 37 HD2 LYS 37 101.624 2.247 -14.036 304 HD3 LYS 37 HD3 LYS 37 102.944 3.329 -13.532 305 HE2 LYS 37 HE2 LYS 37 103.565 2.694 -15.725 306 HE3 LYS 37 HE3 LYS 37 104.510 1.591 -14.696 307 HZ1 LYS 37 HZ1 LYS 37 103.387 0.414 -16.468 308 HZ2 LYS 37 HZ2 LYS 37 102.792 -0.063 -15.006 309 HZ3 LYS 37 HZ3 LYS 37 101.917 0.960 -15.959 310 H LEU 38 H LEU 38 105.018 2.404 -9.904 311 HA LEU 38 HA LEU 38 103.914 4.434 -7.981 312 HB2 LEU 38 HB2 LEU 38 106.560 3.145 -7.323 313 HB3 LEU 38 HB3 LEU 38 105.403 3.961 -6.247 314 HG LEU 38 HG LEU 38 103.796 2.007 -6.781 315 HD11 LEU 38 HD11 LEU 38 105.784 0.018 -7.178 316 HD12 LEU 38 HD12 LEU 38 104.511 0.511 -8.320 317 HD13 LEU 38 HD13 LEU 38 106.114 1.282 -8.387 318 HD21 LEU 38 HD21 LEU 38 104.538 1.852 -4.609 319 HD22 LEU 38 HD22 LEU 38 106.248 2.027 -5.071 320 HD23 LEU 38 HD23 LEU 38 105.432 0.457 -5.260 321 H THR 39 H THR 39 104.613 6.420 -8.543 322 HA THR 39 HA THR 39 107.036 6.593 -10.338 323 HB THR 39 HB THR 39 105.130 8.872 -9.731 324 HG1 THR 39 HG1 THR 39 103.923 8.115 -11.559 325 HG21 THR 39 HG21 THR 39 105.809 9.556 -12.015 326 HG22 THR 39 HG22 THR 39 106.798 8.083 -12.162 327 HG23 THR 39 HG23 THR 39 107.230 9.329 -10.967 328 H ILE 40 H ILE 40 108.882 6.963 -9.171 329 HA ILE 40 HA ILE 40 108.582 8.658 -6.684 330 HB ILE 40 HB ILE 40 110.778 6.688 -7.446 331 HG12 ILE 40 HG12 ILE 40 109.727 5.472 -5.415 332 HG13 ILE 40 HG13 ILE 40 108.326 6.542 -5.656 333 HG21 ILE 40 HG21 ILE 40 111.208 7.011 -4.882 334 HG22 ILE 40 HG22 ILE 40 111.789 8.264 -6.006 335 HG23 ILE 40 HG23 ILE 40 110.289 8.523 -5.083 336 HD11 ILE 40 HD11 ILE 40 108.701 4.116 -6.931 337 HD12 ILE 40 HD12 ILE 40 107.649 5.424 -7.523 338 HD13 ILE 40 HD13 ILE 40 109.311 5.268 -8.143 339 H THR 41 H THR 41 109.844 10.427 -6.354 340 HA THR 41 HA THR 41 111.889 11.107 -8.461 341 HB THR 41 HB THR 41 110.118 13.248 -7.281 342 HG1 THR 41 HG1 THR 41 108.585 11.908 -8.140 343 HG21 THR 41 HG21 THR 41 110.639 14.334 -9.446 344 HG22 THR 41 HG22 THR 41 111.524 12.879 -9.962 345 HG23 THR 41 HG23 THR 41 112.127 13.851 -8.598 346 H GLN 42 H GLN 42 113.588 12.503 -7.610 347 HA GLN 42 HA GLN 42 113.485 12.836 -4.610 348 HB2 GLN 42 HB3 GLN 42 114.782 10.838 -4.881 349 HB3 GLN 42 HB2 GLN 42 115.668 11.515 -6.268 350 HG2 GLN 42 HG2 GLN 42 115.798 12.970 -3.636 351 HG3 GLN 42 HG3 GLN 42 116.752 11.480 -3.827 352 HE21 GLN 42 HE21 GLN 42 116.266 13.016 -6.862 353 HE22 GLN 42 HE22 GLN 42 117.804 13.844 -6.950 354 H GLU 43 H GLU 43 114.510 14.689 -3.846 355 HA GLU 43 HA GLU 43 116.091 16.299 -5.831 356 HB2 GLU 43 HB2 GLU 43 113.492 17.087 -4.518 357 HB3 GLU 43 HB3 GLU 43 114.731 18.334 -4.797 358 HG2 GLU 43 HG2 GLU 43 113.971 16.437 -7.026 359 HG3 GLU 43 HG3 GLU 43 112.943 17.847 -6.671 360 H GLY 44 H GLY 44 117.799 15.480 -4.366 361 HA2 GLY 44 HA2 GLY 44 119.243 15.742 -2.515 362 HA3 GLY 44 HA3 GLY 44 118.683 17.430 -2.504 363 H ASN 45 H ASN 45 116.906 18.008 -1.134 364 HA ASN 45 HA ASN 45 116.421 15.971 1.051 365 HB2 ASN 45 HB2 ASN 45 115.762 18.666 1.867 366 HB3 ASN 45 HB3 ASN 45 116.992 17.568 2.537 367 HD21 ASN 45 HD21 ASN 45 116.633 20.583 1.102 368 HD22 ASN 45 HD22 ASN 45 118.237 20.750 0.424 369 H LYS 46 H LYS 46 114.886 16.343 -1.486 370 HA LYS 46 HA LYS 46 112.229 16.679 -0.152 371 HB2 LYS 46 HB2 LYS 46 113.253 18.246 -2.543 372 HB3 LYS 46 HB3 LYS 46 111.515 17.919 -2.340 373 HG2 LYS 46 HG2 LYS 46 111.426 19.718 -0.967 374 HG3 LYS 46 HG3 LYS 46 112.404 18.794 0.198 375 HD2 LYS 46 HD3 LYS 46 114.475 19.640 -0.842 376 HD3 LYS 46 HD2 LYS 46 113.521 20.523 -2.057 377 HE2 LYS 46 HE2 LYS 46 114.348 21.877 -0.020 378 HE3 LYS 46 HE3 LYS 46 112.619 22.010 -0.422 379 HZ1 LYS 46 HZ1 LYS 46 113.337 21.511 1.984 380 HZ2 LYS 46 HZ2 LYS 46 113.516 19.959 1.457 381 HZ3 LYS 46 HZ3 LYS 46 112.048 20.702 1.348 382 H PHE 47 H PHE 47 111.434 14.730 -0.451 383 HA PHE 47 HA PHE 47 111.976 13.314 -3.058 384 HB2 PHE 47 HB2 PHE 47 111.456 12.461 -0.234 385 HB3 PHE 47 HB3 PHE 47 110.757 11.439 -1.512 386 HD1 PHE 47 HD1 PHE 47 113.944 13.006 -0.337 387 HD2 PHE 47 HD2 PHE 47 112.123 9.973 -2.775 388 HE1 PHE 47 HE1 PHE 47 116.172 11.994 -0.744 389 HE2 PHE 47 HE2 PHE 47 114.351 8.964 -3.183 390 HZ PHE 47 HZ PHE 47 116.374 9.971 -2.164 391 H THR 48 H THR 48 110.106 12.099 -3.984 392 HA THR 48 HA THR 48 107.418 13.020 -3.108 393 HB THR 48 HB THR 48 108.432 13.587 -5.930 394 HG1 THR 48 HG1 THR 48 109.211 15.340 -5.057 395 HG21 THR 48 HG21 THR 48 106.304 14.845 -6.123 396 HG22 THR 48 HG22 THR 48 106.004 13.133 -5.741 397 HG23 THR 48 HG23 THR 48 105.870 14.366 -4.464 398 H VAL 49 H VAL 49 106.693 10.949 -2.889 399 HA VAL 49 HA VAL 49 107.140 9.082 -5.219 400 HB VAL 49 HB VAL 49 107.941 8.060 -3.226 401 HG11 VAL 49 HG11 VAL 49 106.228 7.927 -1.220 402 HG12 VAL 49 HG12 VAL 49 107.203 9.398 -1.452 403 HG13 VAL 49 HG13 VAL 49 105.508 9.359 -1.994 404 HG21 VAL 49 HG21 VAL 49 106.623 6.123 -3.114 405 HG22 VAL 49 HG22 VAL 49 105.098 7.035 -3.214 406 HG23 VAL 49 HG23 VAL 49 106.107 6.827 -4.665 407 H LYS 50 H LYS 50 105.430 8.537 -6.467 408 HA LYS 50 HA LYS 50 102.685 9.244 -5.399 409 HB2 LYS 50 HB2 LYS 50 103.752 10.548 -7.436 410 HB3 LYS 50 HB3 LYS 50 103.319 9.082 -8.349 411 HG2 LYS 50 HG2 LYS 50 100.975 9.292 -7.606 412 HG3 LYS 50 HG3 LYS 50 101.396 10.730 -6.646 413 HD2 LYS 50 HD2 LYS 50 101.715 10.473 -9.670 414 HD3 LYS 50 HD3 LYS 50 100.403 11.349 -8.845 415 HE2 LYS 50 HE2 LYS 50 102.443 12.558 -7.622 416 HE3 LYS 50 HE3 LYS 50 103.324 12.048 -9.082 417 HZ1 LYS 50 HZ1 LYS 50 102.320 14.215 -9.359 418 HZ2 LYS 50 HZ2 LYS 50 101.635 13.136 -10.401 419 HZ3 LYS 50 HZ3 LYS 50 100.818 13.608 -9.048 420 H GLU 51 H GLU 51 102.015 7.227 -4.677 421 HA GLU 51 HA GLU 51 102.590 4.785 -6.210 422 HB2 GLU 51 HB2 GLU 51 100.674 5.403 -3.921 423 HB3 GLU 51 HB3 GLU 51 100.872 3.779 -4.622 424 HG2 GLU 51 HG2 GLU 51 103.149 3.641 -3.937 425 HG3 GLU 51 HG3 GLU 51 103.248 5.392 -3.630 426 H SER 52 H SER 52 100.854 3.429 -7.195 427 HA SER 52 HA SER 52 98.310 4.770 -7.852 428 HB2 SER 52 HB2 SER 52 100.094 4.089 -10.204 429 HB3 SER 52 HB3 SER 52 98.646 5.124 -10.160 430 HG SER 52 HG SER 52 100.804 6.207 -10.203 431 H SER 53 H SER 53 97.113 3.077 -7.350 432 HA SER 53 HA SER 53 97.668 0.495 -8.813 433 HB2 SER 53 HB2 SER 53 96.265 -0.220 -6.505 434 HB3 SER 53 HB3 SER 53 98.014 -0.433 -6.760 435 HG SER 53 HG SER 53 97.412 0.800 -4.829 436 H ALA 54 H ALA 54 95.791 -0.505 -9.644 437 HA ALA 54 HA ALA 54 93.578 1.215 -10.269 438 HB1 ALA 54 HB1 ALA 54 92.433 -0.859 -11.004 439 HB2 ALA 54 HB2 ALA 54 94.126 -0.835 -11.552 440 HB3 ALA 54 HB3 ALA 54 93.657 -1.835 -10.157 441 H PHE 55 H PHE 55 94.407 0.367 -7.258 442 HA PHE 55 HA PHE 55 91.540 -0.068 -6.402 443 HB2 PHE 55 HB2 PHE 55 93.871 -0.628 -4.580 444 HB3 PHE 55 HB3 PHE 55 92.275 -1.414 -4.655 445 HD1 PHE 55 HD1 PHE 55 92.017 -2.043 -7.517 446 HD2 PHE 55 HD2 PHE 55 95.438 -2.347 -4.937 447 HE1 PHE 55 HE1 PHE 55 92.960 -3.813 -8.976 448 HE2 PHE 55 HE2 PHE 55 96.379 -4.120 -6.395 449 HZ PHE 55 HZ PHE 55 95.140 -4.853 -8.413 450 H ARG 56 H ARG 56 94.311 2.092 -6.166 451 HA ARG 56 HA ARG 56 92.876 4.243 -5.075 452 HB2 ARG 56 HB2 ARG 56 93.800 4.017 -2.597 453 HB3 ARG 56 HB3 ARG 56 92.266 3.240 -3.052 454 HG2 ARG 56 HG3 ARG 56 93.130 1.133 -2.846 455 HG3 ARG 56 HG2 ARG 56 94.687 1.597 -3.574 456 HD2 ARG 56 HD2 ARG 56 94.853 0.950 -1.137 457 HD3 ARG 56 HD3 ARG 56 95.433 2.597 -1.485 458 HE ARG 56 HE ARG 56 92.577 2.413 -0.671 459 HH11 ARG 56 HH11 ARG 56 92.121 3.493 1.262 460 HH12 ARG 56 HH12 ARG 56 93.428 4.047 2.284 461 HH21 ARG 56 HH21 ARG 56 95.926 2.844 0.176 462 HH22 ARG 56 HH22 ARG 56 95.574 3.680 1.672 463 H ASN 57 H ASN 57 94.471 5.156 -6.486 464 HA ASN 57 HA ASN 57 97.316 4.872 -6.068 465 HB2 ASN 57 HB3 ASN 57 95.872 7.329 -7.151 466 HB3 ASN 57 HB2 ASN 57 97.541 6.817 -7.497 467 HD21 ASN 57 HD21 ASN 57 96.074 7.144 -9.754 468 HD22 ASN 57 HD22 ASN 57 95.534 5.610 -10.397 469 H ILE 58 H ILE 58 98.805 6.255 -4.976 470 HA ILE 58 HA ILE 58 97.558 8.199 -3.038 471 HB ILE 58 HB ILE 58 99.822 6.446 -2.125 472 HG12 ILE 58 HG12 ILE 58 96.917 5.648 -2.440 473 HG13 ILE 58 HG13 ILE 58 98.383 4.711 -2.820 474 HG21 ILE 58 HG21 ILE 58 98.726 8.516 -0.924 475 HG22 ILE 58 HG22 ILE 58 97.408 7.379 -0.553 476 HG23 ILE 58 HG23 ILE 58 99.060 7.044 0.020 477 HD11 ILE 58 HD11 ILE 58 97.676 3.747 -0.794 478 HD12 ILE 58 HD12 ILE 58 98.882 4.939 -0.253 479 HD13 ILE 58 HD13 ILE 58 97.145 5.309 -0.125 480 H GLU 59 H GLU 59 99.413 9.408 -1.865 481 HA GLU 59 HA GLU 59 101.874 9.707 -3.511 482 HB2 GLU 59 HB2 GLU 59 101.513 11.941 -4.208 483 HB3 GLU 59 HB3 GLU 59 99.960 11.138 -4.540 484 HG2 GLU 59 HG2 GLU 59 99.435 11.907 -2.032 485 HG3 GLU 59 HG3 GLU 59 100.668 13.136 -2.404 486 H CYS 60 H CYS 60 103.544 10.734 -2.359 487 HA CYS 60 HA CYS 60 102.889 11.949 0.291 488 HB2 CYS 60 HB3 CYS 60 104.309 9.307 -0.089 489 HB3 CYS 60 HB2 CYS 60 104.777 10.371 1.259 490 HG CYS 60 HG CYS 60 101.780 10.596 1.847 491 H VAL 61 H VAL 61 103.988 13.846 0.067 492 HA VAL 61 HA VAL 61 106.743 13.713 -1.173 493 HB VAL 61 HB VAL 61 105.447 16.345 -0.627 494 HG11 VAL 61 HG11 VAL 61 106.315 16.736 -2.969 495 HG12 VAL 61 HG12 VAL 61 106.928 15.065 -2.961 496 HG13 VAL 61 HG13 VAL 61 107.569 16.253 -1.801 497 HG21 VAL 61 HG21 VAL 61 104.108 16.058 -2.804 498 HG22 VAL 61 HG22 VAL 61 104.351 14.307 -2.600 499 HG23 VAL 61 HG23 VAL 61 103.461 15.232 -1.366 500 H PHE 62 H PHE 62 108.518 14.470 0.028 501 HA PHE 62 HA PHE 62 108.329 16.163 2.326 502 HB2 PHE 62 HB2 PHE 62 107.583 13.349 2.816 503 HB3 PHE 62 HB3 PHE 62 108.881 13.931 3.886 504 HD1 PHE 62 HD1 PHE 62 105.456 13.577 3.719 505 HD2 PHE 62 HD2 PHE 62 108.404 16.581 4.573 506 HE1 PHE 62 HE1 PHE 62 103.789 14.831 5.060 507 HE2 PHE 62 HE2 PHE 62 106.737 17.837 5.913 508 HZ PHE 62 HZ PHE 62 104.428 16.962 6.156 509 H GLU 63 H GLU 63 110.305 15.899 3.817 510 HA GLU 63 HA GLU 63 112.656 15.229 2.062 511 HB2 GLU 63 HB2 GLU 63 112.631 17.481 3.058 512 HB3 GLU 63 HB3 GLU 63 112.429 16.782 4.683 513 HG2 GLU 63 HG3 GLU 63 114.614 15.779 4.620 514 HG3 GLU 63 HG2 GLU 63 114.789 16.111 2.880 515 H LEU 64 H LEU 64 114.546 14.133 3.232 516 HA LEU 64 HA LEU 64 113.437 11.815 4.716 517 HB2 LEU 64 HB3 LEU 64 115.610 10.835 4.484 518 HB3 LEU 64 HB2 LEU 64 115.300 11.701 2.961 519 HG LEU 64 HG LEU 64 116.475 13.702 4.352 520 HD11 LEU 64 HD11 LEU 64 116.816 12.297 6.372 521 HD12 LEU 64 HD12 LEU 64 118.373 12.775 5.655 522 HD13 LEU 64 HD13 LEU 64 117.744 11.129 5.402 523 HD21 LEU 64 HD21 LEU 64 118.575 13.074 3.186 524 HD22 LEU 64 HD22 LEU 64 117.940 11.432 2.928 525 HD23 LEU 64 HD23 LEU 64 117.160 12.822 2.136 526 H GLY 65 H GLY 65 113.443 11.557 6.898 527 HA2 GLY 65 HA2 GLY 65 114.709 11.840 9.046 528 HA3 GLY 65 HA3 GLY 65 115.162 13.470 8.496 529 H VAL 66 H VAL 66 112.447 14.044 7.419 530 HA VAL 66 HA VAL 66 111.247 14.818 10.041 531 HB VAL 66 HB VAL 66 111.407 16.497 8.235 532 HG11 VAL 66 HG11 VAL 66 110.619 16.172 6.094 533 HG12 VAL 66 HG12 VAL 66 110.909 14.465 6.507 534 HG13 VAL 66 HG13 VAL 66 109.269 15.145 6.634 535 HG21 VAL 66 HG21 VAL 66 109.034 17.225 8.261 536 HG22 VAL 66 HG22 VAL 66 108.545 15.604 8.810 537 HG23 VAL 66 HG23 VAL 66 109.543 16.636 9.862 538 H THR 67 H THR 67 109.824 13.476 11.011 539 HA THR 67 HA THR 67 108.693 11.142 9.818 540 HB THR 67 HB THR 67 107.147 12.635 11.925 541 HG1 THR 67 HG1 THR 67 109.209 13.014 12.633 542 HG21 THR 67 HG21 THR 67 106.636 10.495 12.702 543 HG22 THR 67 HG22 THR 67 106.817 10.184 10.959 544 HG23 THR 67 HG23 THR 67 108.147 9.793 12.076 545 H PHE 68 H PHE 68 106.765 10.694 8.864 546 HA PHE 68 HA PHE 68 104.745 12.837 8.487 547 HB2 PHE 68 HB2 PHE 68 104.853 12.099 5.897 548 HB3 PHE 68 HB3 PHE 68 105.780 13.482 6.524 549 HD1 PHE 68 HD1 PHE 68 106.115 9.729 6.288 550 HD2 PHE 68 HD2 PHE 68 108.018 13.567 5.981 551 HE1 PHE 68 HE1 PHE 68 108.235 8.628 5.608 552 HE2 PHE 68 HE2 PHE 68 110.132 12.465 5.309 553 HZ PHE 68 HZ PHE 68 110.240 9.998 5.119 554 H ASN 69 H ASN 69 103.132 11.626 6.631 555 HA ASN 69 HA ASN 69 102.876 8.809 7.687 556 HB2 ASN 69 HB2 ASN 69 100.525 9.082 8.031 557 HB3 ASN 69 HB3 ASN 69 101.284 10.510 8.775 558 HD21 ASN 69 HD21 ASN 69 101.744 12.262 6.741 559 HD22 ASN 69 HD22 ASN 69 100.272 12.623 5.868 560 H CYS 70 H CYS 70 101.903 7.323 6.256 561 HA CYS 70 HA CYS 70 101.081 8.257 3.558 562 HB2 CYS 70 HB3 CYS 70 103.742 7.832 3.797 563 HB3 CYS 70 HB2 CYS 70 103.217 6.151 3.531 564 HG CYS 70 HG CYS 70 102.832 6.393 0.936 565 H ASN 71 H ASN 71 99.533 6.857 2.781 566 HA ASN 71 HA ASN 71 98.923 4.530 4.543 567 HB2 ASN 71 HB3 ASN 71 97.327 5.179 2.075 568 HB3 ASN 71 HB2 ASN 71 96.773 4.607 3.667 569 HD21 ASN 71 HD21 ASN 71 96.189 7.153 1.880 570 HD22 ASN 71 HD22 ASN 71 96.322 8.457 3.039 571 H LEU 72 H LEU 72 98.762 2.373 3.796 572 HA LEU 72 HA LEU 72 100.476 1.856 1.375 573 HB2 LEU 72 HB2 LEU 72 99.602 0.143 3.734 574 HB3 LEU 72 HB3 LEU 72 100.405 -0.542 2.301 575 HG LEU 72 HG LEU 72 101.577 1.803 3.840 576 HD11 LEU 72 HD11 LEU 72 102.287 -1.135 4.214 577 HD12 LEU 72 HD12 LEU 72 102.901 0.258 5.136 578 HD13 LEU 72 HD13 LEU 72 101.203 -0.246 5.310 579 HD21 LEU 72 HD21 LEU 72 102.423 1.371 1.547 580 HD22 LEU 72 HD22 LEU 72 102.770 -0.317 1.994 581 HD23 LEU 72 HD23 LEU 72 103.668 1.011 2.767 582 H ALA 73 H ALA 73 99.739 0.539 -0.326 583 HA ALA 73 HA ALA 73 97.121 0.803 -1.247 584 HB1 ALA 73 HB1 ALA 73 97.512 -1.226 -2.617 585 HB2 ALA 73 HB2 ALA 73 98.958 -0.189 -2.578 586 HB3 ALA 73 HB3 ALA 73 98.890 -1.660 -1.578 587 H ASP 74 H ASP 74 98.308 -1.545 1.138 588 HA ASP 74 HA ASP 74 95.919 -3.197 1.143 589 HB2 ASP 74 HB3 ASP 74 97.538 -2.716 3.647 590 HB3 ASP 74 HB2 ASP 74 96.844 -4.232 3.026 591 H GLY 75 H GLY 75 95.893 -0.030 1.494 592 HA2 GLY 75 HA2 GLY 75 94.295 1.420 2.473 593 HA3 GLY 75 HA3 GLY 75 93.421 -0.019 3.052 594 H THR 76 H THR 76 96.825 0.474 3.801 595 HA THR 76 HA THR 76 96.030 0.725 6.688 596 HB THR 76 HB THR 76 98.900 0.480 6.004 597 HG1 THR 76 HG1 THR 76 98.088 -0.827 4.364 598 HG21 THR 76 HG21 THR 76 98.764 -1.265 7.757 599 HG22 THR 76 HG22 THR 76 96.990 -1.119 7.763 600 HG23 THR 76 HG23 THR 76 97.997 0.248 8.296 601 H GLU 77 H GLU 77 97.319 2.223 8.031 602 HA GLU 77 HA GLU 77 98.339 4.597 6.466 603 HB2 GLU 77 HB2 GLU 77 95.991 4.981 7.321 604 HB3 GLU 77 HB3 GLU 77 96.609 4.747 8.974 605 HG2 GLU 77 HG2 GLU 77 98.238 6.607 8.589 606 HG3 GLU 77 HG3 GLU 77 97.516 6.873 6.984 607 H LEU 78 H LEU 78 100.451 4.921 7.060 608 HA LEU 78 HA LEU 78 101.112 4.436 9.971 609 HB2 LEU 78 HB2 LEU 78 103.159 3.726 7.889 610 HB3 LEU 78 HB3 LEU 78 102.910 3.048 9.516 611 HG LEU 78 HG LEU 78 100.614 2.214 8.468 612 HD11 LEU 78 HD11 LEU 78 101.168 3.491 6.302 613 HD12 LEU 78 HD12 LEU 78 102.404 2.246 6.007 614 HD13 LEU 78 HD13 LEU 78 100.687 1.789 6.109 615 HD21 LEU 78 HD21 LEU 78 103.224 0.874 7.645 616 HD22 LEU 78 HD22 LEU 78 102.613 0.866 9.316 617 HD23 LEU 78 HD23 LEU 78 101.670 0.091 8.020 618 H ARG 79 H ARG 79 103.168 5.486 10.636 619 HA ARG 79 HA ARG 79 104.017 7.734 8.827 620 HB2 ARG 79 HB2 ARG 79 103.848 9.337 10.750 621 HB3 ARG 79 HB3 ARG 79 102.264 8.716 10.227 622 HG2 ARG 79 HG2 ARG 79 102.494 6.930 12.034 623 HG3 ARG 79 HG3 ARG 79 103.907 7.830 12.634 624 HD2 ARG 79 HD2 ARG 79 101.105 8.992 12.293 625 HD3 ARG 79 HD3 ARG 79 101.809 8.456 13.838 626 HE ARG 79 HE ARG 79 103.275 10.374 13.818 627 HH11 ARG 79 HH11 ARG 79 103.704 12.453 13.049 628 HH12 ARG 79 HH12 ARG 79 103.009 12.988 11.535 629 HH21 ARG 79 HH21 ARG 79 101.346 9.988 10.942 630 HH22 ARG 79 HH22 ARG 79 101.680 11.599 10.349 631 H GLY 80 H GLY 80 106.169 8.347 9.117 632 HA2 GLY 80 HA2 GLY 80 107.774 7.876 11.412 633 HA3 GLY 80 HA3 GLY 80 107.908 6.418 10.393 634 H THR 81 H THR 81 109.556 6.506 8.934 635 HA THR 81 HA THR 81 109.911 8.612 7.053 636 HB THR 81 HB THR 81 112.261 9.170 8.593 637 HG1 THR 81 HG1 THR 81 111.444 9.788 10.527 638 HG21 THR 81 HG21 THR 81 111.259 11.489 8.580 639 HG22 THR 81 HG22 THR 81 109.776 10.786 7.893 640 HG23 THR 81 HG23 THR 81 111.302 10.710 6.980 641 H TRP 82 H TRP 82 111.837 8.395 5.766 642 HA TRP 82 HA TRP 82 113.116 5.690 6.144 643 HB2 TRP 82 HB2 TRP 82 113.398 7.436 3.681 644 HB3 TRP 82 HB3 TRP 82 113.561 5.670 3.818 645 HD1 TRP 82 HD1 TRP 82 110.885 8.433 3.948 646 HE1 TRP 82 HE1 TRP 82 108.599 7.432 3.301 647 HE3 TRP 82 HE3 TRP 82 112.240 3.531 3.559 648 HZ2 TRP 82 HZ2 TRP 82 107.522 4.821 2.682 649 HZ3 TRP 82 HZ3 TRP 82 110.574 1.808 2.935 650 HH2 TRP 82 HH2 TRP 82 108.219 2.447 2.491 651 H SER 83 H SER 83 115.362 5.508 6.334 652 HA SER 83 HA SER 83 116.954 8.053 6.133 653 HB2 SER 83 HB2 SER 83 116.584 6.331 8.597 654 HB3 SER 83 HB3 SER 83 118.107 7.217 8.342 655 HG SER 83 HG SER 83 116.536 8.463 9.510 656 H LEU 84 H LEU 84 119.305 7.582 5.908 657 HA LEU 84 HA LEU 84 119.615 4.983 4.520 658 HB2 LEU 84 HB2 LEU 84 121.036 7.555 4.601 659 HB3 LEU 84 HB3 LEU 84 122.140 6.158 4.629 660 HG LEU 84 HG LEU 84 119.956 5.693 2.764 661 HD11 LEU 84 HD11 LEU 84 119.915 8.167 2.596 662 HD12 LEU 84 HD12 LEU 84 121.665 8.172 2.275 663 HD13 LEU 84 HD13 LEU 84 120.548 7.430 1.105 664 HD21 LEU 84 HD21 LEU 84 122.138 4.513 2.790 665 HD22 LEU 84 HD22 LEU 84 121.846 5.296 1.218 666 HD23 LEU 84 HD23 LEU 84 122.964 6.038 2.388 667 H GLU 85 H GLU 85 120.207 3.202 5.491 668 HA GLU 85 HA GLU 85 121.750 3.420 8.079 669 HB2 GLU 85 HB3 GLU 85 119.936 2.188 8.771 670 HB3 GLU 85 HB2 GLU 85 119.527 1.679 7.117 671 HG2 GLU 85 HG2 GLU 85 121.062 -0.109 7.152 672 HG3 GLU 85 HG3 GLU 85 121.993 0.592 8.498 673 H GLY 86 H GLY 86 123.889 3.169 7.568 674 HA2 GLY 86 HA2 GLY 86 125.820 2.160 6.641 675 HA3 GLY 86 HA3 GLY 86 124.846 0.679 6.458 676 H ASN 87 H ASN 87 124.093 0.134 4.427 677 HA ASN 87 HA ASN 87 124.491 2.220 2.268 678 HB2 ASN 87 HB2 ASN 87 125.165 -0.742 2.286 679 HB3 ASN 87 HB3 ASN 87 124.942 0.160 0.768 680 HD21 ASN 87 HD21 ASN 87 126.143 2.143 3.335 681 HD22 ASN 87 HD22 ASN 87 127.825 2.125 2.856 682 H LYS 88 H LYS 88 122.030 1.604 3.786 683 HA LYS 88 HA LYS 88 120.365 0.812 1.406 684 HB2 LYS 88 HB3 LYS 88 119.892 -0.287 4.211 685 HB3 LYS 88 HB2 LYS 88 118.989 -0.691 2.733 686 HG2 LYS 88 HG2 LYS 88 120.442 -2.478 2.716 687 HG3 LYS 88 HG3 LYS 88 121.492 -1.301 1.891 688 HD2 LYS 88 HD2 LYS 88 122.464 -0.673 4.116 689 HD3 LYS 88 HD3 LYS 88 121.479 -1.948 4.873 690 HE2 LYS 88 HE3 LYS 88 123.615 -2.334 2.728 691 HE3 LYS 88 HE2 LYS 88 123.730 -2.816 4.438 692 HZ1 LYS 88 HZ1 LYS 88 123.020 -4.737 3.489 693 HZ2 LYS 88 HZ2 LYS 88 121.549 -4.070 3.823 694 HZ3 LYS 88 HZ3 LYS 88 122.157 -4.000 2.292 695 H LEU 89 H LEU 89 118.044 1.445 1.722 696 HA LEU 89 HA LEU 89 117.934 3.967 3.377 697 HB2 LEU 89 HB3 LEU 89 116.671 3.031 0.828 698 HB3 LEU 89 HB2 LEU 89 115.661 4.042 1.888 699 HG LEU 89 HG LEU 89 118.507 4.863 1.275 700 HD11 LEU 89 HD11 LEU 89 117.432 4.415 -0.915 701 HD12 LEU 89 HD12 LEU 89 116.047 5.427 -0.442 702 HD13 LEU 89 HD13 LEU 89 117.653 6.162 -0.658 703 HD21 LEU 89 HD21 LEU 89 117.218 6.043 3.037 704 HD22 LEU 89 HD22 LEU 89 117.529 7.112 1.648 705 HD23 LEU 89 HD23 LEU 89 115.922 6.378 1.863 706 H ILE 90 H ILE 90 117.216 3.394 5.412 707 HA ILE 90 HA ILE 90 115.337 1.173 5.773 708 HB ILE 90 HB ILE 90 115.148 2.370 8.141 709 HG12 ILE 90 HG13 ILE 90 117.827 3.387 7.152 710 HG13 ILE 90 HG12 ILE 90 116.366 4.407 7.181 711 HG21 ILE 90 HG21 ILE 90 116.204 0.177 7.668 712 HG22 ILE 90 HG22 ILE 90 117.678 1.010 7.117 713 HG23 ILE 90 HG23 ILE 90 117.173 1.126 8.820 714 HD11 ILE 90 HD11 ILE 90 117.684 4.678 9.260 715 HD12 ILE 90 HD12 ILE 90 116.096 3.947 9.596 716 HD13 ILE 90 HD13 ILE 90 117.556 2.929 9.566 717 H GLY 91 H GLY 91 113.258 1.447 6.907 718 HA2 GLY 91 HA2 GLY 91 111.844 4.030 6.362 719 HA3 GLY 91 HA3 GLY 91 111.217 2.566 5.561 720 H LYS 92 H LYS 92 111.575 4.267 8.595 721 HA LYS 92 HA LYS 92 110.404 1.989 10.128 722 HB2 LYS 92 HB2 LYS 92 111.546 4.698 10.786 723 HB3 LYS 92 HB3 LYS 92 110.411 3.953 11.938 724 HG2 LYS 92 HG2 LYS 92 111.807 1.921 12.024 725 HG3 LYS 92 HG3 LYS 92 112.926 2.623 10.832 726 HD2 LYS 92 HD2 LYS 92 113.409 4.491 12.402 727 HD3 LYS 92 HD3 LYS 92 112.309 3.762 13.597 728 HE2 LYS 92 HE2 LYS 92 114.960 2.700 12.567 729 HE3 LYS 92 HE3 LYS 92 114.460 2.995 14.250 730 HZ1 LYS 92 HZ1 LYS 92 114.214 0.739 14.025 731 HZ2 LYS 92 HZ2 LYS 92 113.691 0.810 12.463 732 HZ3 LYS 92 HZ3 LYS 92 112.681 1.249 13.691 733 H PHE 93 H PHE 93 108.261 1.690 9.670 734 HA PHE 93 HA PHE 93 106.535 4.177 9.668 735 HB2 PHE 93 HB3 PHE 93 106.465 1.641 8.050 736 HB3 PHE 93 HB2 PHE 93 104.922 2.426 8.453 737 HD1 PHE 93 HD1 PHE 93 107.280 5.007 8.442 738 HD2 PHE 93 HD2 PHE 93 105.197 2.401 5.734 739 HE1 PHE 93 HE1 PHE 93 107.625 6.636 6.607 740 HE2 PHE 93 HE2 PHE 93 105.543 4.034 3.900 741 HZ PHE 93 HZ PHE 93 106.758 6.151 4.337 742 H LYS 94 H LYS 94 104.872 4.278 11.051 743 HA LYS 94 HA LYS 94 104.403 1.844 12.783 744 HB2 LYS 94 HB3 LYS 94 104.417 4.813 13.410 745 HB3 LYS 94 HB2 LYS 94 103.557 3.651 14.449 746 HG2 LYS 94 HG2 LYS 94 105.614 2.392 14.828 747 HG3 LYS 94 HG3 LYS 94 106.496 3.417 13.670 748 HD2 LYS 94 HD2 LYS 94 105.690 5.391 15.217 749 HD3 LYS 94 HD3 LYS 94 105.461 4.106 16.428 750 HE2 LYS 94 HE3 LYS 94 107.732 5.155 16.559 751 HE3 LYS 94 HE2 LYS 94 107.804 3.416 16.187 752 HZ1 LYS 94 HZ1 LYS 94 109.123 5.148 14.782 753 HZ2 LYS 94 HZ2 LYS 94 108.436 3.832 14.062 754 HZ3 LYS 94 HZ3 LYS 94 107.694 5.302 13.972 755 H ARG 95 H ARG 95 102.477 0.935 12.318 756 HA ARG 95 HA ARG 95 100.454 2.093 10.688 757 HB2 ARG 95 HB2 ARG 95 100.509 -0.106 12.745 758 HB3 ARG 95 HB3 ARG 95 98.927 0.459 12.158 759 HG2 ARG 95 HG2 ARG 95 99.867 0.167 9.783 760 HG3 ARG 95 HG3 ARG 95 101.222 -0.708 10.535 761 HD2 ARG 95 HD2 ARG 95 99.725 -2.449 10.042 762 HD3 ARG 95 HD3 ARG 95 99.318 -2.077 11.735 763 HE ARG 95 HE ARG 95 97.689 -0.443 9.985 764 HH11 ARG 95 HH11 ARG 95 95.539 -1.078 9.690 765 HH12 ARG 95 HH12 ARG 95 95.053 -2.717 10.060 766 HH21 ARG 95 HH21 ARG 95 98.237 -3.708 11.061 767 HH22 ARG 95 HH22 ARG 95 96.573 -4.199 10.833 768 H THR 96 H THR 96 99.363 3.952 11.062 769 HA THR 96 HA THR 96 99.173 5.109 13.738 770 HB THR 96 HB THR 96 97.264 6.428 12.281 771 HG1 THR 96 HG1 THR 96 97.756 4.904 10.521 772 HG21 THR 96 HG21 THR 96 99.079 8.008 11.697 773 HG22 THR 96 HG22 THR 96 100.288 6.753 12.059 774 HG23 THR 96 HG23 THR 96 99.267 7.406 13.362 775 H ASP 97 H ASP 97 97.512 2.729 12.097 776 HA ASP 97 HA ASP 97 94.868 3.139 13.330 777 HB2 ASP 97 HB2 ASP 97 95.978 0.571 12.131 778 HB3 ASP 97 HB3 ASP 97 94.273 1.058 12.283 779 H ASN 98 H ASN 98 97.561 0.800 13.813 780 HA ASN 98 HA ASN 98 96.570 0.510 16.651 781 HB2 ASN 98 HB2 ASN 98 97.576 -1.752 14.870 782 HB3 ASN 98 HB3 ASN 98 97.029 -1.900 16.557 783 HD21 ASN 98 HD21 ASN 98 95.722 -3.401 14.531 784 HD22 ASN 98 HD22 ASN 98 94.117 -2.745 14.294 785 H GLY 99 H GLY 99 98.967 1.766 14.925 786 HA2 GLY 99 HA2 GLY 99 101.310 1.995 15.250 787 HA3 GLY 99 HA3 GLY 99 100.888 1.878 16.975 788 H ASN 100 H ASN 100 100.570 -0.628 14.432 789 HA ASN 100 HA ASN 100 101.903 -2.573 16.210 790 HB2 ASN 100 HB2 ASN 100 100.571 -2.616 13.525 791 HB3 ASN 100 HB3 ASN 100 101.744 -3.906 13.878 792 HD21 ASN 100 HD21 ASN 100 99.352 -2.181 16.000 793 HD22 ASN 100 HD22 ASN 100 98.563 -3.648 16.534 794 H GLU 101 H GLU 101 103.280 -0.129 15.000 795 HA GLU 101 HA GLU 101 105.325 0.404 13.955 796 HB2 GLU 101 HB2 GLU 101 107.199 -0.632 14.991 797 HB3 GLU 101 HB3 GLU 101 105.897 -0.691 16.201 798 HG2 GLU 101 HG2 GLU 101 105.449 -3.016 15.716 799 HG3 GLU 101 HG3 GLU 101 106.523 -2.985 14.297 800 H LEU 102 H LEU 102 106.967 -0.171 12.388 801 HA LEU 102 HA LEU 102 106.709 -2.755 10.956 802 HB2 LEU 102 HB2 LEU 102 104.829 -1.303 10.041 803 HB3 LEU 102 HB3 LEU 102 106.072 -0.159 9.482 804 HG LEU 102 HG LEU 102 106.090 -3.111 8.732 805 HD11 LEU 102 HD11 LEU 102 103.996 -2.055 7.920 806 HD12 LEU 102 HD12 LEU 102 104.945 -0.744 7.182 807 HD13 LEU 102 HD13 LEU 102 105.102 -2.408 6.571 808 HD21 LEU 102 HD21 LEU 102 107.334 -1.770 6.721 809 HD22 LEU 102 HD22 LEU 102 108.197 -2.373 8.156 810 HD23 LEU 102 HD23 LEU 102 107.692 -0.669 8.073 811 H ASN 103 H ASN 103 108.770 -3.250 10.282 812 HA ASN 103 HA ASN 103 110.653 -0.893 9.964 813 HB2 ASN 103 HB2 ASN 103 110.890 -2.873 11.828 814 HB3 ASN 103 HB3 ASN 103 111.785 -3.608 10.476 815 HD21 ASN 103 HD21 ASN 103 113.978 -3.179 10.733 816 HD22 ASN 103 HD22 ASN 103 114.636 -1.642 11.247 817 H THR 104 H THR 104 111.073 -0.572 7.835 818 HA THR 104 HA THR 104 111.349 -3.059 6.133 819 HB THR 104 HB THR 104 109.288 -1.983 5.498 820 HG1 THR 104 HG1 THR 104 110.056 -2.337 3.552 821 HG21 THR 104 HG21 THR 104 109.610 0.540 4.688 822 HG22 THR 104 HG22 THR 104 109.296 0.165 6.399 823 HG23 THR 104 HG23 THR 104 110.956 0.502 5.852 824 H VAL 105 H VAL 105 112.453 -2.420 3.970 825 HA VAL 105 HA VAL 105 114.584 -0.349 4.359 826 HB VAL 105 HB VAL 105 115.185 -3.256 3.648 827 HG11 VAL 105 HG11 VAL 105 116.673 -1.589 2.573 828 HG12 VAL 105 HG12 VAL 105 117.542 -2.507 3.826 829 HG13 VAL 105 HG13 VAL 105 116.989 -0.848 4.160 830 HG21 VAL 105 HG21 VAL 105 114.587 -2.981 6.040 831 HG22 VAL 105 HG22 VAL 105 115.771 -1.660 6.183 832 HG23 VAL 105 HG23 VAL 105 116.325 -3.319 5.850 833 H ARG 106 H ARG 106 115.391 0.435 2.343 834 HA ARG 106 HA ARG 106 113.927 -0.691 -0.060 835 HB2 ARG 106 HB2 ARG 106 113.441 1.760 0.981 836 HB3 ARG 106 HB3 ARG 106 114.824 2.167 -0.062 837 HG2 ARG 106 HG2 ARG 106 113.601 0.914 -1.939 838 HG3 ARG 106 HG3 ARG 106 112.176 0.902 -0.872 839 HD2 ARG 106 HD2 ARG 106 113.619 3.287 -2.076 840 HD3 ARG 106 HD3 ARG 106 111.895 2.858 -2.193 841 HE ARG 106 HE ARG 106 112.459 3.247 0.579 842 HH11 ARG 106 HH11 ARG 106 111.991 5.246 1.522 843 HH12 ARG 106 HH12 ARG 106 111.845 6.673 0.520 844 HH21 ARG 106 HH21 ARG 106 112.489 4.969 -2.447 845 HH22 ARG 106 HH22 ARG 106 112.125 6.517 -1.717 846 H GLU 107 H GLU 107 115.190 -1.260 -1.765 847 HA GLU 107 HA GLU 107 118.004 -0.172 -1.849 848 HB2 GLU 107 HB2 GLU 107 118.739 -2.233 -1.231 849 HB3 GLU 107 HB3 GLU 107 117.125 -2.952 -1.428 850 HG2 GLU 107 HG2 GLU 107 117.470 -3.202 -3.828 851 HG3 GLU 107 HG3 GLU 107 119.012 -2.317 -3.738 852 H ILE 108 H ILE 108 118.921 -0.268 -4.069 853 HA ILE 108 HA ILE 108 116.749 -0.513 -6.153 854 HB ILE 108 HB ILE 108 119.055 1.473 -6.184 855 HG12 ILE 108 HG13 ILE 108 116.381 1.546 -4.853 856 HG13 ILE 108 HG12 ILE 108 117.867 2.445 -4.471 857 HG21 ILE 108 HG21 ILE 108 117.891 0.680 -8.326 858 HG22 ILE 108 HG22 ILE 108 117.880 2.436 -8.034 859 HG23 ILE 108 HG23 ILE 108 116.423 1.469 -7.702 860 HD11 ILE 108 HD11 ILE 108 116.314 4.080 -5.269 861 HD12 ILE 108 HD12 ILE 108 117.434 3.784 -6.620 862 HD13 ILE 108 HD13 ILE 108 115.813 3.047 -6.629 863 H ILE 109 H ILE 109 117.561 -2.691 -6.449 864 HA ILE 109 HA ILE 109 120.331 -3.240 -7.063 865 HB ILE 109 HB ILE 109 117.738 -4.654 -7.799 866 HG12 ILE 109 HG13 ILE 109 120.004 -5.408 -5.902 867 HG13 ILE 109 HG12 ILE 109 118.515 -4.577 -5.392 868 HG21 ILE 109 HG21 ILE 109 119.164 -6.553 -8.514 869 HG22 ILE 109 HG22 ILE 109 119.454 -5.120 -9.528 870 HG23 ILE 109 HG23 ILE 109 120.617 -5.560 -8.254 871 HD11 ILE 109 HD11 ILE 109 118.840 -7.381 -6.502 872 HD12 ILE 109 HD12 ILE 109 118.031 -6.861 -5.004 873 HD13 ILE 109 HD13 ILE 109 117.274 -6.539 -6.582 874 H GLY 110 H GLY 110 121.093 -1.668 -8.504 875 HA2 GLY 110 HA3 GLY 110 121.506 -0.741 -10.635 876 HA3 GLY 110 HA2 GLY 110 120.951 -2.302 -11.281 877 H ASP 111 H ASP 111 118.558 -2.574 -11.554 878 HA ASP 111 HA ASP 111 117.193 0.100 -11.916 879 HB2 ASP 111 HB2 ASP 111 118.082 -1.635 -13.985 880 HB3 ASP 111 HB3 ASP 111 116.316 -1.833 -13.901 881 H GLU 112 H GLU 112 117.003 -2.005 -9.800 882 HA GLU 112 HA GLU 112 114.035 -2.457 -10.095 883 HB2 GLU 112 HB2 GLU 112 115.672 -4.534 -8.670 884 HB3 GLU 112 HB3 GLU 112 114.153 -4.713 -9.580 885 HG2 GLU 112 HG3 GLU 112 115.524 -4.161 -11.686 886 HG3 GLU 112 HG2 GLU 112 116.973 -4.393 -10.678 887 H LEU 113 H LEU 113 112.896 -1.972 -8.212 888 HA LEU 113 HA LEU 113 114.610 -0.949 -5.955 889 HB2 LEU 113 HB3 LEU 113 112.737 0.459 -6.988 890 HB3 LEU 113 HB2 LEU 113 111.595 -0.686 -6.243 891 HG LEU 113 HG LEU 113 113.481 0.013 -4.219 892 HD11 LEU 113 HD11 LEU 113 113.900 2.244 -4.380 893 HD12 LEU 113 HD12 LEU 113 113.479 2.064 -6.099 894 HD13 LEU 113 HD13 LEU 113 112.245 2.597 -4.932 895 HD21 LEU 113 HD21 LEU 113 111.534 0.654 -3.035 896 HD22 LEU 113 HD22 LEU 113 110.923 -0.527 -4.218 897 HD23 LEU 113 HD23 LEU 113 110.712 1.216 -4.510 898 H VAL 114 H VAL 114 115.067 -2.482 -4.451 899 HA VAL 114 HA VAL 114 113.008 -4.596 -3.935 900 HB VAL 114 HB VAL 114 115.787 -4.220 -2.732 901 HG11 VAL 114 HG11 VAL 114 114.243 -5.590 -1.355 902 HG12 VAL 114 HG12 VAL 114 115.514 -6.600 -2.086 903 HG13 VAL 114 HG13 VAL 114 113.873 -6.598 -2.775 904 HG21 VAL 114 HG21 VAL 114 116.454 -6.002 -4.324 905 HG22 VAL 114 HG22 VAL 114 114.812 -6.000 -5.012 906 HG23 VAL 114 HG23 VAL 114 115.852 -4.566 -5.187 907 H GLN 115 H GLN 115 111.439 -4.064 -2.508 908 HA GLN 115 HA GLN 115 112.247 -2.309 -0.176 909 HB2 GLN 115 HB3 GLN 115 110.491 -1.456 -1.890 910 HB3 GLN 115 HB2 GLN 115 109.412 -2.692 -1.200 911 HG2 GLN 115 HG2 GLN 115 109.781 -1.717 1.067 912 HG3 GLN 115 HG3 GLN 115 110.799 -0.451 0.338 913 HE21 GLN 115 HE21 GLN 115 108.507 -1.087 -1.991 914 HE22 GLN 115 HE22 GLN 115 107.302 0.096 -1.534 915 H THR 116 H THR 116 112.680 -3.779 1.432 916 HA THR 116 HA THR 116 110.729 -6.050 1.756 917 HB THR 116 HB THR 116 113.172 -5.805 3.474 918 HG1 THR 116 HG1 THR 116 114.075 -5.304 1.503 919 HG21 THR 116 HG21 THR 116 113.204 -8.259 3.055 920 HG22 THR 116 HG22 THR 116 111.821 -8.075 1.950 921 HG23 THR 116 HG23 THR 116 111.629 -7.714 3.682 922 H TYR 117 H TYR 117 109.582 -6.320 3.660 923 HA TYR 117 HA TYR 117 109.892 -4.080 5.669 924 HB2 TYR 117 HB2 TYR 117 107.224 -5.421 5.232 925 HB3 TYR 117 HB3 TYR 117 107.582 -3.810 5.897 926 HD1 TYR 117 HD1 TYR 117 108.156 -5.766 2.772 927 HD2 TYR 117 HD2 TYR 117 107.147 -1.986 4.516 928 HE1 TYR 117 HE1 TYR 117 107.840 -4.813 0.505 929 HE2 TYR 117 HE2 TYR 117 106.834 -1.017 2.254 930 HH TYR 117 HH TYR 117 107.963 -2.372 -0.519 931 H VAL 118 H VAL 118 109.498 -4.617 7.800 932 HA VAL 118 HA VAL 118 109.468 -7.591 8.366 933 HB VAL 118 HB VAL 118 110.616 -5.464 10.202 934 HG11 VAL 118 HG11 VAL 118 111.394 -7.249 11.465 935 HG12 VAL 118 HG12 VAL 118 111.484 -8.341 10.062 936 HG13 VAL 118 HG13 VAL 118 109.908 -7.970 10.802 937 HG21 VAL 118 HG21 VAL 118 111.854 -5.393 8.058 938 HG22 VAL 118 HG22 VAL 118 112.092 -7.155 8.139 939 HG23 VAL 118 HG23 VAL 118 112.850 -6.097 9.354 940 H TYR 119 H TYR 119 108.180 -8.261 10.081 941 HA TYR 119 HA TYR 119 106.547 -6.138 11.412 942 HB2 TYR 119 HB3 TYR 119 105.562 -7.332 9.162 943 HB3 TYR 119 HB2 TYR 119 104.967 -8.447 10.415 944 HD1 TYR 119 HD1 TYR 119 103.675 -7.535 12.350 945 HD2 TYR 119 HD2 TYR 119 104.610 -5.150 8.908 946 HE1 TYR 119 HE1 TYR 119 101.888 -5.936 12.977 947 HE2 TYR 119 HE2 TYR 119 102.833 -3.538 9.540 948 HH TYR 119 HH TYR 119 100.640 -4.164 12.256 949 H GLU 120 H GLU 120 106.921 -6.552 13.467 950 HA GLU 120 HA GLU 120 107.196 -7.734 15.482 951 HB2 GLU 120 HB2 GLU 120 104.898 -9.110 14.086 952 HB3 GLU 120 HB3 GLU 120 105.476 -9.708 15.660 953 HG2 GLU 120 HG2 GLU 120 105.222 -7.384 16.580 954 HG3 GLU 120 HG3 GLU 120 104.517 -6.883 15.024 955 H GLY 121 H GLY 121 108.673 -8.740 12.947 956 HA2 GLY 121 HA3 GLY 121 110.587 -10.310 13.343 957 HA3 GLY 121 HA2 GLY 121 109.458 -11.374 14.218 958 H VAL 122 H VAL 122 108.499 -9.696 11.301 959 HA VAL 122 HA VAL 122 108.694 -12.320 9.825 960 HB VAL 122 HB VAL 122 106.328 -11.217 10.553 961 HG11 VAL 122 HG11 VAL 122 106.683 -10.159 7.739 962 HG12 VAL 122 HG12 VAL 122 105.420 -9.771 8.931 963 HG13 VAL 122 HG13 VAL 122 107.071 -9.144 9.149 964 HG21 VAL 122 HG21 VAL 122 105.348 -12.454 8.642 965 HG22 VAL 122 HG22 VAL 122 106.669 -13.374 9.402 966 HG23 VAL 122 HG23 VAL 122 106.949 -12.517 7.867 967 H GLU 123 H GLU 123 108.409 -11.708 7.334 968 HA GLU 123 HA GLU 123 109.655 -9.076 6.775 969 HB2 GLU 123 HB3 GLU 123 111.600 -10.463 7.403 970 HB3 GLU 123 HB2 GLU 123 111.138 -11.669 6.177 971 HG2 GLU 123 HG2 GLU 123 111.435 -10.039 4.389 972 HG3 GLU 123 HG3 GLU 123 111.736 -8.743 5.571 973 H ALA 124 H ALA 124 108.536 -8.363 5.063 974 HA ALA 124 HA ALA 124 107.700 -10.386 2.977 975 HB1 ALA 124 HB1 ALA 124 106.551 -7.776 2.536 976 HB2 ALA 124 HB2 ALA 124 105.722 -9.293 2.961 977 HB3 ALA 124 HB3 ALA 124 106.319 -8.215 4.246 978 H LYS 125 H LYS 125 108.147 -9.870 0.724 979 HA LYS 125 HA LYS 125 110.203 -7.669 0.434 980 HB2 LYS 125 HB3 LYS 125 110.376 -10.101 -1.316 981 HB3 LYS 125 HB2 LYS 125 111.672 -9.054 -0.692 982 HG2 LYS 125 HG2 LYS 125 110.831 -10.047 1.655 983 HG3 LYS 125 HG3 LYS 125 110.295 -11.387 0.614 984 HD2 LYS 125 HD2 LYS 125 113.110 -10.236 0.484 985 HD3 LYS 125 HD3 LYS 125 112.675 -11.580 1.565 986 HE2 LYS 125 HE3 LYS 125 111.848 -11.798 -1.312 987 HE3 LYS 125 HE2 LYS 125 113.576 -11.999 -0.939 988 HZ1 LYS 125 HZ1 LYS 125 112.759 -13.580 0.839 989 HZ2 LYS 125 HZ2 LYS 125 112.658 -14.105 -0.721 990 HZ3 LYS 125 HZ3 LYS 125 111.305 -13.573 0.059 991 H ARG 126 H ARG 126 109.962 -6.344 -1.317 992 HA ARG 126 HA ARG 126 108.066 -7.209 -3.493 993 HB2 ARG 126 HB2 ARG 126 107.910 -4.625 -1.877 994 HB3 ARG 126 HB3 ARG 126 107.077 -4.866 -3.432 995 HG2 ARG 126 HG3 ARG 126 106.159 -7.058 -2.284 996 HG3 ARG 126 HG2 ARG 126 106.588 -6.221 -0.773 997 HD2 ARG 126 HD2 ARG 126 104.841 -5.030 -2.971 998 HD3 ARG 126 HD3 ARG 126 104.216 -5.801 -1.493 999 HE ARG 126 HE ARG 126 106.099 -3.789 -0.691 1000 HH11 ARG 126 HH11 ARG 126 105.302 -1.783 -0.021 1001 HH12 ARG 126 HH12 ARG 126 103.696 -1.277 -0.494 1002 HH21 ARG 126 HH21 ARG 126 103.034 -4.182 -2.296 1003 HH22 ARG 126 HH22 ARG 126 102.417 -2.629 -1.777 1004 H ILE 127 H ILE 127 109.323 -7.082 -5.308 1005 HA ILE 127 HA ILE 127 111.403 -4.889 -5.347 1006 HB ILE 127 HB ILE 127 111.289 -7.450 -6.991 1007 HG12 ILE 127 HG12 ILE 127 113.488 -7.628 -5.352 1008 HG13 ILE 127 HG13 ILE 127 112.338 -6.785 -4.286 1009 HG21 ILE 127 HG21 ILE 127 113.629 -6.843 -7.547 1010 HG22 ILE 127 HG22 ILE 127 112.498 -5.573 -8.072 1011 HG23 ILE 127 HG23 ILE 127 113.467 -5.347 -6.596 1012 HD11 ILE 127 HD11 ILE 127 112.135 -9.246 -4.047 1013 HD12 ILE 127 HD12 ILE 127 111.796 -9.387 -5.788 1014 HD13 ILE 127 HD13 ILE 127 110.645 -8.545 -4.723 1015 H PHE 128 H PHE 128 111.260 -3.307 -6.808 1016 HA PHE 128 HA PHE 128 109.084 -3.531 -8.881 1017 HB2 PHE 128 HB2 PHE 128 110.733 -1.073 -8.159 1018 HB3 PHE 128 HB3 PHE 128 109.211 -1.124 -9.073 1019 HD1 PHE 128 HD1 PHE 128 108.235 -3.423 -6.994 1020 HD2 PHE 128 HD2 PHE 128 109.597 0.629 -6.681 1021 HE1 PHE 128 HE1 PHE 128 106.941 -3.155 -4.897 1022 HE2 PHE 128 HE2 PHE 128 108.312 0.902 -4.576 1023 HZ PHE 128 HZ PHE 128 106.979 -0.991 -3.685 1024 H LYS 129 H LYS 129 109.720 -2.205 -10.959 1025 HA LYS 129 HA LYS 129 112.551 -2.314 -11.752 1026 HB2 LYS 129 HB2 LYS 129 111.708 -4.757 -11.858 1027 HB3 LYS 129 HB3 LYS 129 110.680 -4.219 -13.208 1028 HG2 LYS 129 HG2 LYS 129 112.909 -3.197 -14.155 1029 HG3 LYS 129 HG3 LYS 129 113.699 -4.332 -13.035 1030 HD2 LYS 129 HD2 LYS 129 112.221 -6.160 -14.059 1031 HD3 LYS 129 HD3 LYS 129 111.795 -4.978 -15.320 1032 HE2 LYS 129 HE3 LYS 129 114.392 -4.666 -15.551 1033 HE3 LYS 129 HE2 LYS 129 114.483 -6.234 -14.714 1034 HZ1 LYS 129 HZ1 LYS 129 114.408 -6.503 -17.102 1035 HZ2 LYS 129 HZ2 LYS 129 113.056 -7.152 -16.417 1036 HZ3 LYS 129 HZ3 LYS 129 112.971 -5.699 -17.192 1037 H LYS 130 H LYS 130 112.857 -1.280 -13.821 1038 HA LYS 130 HA LYS 130 111.114 0.842 -14.438 1039 HB2 LYS 130 HB2 LYS 130 113.003 -0.750 -16.211 1040 HB3 LYS 130 HB3 LYS 130 112.125 0.679 -16.807 1041 HG2 LYS 130 HG2 LYS 130 113.083 1.843 -14.649 1042 HG3 LYS 130 HG3 LYS 130 114.258 0.505 -14.665 1043 HD2 LYS 130 HD3 LYS 130 114.951 1.085 -16.939 1044 HD3 LYS 130 HD2 LYS 130 113.692 2.339 -17.037 1045 HE2 LYS 130 HE3 LYS 130 114.964 3.117 -14.752 1046 HE3 LYS 130 HE2 LYS 130 116.325 2.379 -15.631 1047 HZ1 LYS 130 HZ1 LYS 130 116.063 4.704 -16.185 1048 HZ2 LYS 130 HZ2 LYS 130 114.517 4.454 -16.700 1049 HZ3 LYS 130 HZ3 LYS 130 115.778 3.770 -17.514 1050 H ASP 131 H ASP 131 109.180 1.049 -15.474 1051 HA ASP 131 HA ASP 131 107.509 -1.205 -15.984 1052 HB2 ASP 131 HB3 ASP 131 106.227 0.469 -17.490 1053 HB3 ASP 131 HB2 ASP 131 106.447 0.918 -15.782 Start of MODEL 2 1 H1 ALA 1 H1 ALA 1 116.628 9.100 -6.650 2 H2 ALA 1 H2 ALA 1 118.004 8.631 -5.871 3 H3 ALA 1 H3 ALA 1 116.538 8.065 -5.369 4 HA ALA 1 HA ALA 1 117.808 7.472 -7.968 5 HB1 ALA 1 HB1 ALA 1 118.917 6.326 -6.089 6 HB2 ALA 1 HB2 ALA 1 117.341 5.756 -5.489 7 HB3 ALA 1 HB3 ALA 1 117.969 5.161 -7.044 8 H PHE 2 H PHE 2 116.596 5.199 -8.609 9 HA PHE 2 HA PHE 2 114.565 4.539 -9.665 10 HB2 PHE 2 HB2 PHE 2 114.451 4.179 -6.915 11 HB3 PHE 2 HB3 PHE 2 112.954 5.084 -7.241 12 HD1 PHE 2 HD1 PHE 2 114.930 2.372 -8.974 13 HD2 PHE 2 HD2 PHE 2 111.103 3.749 -7.595 14 HE1 PHE 2 HE1 PHE 2 113.865 0.320 -9.876 15 HE2 PHE 2 HE2 PHE 2 110.042 1.696 -8.492 16 HZ PHE 2 HZ PHE 2 111.423 -0.015 -9.636 17 H ASP 3 H ASP 3 115.194 7.360 -9.955 18 HA ASP 3 HA ASP 3 112.672 8.841 -9.482 19 HB2 ASP 3 HB3 ASP 3 113.910 10.586 -10.945 20 HB3 ASP 3 HB2 ASP 3 114.632 10.180 -9.370 21 H SER 4 H SER 4 111.317 7.239 -10.716 22 HA SER 4 HA SER 4 110.664 8.278 -13.325 23 HB2 SER 4 HB3 SER 4 112.710 7.250 -14.131 24 HB3 SER 4 HB2 SER 4 112.324 5.721 -13.303 25 HG SER 4 HG SER 4 111.763 6.069 -15.704 26 H THR 5 H THR 5 109.588 5.975 -14.537 27 HA THR 5 HA THR 5 107.412 5.379 -12.568 28 HB THR 5 HB THR 5 107.660 4.653 -15.522 29 HG1 THR 5 HG1 THR 5 106.221 6.457 -15.747 30 HG21 THR 5 HG21 THR 5 105.212 4.296 -15.347 31 HG22 THR 5 HG22 THR 5 106.096 3.221 -14.238 32 HG23 THR 5 HG23 THR 5 105.282 4.674 -13.609 33 H TRP 6 H TRP 6 106.848 3.235 -11.966 34 HA TRP 6 HA TRP 6 108.605 1.026 -12.942 35 HB2 TRP 6 HB2 TRP 6 108.429 1.622 -9.969 36 HB3 TRP 6 HB3 TRP 6 109.500 0.466 -10.797 37 HD1 TRP 6 HD1 TRP 6 108.915 4.269 -10.459 38 HE1 TRP 6 HE1 TRP 6 111.126 5.506 -10.940 39 HE3 TRP 6 HE3 TRP 6 111.775 0.291 -11.876 40 HZ2 TRP 6 HZ2 TRP 6 113.790 4.831 -11.831 41 HZ3 TRP 6 HZ3 TRP 6 114.140 0.608 -12.528 42 HH2 TRP 6 HH2 TRP 6 115.153 2.871 -12.511 43 H LYS 7 H LYS 7 107.892 -1.108 -11.872 44 HA LYS 7 HA LYS 7 105.088 -1.028 -10.835 45 HB2 LYS 7 HB3 LYS 7 105.838 -1.775 -13.606 46 HB3 LYS 7 HB2 LYS 7 104.867 -3.004 -12.763 47 HG2 LYS 7 HG3 LYS 7 103.106 -1.422 -12.308 48 HG3 LYS 7 HG2 LYS 7 104.115 -0.055 -12.838 49 HD2 LYS 7 HD2 LYS 7 102.802 -0.418 -14.739 50 HD3 LYS 7 HD3 LYS 7 104.233 -1.410 -15.110 51 HE2 LYS 7 HE2 LYS 7 102.880 -3.297 -13.834 52 HE3 LYS 7 HE3 LYS 7 101.477 -2.278 -14.234 53 HZ1 LYS 7 HZ1 LYS 7 101.924 -3.893 -15.959 54 HZ2 LYS 7 HZ2 LYS 7 103.454 -3.311 -16.168 55 HZ3 LYS 7 HZ3 LYS 7 102.154 -2.366 -16.540 56 H VAL 8 H VAL 8 104.898 -2.586 -9.284 57 HA VAL 8 HA VAL 8 106.984 -4.193 -8.375 58 HB VAL 8 HB VAL 8 105.192 -4.334 -6.945 59 HG11 VAL 8 HG11 VAL 8 103.525 -4.435 -9.475 60 HG12 VAL 8 HG12 VAL 8 103.553 -3.183 -8.210 61 HG13 VAL 8 HG13 VAL 8 102.814 -4.768 -7.877 62 HG21 VAL 8 HG21 VAL 8 104.323 -6.557 -6.875 63 HG22 VAL 8 HG22 VAL 8 104.419 -6.733 -8.644 64 HG23 VAL 8 HG23 VAL 8 105.909 -6.703 -7.670 65 H ASP 9 H ASP 9 108.279 -5.362 -9.672 66 HA ASP 9 HA ASP 9 107.027 -7.048 -11.817 67 HB2 ASP 9 HB3 ASP 9 109.792 -6.010 -11.219 68 HB3 ASP 9 HB2 ASP 9 109.641 -7.520 -12.149 69 H ARG 10 H ARG 10 108.718 -7.217 -8.719 70 HA ARG 10 HA ARG 10 107.966 -10.109 -8.606 71 HB2 ARG 10 HB2 ARG 10 110.799 -9.383 -7.845 72 HB3 ARG 10 HB3 ARG 10 110.119 -10.971 -8.276 73 HG2 ARG 10 HG2 ARG 10 109.823 -10.195 -10.621 74 HG3 ARG 10 HG3 ARG 10 110.534 -8.623 -10.183 75 HD2 ARG 10 HD3 ARG 10 112.670 -9.472 -10.060 76 HD3 ARG 10 HD2 ARG 10 112.120 -11.050 -9.446 77 HE ARG 10 HE ARG 10 111.452 -10.458 -12.295 78 HH11 ARG 10 HH11 ARG 10 112.352 -11.941 -13.743 79 HH12 ARG 10 HH12 ARG 10 113.569 -13.072 -13.194 80 HH21 ARG 10 HH21 ARG 10 113.538 -11.908 -9.913 81 HH22 ARG 10 HH22 ARG 10 114.236 -13.053 -11.036 82 H SER 11 H SER 11 108.330 -10.999 -6.364 83 HA SER 11 HA SER 11 108.867 -9.181 -4.148 84 HB2 SER 11 HB2 SER 11 105.955 -9.770 -4.837 85 HB3 SER 11 HB3 SER 11 106.497 -9.148 -3.260 86 HG SER 11 HG SER 11 106.052 -7.342 -4.431 87 H GLU 12 H GLU 12 107.865 -10.326 -2.011 88 HA GLU 12 HA GLU 12 107.553 -13.254 -2.388 89 HB2 GLU 12 HB3 GLU 12 109.588 -13.976 -1.596 90 HB3 GLU 12 HB2 GLU 12 110.130 -12.435 -2.301 91 HG2 GLU 12 HG2 GLU 12 109.578 -11.407 0.022 92 HG3 GLU 12 HG3 GLU 12 109.556 -13.088 0.607 93 H ASN 13 H ASN 13 107.043 -14.354 -0.359 94 HA ASN 13 HA ASN 13 105.848 -14.456 1.670 95 HB2 ASN 13 HB2 ASN 13 107.712 -12.113 2.070 96 HB3 ASN 13 HB3 ASN 13 106.476 -12.468 3.300 97 HD21 ASN 13 HD21 ASN 13 108.332 -13.052 4.766 98 HD22 ASN 13 HD22 ASN 13 109.069 -14.629 4.599 99 H TYR 14 H TYR 14 105.733 -11.152 2.459 100 HA TYR 14 HA TYR 14 104.019 -9.539 2.263 101 HB2 TYR 14 HB2 TYR 14 104.162 -10.593 -0.268 102 HB3 TYR 14 HB3 TYR 14 102.478 -10.971 0.164 103 HD1 TYR 14 HD1 TYR 14 104.650 -8.067 1.160 104 HD2 TYR 14 HD2 TYR 14 101.152 -9.391 -0.956 105 HE1 TYR 14 HE1 TYR 14 104.012 -5.709 0.737 106 HE2 TYR 14 HE2 TYR 14 100.514 -7.034 -1.374 107 HH TYR 14 HH TYR 14 101.823 -4.752 -1.528 108 H ASP 15 H ASP 15 102.729 -12.870 1.719 109 HA ASP 15 HA ASP 15 100.225 -12.314 3.057 110 HB2 ASP 15 HB2 ASP 15 99.895 -14.694 3.100 111 HB3 ASP 15 HB3 ASP 15 100.784 -14.341 1.599 112 H LYS 16 H LYS 16 103.375 -13.523 4.231 113 HA LYS 16 HA LYS 16 102.424 -13.885 6.973 114 HB2 LYS 16 HB2 LYS 16 105.265 -13.350 5.995 115 HB3 LYS 16 HB3 LYS 16 104.794 -14.073 7.552 116 HG2 LYS 16 HG3 LYS 16 103.701 -15.953 6.302 117 HG3 LYS 16 HG2 LYS 16 104.299 -15.249 4.780 118 HD2 LYS 16 HD2 LYS 16 106.560 -15.668 5.331 119 HD3 LYS 16 HD3 LYS 16 106.198 -15.854 7.064 120 HE2 LYS 16 HE2 LYS 16 106.599 -18.065 6.126 121 HE3 LYS 16 HE3 LYS 16 104.863 -17.921 6.492 122 HZ1 LYS 16 HZ1 LYS 16 105.238 -18.836 4.300 123 HZ2 LYS 16 HZ2 LYS 16 106.098 -17.506 3.842 124 HZ3 LYS 16 HZ3 LYS 16 104.489 -17.372 4.181 125 H PHE 17 H PHE 17 103.716 -11.210 5.073 126 HA PHE 17 HA PHE 17 104.136 -9.446 7.382 127 HB2 PHE 17 HB2 PHE 17 105.332 -9.041 5.309 128 HB3 PHE 17 HB3 PHE 17 103.811 -8.960 4.392 129 HD1 PHE 17 HD1 PHE 17 105.741 -7.319 7.118 130 HD2 PHE 17 HD2 PHE 17 102.639 -6.908 4.186 131 HE1 PHE 17 HE1 PHE 17 105.641 -4.885 7.572 132 HE2 PHE 17 HE2 PHE 17 102.526 -4.472 4.642 133 HZ PHE 17 HZ PHE 17 104.032 -3.458 6.333 134 H MET 18 H MET 18 101.713 -9.511 4.746 135 HA MET 18 HA MET 18 99.941 -7.588 5.948 136 HB2 MET 18 HB3 MET 18 99.632 -9.800 3.914 137 HB3 MET 18 HB2 MET 18 98.181 -8.977 4.535 138 HG2 MET 18 HG2 MET 18 100.586 -7.469 3.441 139 HG3 MET 18 HG3 MET 18 99.215 -7.966 2.420 140 HE1 MET 18 HE1 MET 18 100.585 -5.139 3.286 141 HE2 MET 18 HE2 MET 18 99.608 -4.122 4.372 142 HE3 MET 18 HE3 MET 18 100.589 -5.450 5.039 143 H GLU 19 H GLU 19 100.331 -11.087 6.426 144 HA GLU 19 HA GLU 19 97.853 -11.406 7.945 145 HB2 GLU 19 HB3 GLU 19 99.002 -13.334 6.930 146 HB3 GLU 19 HB2 GLU 19 100.427 -13.044 7.956 147 HG2 GLU 19 HG2 GLU 19 99.124 -13.483 9.974 148 HG3 GLU 19 HG3 GLU 19 97.628 -13.622 9.020 149 H LYS 20 H LYS 20 101.226 -10.635 8.783 150 HA LYS 20 HA LYS 20 100.879 -10.849 11.647 151 HB2 LYS 20 HB2 LYS 20 102.790 -9.282 9.881 152 HB3 LYS 20 HB3 LYS 20 102.861 -9.189 11.657 153 HG2 LYS 20 HG2 LYS 20 102.775 -11.893 10.309 154 HG3 LYS 20 HG3 LYS 20 104.311 -10.995 10.377 155 HD2 LYS 20 HD3 LYS 20 103.977 -10.751 12.868 156 HD3 LYS 20 HD2 LYS 20 102.560 -11.820 12.732 157 HE2 LYS 20 HE2 LYS 20 103.879 -13.681 12.084 158 HE3 LYS 20 HE3 LYS 20 105.268 -12.656 11.647 159 HZ1 LYS 20 HZ1 LYS 20 105.598 -13.749 13.764 160 HZ2 LYS 20 HZ2 LYS 20 105.517 -12.116 13.976 161 HZ3 LYS 20 HZ3 LYS 20 104.231 -13.064 14.381 162 H MET 21 H MET 21 100.431 -8.132 9.358 163 HA MET 21 HA MET 21 99.840 -6.182 11.433 164 HB2 MET 21 HB2 MET 21 98.627 -6.113 8.656 165 HB3 MET 21 HB3 MET 21 99.170 -4.756 9.671 166 HG2 MET 21 HG3 MET 21 101.507 -6.148 9.437 167 HG3 MET 21 HG2 MET 21 100.742 -6.553 7.881 168 HE1 MET 21 HE1 MET 21 98.948 -3.351 7.888 169 HE2 MET 21 HE2 MET 21 99.177 -4.820 6.909 170 HE3 MET 21 HE3 MET 21 99.813 -3.260 6.335 171 H GLY 22 H GLY 22 98.176 -8.954 10.426 172 HA2 GLY 22 HA2 GLY 22 96.114 -9.707 11.428 173 HA3 GLY 22 HA3 GLY 22 95.766 -8.039 11.940 174 H VAL 23 H VAL 23 96.745 -8.934 8.653 175 HA VAL 23 HA VAL 23 94.141 -7.800 7.691 176 HB VAL 23 HB VAL 23 96.582 -8.690 6.094 177 HG11 VAL 23 HG11 VAL 23 95.601 -7.220 4.356 178 HG12 VAL 23 HG12 VAL 23 94.472 -8.519 4.809 179 HG13 VAL 23 HG13 VAL 23 94.226 -6.869 5.430 180 HG21 VAL 23 HG21 VAL 23 97.164 -6.905 7.721 181 HG22 VAL 23 HG22 VAL 23 97.177 -6.281 6.055 182 HG23 VAL 23 HG23 VAL 23 95.804 -5.923 7.129 183 H ASN 24 H ASN 24 92.624 -9.012 6.556 184 HA ASN 24 HA ASN 24 92.463 -11.827 7.044 185 HB2 ASN 24 HB2 ASN 24 91.174 -10.007 4.984 186 HB3 ASN 24 HB3 ASN 24 90.829 -11.753 5.023 187 HD21 ASN 24 HD21 ASN 24 90.000 -12.635 7.174 188 HD22 ASN 24 HD22 ASN 24 89.048 -11.567 8.180 189 H ILE 25 H ILE 25 92.656 -13.626 5.499 190 HA ILE 25 HA ILE 25 95.127 -13.324 3.883 191 HB ILE 25 HB ILE 25 93.348 -15.587 4.760 192 HG12 ILE 25 HG12 ILE 25 95.309 -14.863 6.103 193 HG13 ILE 25 HG13 ILE 25 95.512 -16.520 5.488 194 HG21 ILE 25 HG21 ILE 25 94.714 -17.117 3.266 195 HG22 ILE 25 HG22 ILE 25 95.276 -15.665 2.405 196 HG23 ILE 25 HG23 ILE 25 93.547 -16.086 2.404 197 HD11 ILE 25 HD11 ILE 25 97.467 -14.698 5.266 198 HD12 ILE 25 HD12 ILE 25 96.552 -14.252 3.806 199 HD13 ILE 25 HD13 ILE 25 97.179 -15.907 3.992 200 H VAL 26 H VAL 26 91.980 -12.613 3.400 201 HA VAL 26 HA VAL 26 91.684 -13.642 0.643 202 HB VAL 26 HB VAL 26 90.104 -11.555 2.212 203 HG11 VAL 26 HG11 VAL 26 89.884 -11.281 -0.243 204 HG12 VAL 26 HG12 VAL 26 89.481 -13.008 -0.399 205 HG13 VAL 26 HG13 VAL 26 88.378 -11.912 0.466 206 HG21 VAL 26 HG21 VAL 26 88.468 -13.402 2.469 207 HG22 VAL 26 HG22 VAL 26 90.039 -13.835 3.186 208 HG23 VAL 26 HG23 VAL 26 89.570 -14.498 1.602 209 H LYS 27 H LYS 27 91.878 -10.326 2.038 210 HA LYS 27 HA LYS 27 92.326 -9.003 -0.461 211 HB2 LYS 27 HB3 LYS 27 93.606 -8.180 2.176 212 HB3 LYS 27 HB2 LYS 27 93.083 -7.131 0.836 213 HG2 LYS 27 HG2 LYS 27 90.712 -7.989 1.248 214 HG3 LYS 27 HG3 LYS 27 91.330 -8.734 2.741 215 HD2 LYS 27 HD2 LYS 27 91.975 -6.588 3.638 216 HD3 LYS 27 HD3 LYS 27 91.671 -5.780 2.082 217 HE2 LYS 27 HE3 LYS 27 89.272 -6.285 2.256 218 HE3 LYS 27 HE2 LYS 27 89.550 -7.182 3.768 219 HZ1 LYS 27 HZ1 LYS 27 88.821 -4.930 4.191 220 HZ2 LYS 27 HZ2 LYS 27 90.356 -5.143 4.753 221 HZ3 LYS 27 HZ3 LYS 27 90.099 -4.312 3.352 222 H ARG 28 H ARG 28 94.536 -10.709 1.721 223 HA ARG 28 HA ARG 28 96.988 -9.828 0.440 224 HB2 ARG 28 HB2 ARG 28 97.554 -10.847 2.409 225 HB3 ARG 28 HB3 ARG 28 96.148 -11.933 2.367 226 HG2 ARG 28 HG2 ARG 28 98.326 -13.155 2.155 227 HG3 ARG 28 HG3 ARG 28 97.269 -13.389 0.745 228 HD2 ARG 28 HD3 ARG 28 98.858 -11.040 0.275 229 HD3 ARG 28 HD2 ARG 28 99.948 -12.341 0.812 230 HE ARG 28 HE ARG 28 98.751 -12.192 -1.787 231 HH11 ARG 28 HH11 ARG 28 98.710 -14.057 -3.067 232 HH12 ARG 28 HH12 ARG 28 98.872 -15.632 -2.323 233 HH21 ARG 28 HH21 ARG 28 99.151 -14.362 0.907 234 HH22 ARG 28 HH22 ARG 28 99.121 -15.804 -0.084 235 H LYS 29 H LYS 29 95.039 -12.837 0.052 236 HA LYS 29 HA LYS 29 96.589 -13.987 -2.041 237 HB2 LYS 29 HB2 LYS 29 93.684 -14.108 -1.250 238 HB3 LYS 29 HB3 LYS 29 94.172 -14.820 -2.806 239 HG2 LYS 29 HG3 LYS 29 95.851 -16.215 -1.671 240 HG3 LYS 29 HG2 LYS 29 95.451 -15.460 -0.109 241 HD2 LYS 29 HD2 LYS 29 93.241 -16.405 -0.116 242 HD3 LYS 29 HD3 LYS 29 93.387 -16.904 -1.818 243 HE2 LYS 29 HE2 LYS 29 95.175 -17.955 0.415 244 HE3 LYS 29 HE3 LYS 29 93.705 -18.786 -0.148 245 HZ1 LYS 29 HZ1 LYS 29 95.672 -19.600 -1.267 246 HZ2 LYS 29 HZ2 LYS 29 94.670 -18.861 -2.349 247 HZ3 LYS 29 HZ3 LYS 29 96.033 -18.092 -1.827 248 H LEU 30 H LEU 30 94.183 -11.382 -2.140 249 HA LEU 30 HA LEU 30 94.300 -11.304 -5.113 250 HB2 LEU 30 HB2 LEU 30 92.852 -9.645 -3.019 251 HB3 LEU 30 HB3 LEU 30 92.841 -9.221 -4.748 252 HG LEU 30 HG LEU 30 92.169 -12.047 -3.936 253 HD11 LEU 30 HD11 LEU 30 90.801 -10.617 -2.441 254 HD12 LEU 30 HD12 LEU 30 89.791 -11.395 -3.683 255 HD13 LEU 30 HD13 LEU 30 90.242 -9.682 -3.849 256 HD21 LEU 30 HD21 LEU 30 92.413 -11.417 -6.324 257 HD22 LEU 30 HD22 LEU 30 91.183 -10.148 -6.114 258 HD23 LEU 30 HD23 LEU 30 90.731 -11.862 -5.949 259 H ALA 31 H ALA 31 96.030 -10.114 -2.492 260 HA ALA 31 HA ALA 31 96.937 -7.620 -3.825 261 HB1 ALA 31 HB1 ALA 31 98.624 -7.733 -1.817 262 HB2 ALA 31 HB2 ALA 31 97.571 -9.041 -1.228 263 HB3 ALA 31 HB3 ALA 31 96.907 -7.409 -1.479 264 H ALA 32 H ALA 32 98.429 -10.754 -2.854 265 HA ALA 32 HA ALA 32 101.019 -10.411 -3.829 266 HB1 ALA 32 HB1 ALA 32 100.586 -12.915 -4.755 267 HB2 ALA 32 HB2 ALA 32 100.748 -12.552 -3.021 268 HB3 ALA 32 HB3 ALA 32 99.132 -12.734 -3.745 269 H HIS 33 H HIS 33 98.284 -11.606 -5.844 270 HA HIS 33 HA HIS 33 99.841 -11.207 -8.310 271 HB2 HIS 33 HB3 HIS 33 97.828 -12.844 -7.801 272 HB3 HIS 33 HB2 HIS 33 96.828 -11.442 -8.251 273 HD2 HIS 33 HD2 HIS 33 96.919 -13.984 -10.361 274 HE1 HIS 33 HE1 HIS 33 99.457 -11.520 -12.667 275 HE2 HIS 33 HE2 HIS 33 97.961 -13.587 -12.738 276 H ASP 34 H ASP 34 99.866 -8.817 -6.853 277 HA ASP 34 HA ASP 34 97.988 -7.084 -8.477 278 HB2 ASP 34 HB2 ASP 34 97.672 -7.028 -5.971 279 HB3 ASP 34 HB3 ASP 34 99.335 -6.410 -5.825 280 H ASN 35 H ASN 35 99.250 -6.557 -10.239 281 HA ASN 35 HA ASN 35 102.118 -5.869 -9.853 282 HB2 ASN 35 HB2 ASN 35 100.450 -5.491 -12.371 283 HB3 ASN 35 HB3 ASN 35 102.212 -5.712 -12.243 284 HD21 ASN 35 HD21 ASN 35 100.039 -7.385 -13.657 285 HD22 ASN 35 HD22 ASN 35 100.290 -9.001 -13.036 286 H LEU 36 H LEU 36 100.456 -4.178 -8.327 287 HA LEU 36 HA LEU 36 99.501 -1.824 -9.523 288 HB2 LEU 36 HB3 LEU 36 99.675 -0.782 -7.424 289 HB3 LEU 36 HB2 LEU 36 99.603 -2.509 -7.013 290 HG LEU 36 HG LEU 36 102.343 -1.444 -7.493 291 HD11 LEU 36 HD11 LEU 36 101.298 0.473 -6.314 292 HD12 LEU 36 HD12 LEU 36 100.705 -0.629 -5.048 293 HD13 LEU 36 HD13 LEU 36 102.454 -0.373 -5.257 294 HD21 LEU 36 HD21 LEU 36 101.351 -2.876 -5.025 295 HD22 LEU 36 HD22 LEU 36 102.907 -3.037 -5.875 296 HD23 LEU 36 HD23 LEU 36 101.436 -3.762 -6.567 297 H LYS 37 H LYS 37 100.402 0.280 -9.848 298 HA LYS 37 HA LYS 37 103.262 0.137 -10.803 299 HB2 LYS 37 HB3 LYS 37 101.732 0.728 -12.574 300 HB3 LYS 37 HB2 LYS 37 100.902 1.915 -11.542 301 HG2 LYS 37 HG3 LYS 37 102.688 3.443 -11.641 302 HG3 LYS 37 HG2 LYS 37 103.864 2.187 -12.097 303 HD2 LYS 37 HD2 LYS 37 103.338 3.586 -14.050 304 HD3 LYS 37 HD3 LYS 37 102.705 1.940 -14.297 305 HE2 LYS 37 HE2 LYS 37 100.461 2.644 -13.691 306 HE3 LYS 37 HE3 LYS 37 101.047 4.252 -13.201 307 HZ1 LYS 37 HZ1 LYS 37 100.102 4.285 -15.412 308 HZ2 LYS 37 HZ2 LYS 37 101.170 3.141 -15.933 309 HZ3 LYS 37 HZ3 LYS 37 101.713 4.631 -15.480 310 H LEU 38 H LEU 38 104.727 1.803 -10.214 311 HA LEU 38 HA LEU 38 103.706 3.768 -8.173 312 HB2 LEU 38 HB2 LEU 38 106.274 2.181 -7.779 313 HB3 LEU 38 HB3 LEU 38 105.468 3.258 -6.615 314 HG LEU 38 HG LEU 38 103.432 1.536 -7.084 315 HD11 LEU 38 HD11 LEU 38 104.764 0.177 -8.677 316 HD12 LEU 38 HD12 LEU 38 105.983 -0.109 -7.412 317 HD13 LEU 38 HD13 LEU 38 104.339 -0.767 -7.229 318 HD21 LEU 38 HD21 LEU 38 104.409 2.120 -4.879 319 HD22 LEU 38 HD22 LEU 38 104.131 0.367 -5.013 320 HD23 LEU 38 HD23 LEU 38 105.776 1.024 -5.196 321 H THR 39 H THR 39 104.351 5.764 -8.745 322 HA THR 39 HA THR 39 106.741 5.998 -10.572 323 HB THR 39 HB THR 39 104.824 8.240 -9.853 324 HG1 THR 39 HG1 THR 39 103.618 7.546 -11.707 325 HG21 THR 39 HG21 THR 39 105.482 9.032 -12.108 326 HG22 THR 39 HG22 THR 39 106.490 7.581 -12.323 327 HG23 THR 39 HG23 THR 39 106.911 8.780 -11.077 328 H ILE 40 H ILE 40 108.583 6.236 -9.365 329 HA ILE 40 HA ILE 40 108.357 7.832 -6.822 330 HB ILE 40 HB ILE 40 110.501 5.941 -7.874 331 HG12 ILE 40 HG13 ILE 40 109.775 4.898 -5.534 332 HG13 ILE 40 HG12 ILE 40 108.289 5.831 -5.822 333 HG21 ILE 40 HG21 ILE 40 111.623 6.328 -5.696 334 HG22 ILE 40 HG22 ILE 40 111.519 7.835 -6.636 335 HG23 ILE 40 HG23 ILE 40 110.398 7.552 -5.283 336 HD11 ILE 40 HD11 ILE 40 108.793 3.289 -6.813 337 HD12 ILE 40 HD12 ILE 40 107.592 4.425 -7.471 338 HD13 ILE 40 HD13 ILE 40 109.215 4.328 -8.195 339 H THR 41 H THR 41 109.293 9.779 -6.598 340 HA THR 41 HA THR 41 111.230 10.661 -8.744 341 HB THR 41 HB THR 41 109.372 12.620 -7.399 342 HG1 THR 41 HG1 THR 41 107.898 11.160 -8.166 343 HG21 THR 41 HG21 THR 41 109.635 13.773 -9.577 344 HG22 THR 41 HG22 THR 41 110.594 12.403 -10.186 345 HG23 THR 41 HG23 THR 41 111.218 13.403 -8.852 346 H GLN 42 H GLN 42 112.853 12.169 -7.967 347 HA GLN 42 HA GLN 42 112.962 12.346 -4.947 348 HB2 GLN 42 HB2 GLN 42 114.511 10.598 -5.530 349 HB3 GLN 42 HB3 GLN 42 115.161 11.540 -6.893 350 HG2 GLN 42 HG3 GLN 42 116.287 13.053 -5.468 351 HG3 GLN 42 HG2 GLN 42 115.285 12.619 -4.062 352 HE21 GLN 42 HE21 GLN 42 115.906 10.786 -2.794 353 HE22 GLN 42 HE22 GLN 42 117.361 9.871 -3.118 354 H GLU 43 H GLU 43 113.945 14.252 -4.120 355 HA GLU 43 HA GLU 43 114.921 16.240 -6.143 356 HB2 GLU 43 HB3 GLU 43 112.509 16.590 -4.336 357 HB3 GLU 43 HB2 GLU 43 113.452 17.991 -4.897 358 HG2 GLU 43 HG2 GLU 43 113.138 17.183 -7.261 359 HG3 GLU 43 HG3 GLU 43 112.070 15.902 -6.638 360 H GLY 44 H GLY 44 116.936 15.631 -4.994 361 HA2 GLY 44 HA2 GLY 44 118.618 16.203 -3.443 362 HA3 GLY 44 HA3 GLY 44 117.611 17.594 -2.981 363 H ASN 45 H ASN 45 116.041 17.318 -1.278 364 HA ASN 45 HA ASN 45 116.522 14.833 0.384 365 HB2 ASN 45 HB2 ASN 45 116.208 16.358 2.394 366 HB3 ASN 45 HB3 ASN 45 117.703 16.638 1.469 367 HD21 ASN 45 HD21 ASN 45 117.410 18.382 -0.378 368 HD22 ASN 45 HD22 ASN 45 116.459 19.784 0.060 369 H LYS 46 H LYS 46 114.351 15.547 -1.554 370 HA LYS 46 HA LYS 46 112.106 15.000 0.332 371 HB2 LYS 46 HB2 LYS 46 111.933 17.399 0.141 372 HB3 LYS 46 HB3 LYS 46 112.250 17.345 -1.609 373 HG2 LYS 46 HG2 LYS 46 109.988 15.642 -0.913 374 HG3 LYS 46 HG3 LYS 46 109.727 17.305 -0.337 375 HD2 LYS 46 HD2 LYS 46 110.374 18.124 -2.642 376 HD3 LYS 46 HD3 LYS 46 110.409 16.427 -3.178 377 HE2 LYS 46 HE2 LYS 46 108.079 16.147 -2.823 378 HE3 LYS 46 HE3 LYS 46 107.973 17.595 -1.794 379 HZ1 LYS 46 HZ1 LYS 46 107.123 18.011 -4.005 380 HZ2 LYS 46 HZ2 LYS 46 108.564 17.587 -4.687 381 HZ3 LYS 46 HZ3 LYS 46 108.466 18.929 -3.733 382 H PHE 47 H PHE 47 111.489 13.105 -0.480 383 HA PHE 47 HA PHE 47 111.583 12.691 -3.453 384 HB2 PHE 47 HB3 PHE 47 110.740 10.501 -1.595 385 HB3 PHE 47 HB2 PHE 47 111.788 10.437 -3.032 386 HD1 PHE 47 HD1 PHE 47 113.665 12.698 -2.318 387 HD2 PHE 47 HD2 PHE 47 112.133 9.440 0.025 388 HE1 PHE 47 HE1 PHE 47 115.671 12.801 -0.863 389 HE2 PHE 47 HE2 PHE 47 114.136 9.548 1.483 390 HZ PHE 47 HZ PHE 47 115.905 11.227 1.039 391 H THR 48 H THR 48 109.680 11.220 -4.238 392 HA THR 48 HA THR 48 107.101 11.857 -2.892 393 HB THR 48 HB THR 48 107.726 12.783 -5.735 394 HG1 THR 48 HG1 THR 48 107.381 14.861 -4.768 395 HG21 THR 48 HG21 THR 48 105.437 13.728 -5.647 396 HG22 THR 48 HG22 THR 48 105.210 13.027 -4.027 397 HG23 THR 48 HG23 THR 48 105.409 11.960 -5.438 398 H VAL 49 H VAL 49 106.505 9.750 -2.757 399 HA VAL 49 HA VAL 49 106.863 7.998 -5.166 400 HB VAL 49 HB VAL 49 105.930 7.376 -2.329 401 HG11 VAL 49 HG11 VAL 49 104.974 5.831 -4.018 402 HG12 VAL 49 HG12 VAL 49 106.602 5.541 -4.674 403 HG13 VAL 49 HG13 VAL 49 106.201 5.010 -3.023 404 HG21 VAL 49 HG21 VAL 49 108.152 6.291 -2.137 405 HG22 VAL 49 HG22 VAL 49 108.316 8.027 -2.497 406 HG23 VAL 49 HG23 VAL 49 108.554 6.824 -3.787 407 H LYS 50 H LYS 50 105.221 8.019 -6.609 408 HA LYS 50 HA LYS 50 102.445 8.538 -5.540 409 HB2 LYS 50 HB2 LYS 50 103.662 9.851 -7.536 410 HB3 LYS 50 HB3 LYS 50 103.062 8.469 -8.483 411 HG2 LYS 50 HG2 LYS 50 100.771 8.888 -7.702 412 HG3 LYS 50 HG3 LYS 50 101.345 10.213 -6.660 413 HD2 LYS 50 HD3 LYS 50 102.306 11.257 -8.827 414 HD3 LYS 50 HD2 LYS 50 101.282 10.088 -9.695 415 HE2 LYS 50 HE2 LYS 50 99.315 10.951 -8.335 416 HE3 LYS 50 HE3 LYS 50 100.384 12.243 -7.738 417 HZ1 LYS 50 HZ1 LYS 50 99.139 12.942 -9.673 418 HZ2 LYS 50 HZ2 LYS 50 99.760 11.707 -10.573 419 HZ3 LYS 50 HZ3 LYS 50 100.751 12.904 -10.021 420 H GLU 51 H GLU 51 101.707 6.512 -4.925 421 HA GLU 51 HA GLU 51 102.274 4.120 -6.542 422 HB2 GLU 51 HB2 GLU 51 100.185 4.605 -4.368 423 HB3 GLU 51 HB3 GLU 51 100.655 3.017 -5.019 424 HG2 GLU 51 HG3 GLU 51 102.032 3.127 -3.142 425 HG3 GLU 51 HG2 GLU 51 103.102 3.846 -4.369 426 H SER 52 H SER 52 100.708 2.935 -7.818 427 HA SER 52 HA SER 52 98.123 4.285 -8.378 428 HB2 SER 52 HB2 SER 52 99.796 3.678 -10.799 429 HB3 SER 52 HB3 SER 52 98.526 4.905 -10.575 430 HG SER 52 HG SER 52 100.646 5.834 -10.645 431 H SER 53 H SER 53 96.933 2.568 -7.953 432 HA SER 53 HA SER 53 97.490 0.056 -9.532 433 HB2 SER 53 HB2 SER 53 97.457 -1.243 -7.658 434 HB3 SER 53 HB3 SER 53 97.767 0.267 -6.768 435 HG SER 53 HG SER 53 95.922 -0.539 -5.874 436 H ALA 54 H ALA 54 95.600 -0.927 -10.362 437 HA ALA 54 HA ALA 54 93.360 0.784 -10.874 438 HB1 ALA 54 HB1 ALA 54 92.199 -1.278 -11.616 439 HB2 ALA 54 HB2 ALA 54 93.876 -1.240 -12.210 440 HB3 ALA 54 HB3 ALA 54 93.447 -2.267 -10.821 441 H PHE 55 H PHE 55 94.268 -0.124 -7.900 442 HA PHE 55 HA PHE 55 91.446 -0.668 -6.975 443 HB2 PHE 55 HB2 PHE 55 94.085 -1.124 -5.518 444 HB3 PHE 55 HB3 PHE 55 92.466 -1.573 -4.928 445 HD1 PHE 55 HD1 PHE 55 95.308 -2.645 -6.817 446 HD2 PHE 55 HD2 PHE 55 91.050 -3.115 -6.489 447 HE1 PHE 55 HE1 PHE 55 95.448 -4.787 -8.059 448 HE2 PHE 55 HE2 PHE 55 91.192 -5.257 -7.731 449 HZ PHE 55 HZ PHE 55 93.390 -6.093 -8.516 450 H ARG 56 H ARG 56 94.150 1.612 -6.722 451 HA ARG 56 HA ARG 56 92.612 3.773 -5.805 452 HB2 ARG 56 HB2 ARG 56 93.369 3.668 -3.271 453 HB3 ARG 56 HB3 ARG 56 91.895 2.816 -3.789 454 HG2 ARG 56 HG2 ARG 56 92.828 0.745 -3.474 455 HG3 ARG 56 HG3 ARG 56 94.426 1.266 -4.061 456 HD2 ARG 56 HD2 ARG 56 94.414 0.697 -1.612 457 HD3 ARG 56 HD3 ARG 56 94.891 2.382 -1.933 458 HE ARG 56 HE ARG 56 91.993 1.983 -1.398 459 HH11 ARG 56 HH11 ARG 56 91.266 3.029 0.469 460 HH12 ARG 56 HH12 ARG 56 92.419 3.682 1.611 461 HH21 ARG 56 HH21 ARG 56 95.199 2.668 -0.223 462 HH22 ARG 56 HH22 ARG 56 94.635 3.479 1.221 463 H ASN 57 H ASN 57 94.260 4.681 -7.137 464 HA ASN 57 HA ASN 57 97.084 4.453 -6.576 465 HB2 ASN 57 HB2 ASN 57 95.679 6.872 -7.783 466 HB3 ASN 57 HB3 ASN 57 97.353 6.336 -8.063 467 HD21 ASN 57 HD21 ASN 57 95.747 6.656 -10.319 468 HD22 ASN 57 HD22 ASN 57 95.304 5.089 -10.959 469 H ILE 58 H ILE 58 98.446 5.623 -5.245 470 HA ILE 58 HA ILE 58 97.157 7.772 -3.557 471 HB ILE 58 HB ILE 58 99.228 5.944 -2.368 472 HG12 ILE 58 HG12 ILE 58 96.287 5.307 -2.791 473 HG13 ILE 58 HG13 ILE 58 97.702 4.300 -3.190 474 HG21 ILE 58 HG21 ILE 58 98.106 8.136 -1.380 475 HG22 ILE 58 HG22 ILE 58 96.754 7.035 -1.023 476 HG23 ILE 58 HG23 ILE 58 98.366 6.718 -0.337 477 HD11 ILE 58 HD11 ILE 58 97.013 3.346 -1.167 478 HD12 ILE 58 HD12 ILE 58 96.483 4.907 -0.496 479 HD13 ILE 58 HD13 ILE 58 98.219 4.529 -0.607 480 H GLU 59 H GLU 59 98.954 8.917 -2.259 481 HA GLU 59 HA GLU 59 101.569 9.033 -3.688 482 HB2 GLU 59 HB3 GLU 59 101.403 11.267 -4.426 483 HB3 GLU 59 HB2 GLU 59 99.803 10.600 -4.826 484 HG2 GLU 59 HG3 GLU 59 99.176 11.420 -2.390 485 HG3 GLU 59 HG2 GLU 59 100.586 12.486 -2.600 486 H CYS 60 H CYS 60 103.201 9.839 -2.349 487 HA CYS 60 HA CYS 60 102.472 11.241 0.160 488 HB2 CYS 60 HB2 CYS 60 102.230 8.576 0.377 489 HB3 CYS 60 HB3 CYS 60 103.993 8.685 0.595 490 HG CYS 60 HG CYS 60 101.882 10.741 2.408 491 H VAL 61 H VAL 61 104.091 12.649 0.579 492 HA VAL 61 HA VAL 61 106.607 12.436 -0.950 493 HB VAL 61 HB VAL 61 105.903 14.659 -0.658 494 HG11 VAL 61 HG11 VAL 61 105.456 15.396 1.878 495 HG12 VAL 61 HG12 VAL 61 104.174 14.666 0.882 496 HG13 VAL 61 HG13 VAL 61 105.070 13.667 2.052 497 HG21 VAL 61 HG21 VAL 61 107.580 15.728 0.728 498 HG22 VAL 61 HG22 VAL 61 108.314 14.267 0.025 499 HG23 VAL 61 HG23 VAL 61 107.768 14.261 1.719 500 H PHE 62 H PHE 62 108.744 12.573 0.180 501 HA PHE 62 HA PHE 62 108.707 11.333 2.913 502 HB2 PHE 62 HB2 PHE 62 109.980 10.126 0.434 503 HB3 PHE 62 HB3 PHE 62 110.536 9.719 2.075 504 HD1 PHE 62 HD1 PHE 62 108.475 8.608 -0.471 505 HD2 PHE 62 HD2 PHE 62 108.370 9.352 3.758 506 HE1 PHE 62 HE1 PHE 62 106.600 7.003 -0.235 507 HE2 PHE 62 HE2 PHE 62 106.493 7.749 3.992 508 HZ PHE 62 HZ PHE 62 105.607 6.575 1.997 509 H GLU 63 H GLU 63 109.980 12.587 4.130 510 HA GLU 63 HA GLU 63 112.346 13.920 2.790 511 HB2 GLU 63 HB3 GLU 63 110.294 15.125 4.139 512 HB3 GLU 63 HB2 GLU 63 111.427 14.836 5.479 513 HG2 GLU 63 HG2 GLU 63 112.235 16.152 2.854 514 HG3 GLU 63 HG3 GLU 63 111.726 17.065 4.295 515 H LEU 64 H LEU 64 114.274 14.190 4.279 516 HA LEU 64 HA LEU 64 114.584 11.660 5.892 517 HB2 LEU 64 HB3 LEU 64 116.634 13.567 4.680 518 HB3 LEU 64 HB2 LEU 64 117.043 12.150 5.676 519 HG LEU 64 HG LEU 64 115.381 12.012 3.123 520 HD11 LEU 64 HD11 LEU 64 117.437 11.102 2.074 521 HD12 LEU 64 HD12 LEU 64 117.692 12.770 2.640 522 HD13 LEU 64 HD13 LEU 64 118.338 11.404 3.579 523 HD21 LEU 64 HD21 LEU 64 115.022 10.175 4.754 524 HD22 LEU 64 HD22 LEU 64 116.777 9.886 4.812 525 HD23 LEU 64 HD23 LEU 64 115.876 9.588 3.307 526 H GLY 65 H GLY 65 114.390 11.901 8.065 527 HA2 GLY 65 HA2 GLY 65 115.140 12.816 10.177 528 HA3 GLY 65 HA3 GLY 65 115.715 14.271 9.332 529 H VAL 66 H VAL 66 112.529 13.170 8.475 530 HA VAL 66 HA VAL 66 111.302 15.049 10.478 531 HB VAL 66 HB VAL 66 110.617 15.176 7.517 532 HG11 VAL 66 HG11 VAL 66 108.902 15.964 9.127 533 HG12 VAL 66 HG12 VAL 66 109.585 17.324 8.203 534 HG13 VAL 66 HG13 VAL 66 110.105 17.038 9.881 535 HG21 VAL 66 HG21 VAL 66 112.358 17.141 9.060 536 HG22 VAL 66 HG22 VAL 66 112.041 17.101 7.309 537 HG23 VAL 66 HG23 VAL 66 113.036 15.831 8.062 538 H THR 67 H THR 67 110.016 13.574 11.519 539 HA THR 67 HA THR 67 108.872 11.232 10.348 540 HB THR 67 HB THR 67 107.334 12.726 12.454 541 HG1 THR 67 HG1 THR 67 109.399 13.134 13.143 542 HG21 THR 67 HG21 THR 67 106.969 10.549 13.329 543 HG22 THR 67 HG22 THR 67 106.908 10.323 11.565 544 HG23 THR 67 HG23 THR 67 108.374 9.874 12.469 545 H PHE 68 H PHE 68 106.968 10.795 9.369 546 HA PHE 68 HA PHE 68 104.925 12.918 9.018 547 HB2 PHE 68 HB3 PHE 68 105.060 12.231 6.411 548 HB3 PHE 68 HB2 PHE 68 105.944 13.624 7.075 549 HD1 PHE 68 HD1 PHE 68 106.402 9.890 6.819 550 HD2 PHE 68 HD2 PHE 68 108.169 13.791 6.487 551 HE1 PHE 68 HE1 PHE 68 108.551 8.860 6.120 552 HE2 PHE 68 HE2 PHE 68 110.316 12.761 5.800 553 HZ PHE 68 HZ PHE 68 110.504 10.298 5.614 554 H ASN 69 H ASN 69 103.349 11.700 7.106 555 HA ASN 69 HA ASN 69 103.134 8.869 8.131 556 HB2 ASN 69 HB2 ASN 69 100.766 9.101 8.475 557 HB3 ASN 69 HB3 ASN 69 101.536 10.481 9.294 558 HD21 ASN 69 HD21 ASN 69 101.487 12.613 8.141 559 HD22 ASN 69 HD22 ASN 69 100.227 12.914 6.965 560 H CYS 70 H CYS 70 102.150 7.391 6.710 561 HA CYS 70 HA CYS 70 101.341 8.362 4.004 562 HB2 CYS 70 HB2 CYS 70 103.714 6.523 4.529 563 HB3 CYS 70 HB3 CYS 70 102.890 6.616 2.954 564 HG CYS 70 HG CYS 70 105.311 8.539 3.971 565 H ASN 71 H ASN 71 99.590 7.166 3.383 566 HA ASN 71 HA ASN 71 98.922 4.804 5.083 567 HB2 ASN 71 HB2 ASN 71 96.797 4.915 3.528 568 HB3 ASN 71 HB3 ASN 71 97.029 6.149 4.790 569 HD21 ASN 71 HD21 ASN 71 97.538 8.328 4.132 570 HD22 ASN 71 HD22 ASN 71 97.501 8.817 2.453 571 H LEU 72 H LEU 72 98.668 2.705 4.316 572 HA LEU 72 HA LEU 72 100.000 2.206 1.661 573 HB2 LEU 72 HB2 LEU 72 99.282 0.277 3.914 574 HB3 LEU 72 HB3 LEU 72 100.210 -0.127 2.451 575 HG LEU 72 HG LEU 72 101.011 1.875 4.609 576 HD11 LEU 72 HD11 LEU 72 101.830 -0.943 3.876 577 HD12 LEU 72 HD12 LEU 72 103.010 0.156 4.629 578 HD13 LEU 72 HD13 LEU 72 101.501 -0.250 5.482 579 HD21 LEU 72 HD21 LEU 72 103.226 1.627 3.129 580 HD22 LEU 72 HD22 LEU 72 101.971 2.819 2.714 581 HD23 LEU 72 HD23 LEU 72 102.044 1.266 1.848 582 H ALA 73 H ALA 73 98.988 0.960 0.052 583 HA ALA 73 HA ALA 73 96.276 1.325 -0.485 584 HB1 ALA 73 HB1 ALA 73 96.406 -0.674 -1.946 585 HB2 ALA 73 HB2 ALA 73 97.876 0.320 -2.087 586 HB3 ALA 73 HB3 ALA 73 97.903 -1.176 -1.124 587 H ASP 74 H ASP 74 97.703 -1.029 1.731 588 HA ASP 74 HA ASP 74 95.326 -2.682 2.004 589 HB2 ASP 74 HB2 ASP 74 97.603 -2.109 3.954 590 HB3 ASP 74 HB3 ASP 74 96.382 -3.386 4.169 591 H GLY 75 H GLY 75 95.222 0.437 2.254 592 HA2 GLY 75 HA2 GLY 75 93.832 1.927 3.450 593 HA3 GLY 75 HA3 GLY 75 92.993 0.497 4.098 594 H THR 76 H THR 76 96.463 0.894 4.515 595 HA THR 76 HA THR 76 95.952 1.154 7.465 596 HB THR 76 HB THR 76 98.732 0.793 6.498 597 HG1 THR 76 HG1 THR 76 97.708 -0.502 4.976 598 HG21 THR 76 HG21 THR 76 98.709 -0.921 8.287 599 HG22 THR 76 HG22 THR 76 98.067 0.631 8.875 600 HG23 THR 76 HG23 THR 76 96.953 -0.699 8.476 601 H GLU 77 H GLU 77 97.400 2.576 8.686 602 HA GLU 77 HA GLU 77 98.411 4.914 7.068 603 HB2 GLU 77 HB2 GLU 77 96.172 5.442 8.074 604 HB3 GLU 77 HB3 GLU 77 96.846 5.087 9.683 605 HG2 GLU 77 HG2 GLU 77 98.589 6.848 9.292 606 HG3 GLU 77 HG3 GLU 77 97.795 7.248 7.750 607 H LEU 78 H LEU 78 100.581 5.081 7.501 608 HA LEU 78 HA LEU 78 101.424 4.395 10.328 609 HB2 LEU 78 HB2 LEU 78 103.462 3.969 8.221 610 HB3 LEU 78 HB3 LEU 78 103.038 2.954 9.618 611 HG LEU 78 HG LEU 78 101.188 3.162 7.222 612 HD11 LEU 78 HD11 LEU 78 103.860 1.983 7.317 613 HD12 LEU 78 HD12 LEU 78 102.622 0.735 7.037 614 HD13 LEU 78 HD13 LEU 78 102.743 2.131 5.939 615 HD21 LEU 78 HD21 LEU 78 100.339 2.146 9.323 616 HD22 LEU 78 HD22 LEU 78 100.486 0.925 8.037 617 HD23 LEU 78 HD23 LEU 78 101.709 1.010 9.327 618 H ARG 79 H ARG 79 103.366 5.485 11.073 619 HA ARG 79 HA ARG 79 104.194 7.852 9.409 620 HB2 ARG 79 HB2 ARG 79 103.847 9.418 11.189 621 HB3 ARG 79 HB3 ARG 79 102.340 8.478 11.067 622 HG2 ARG 79 HG3 ARG 79 103.263 6.951 12.880 623 HG3 ARG 79 HG2 ARG 79 104.592 8.117 13.088 624 HD2 ARG 79 HD3 ARG 79 102.611 9.873 13.269 625 HD3 ARG 79 HD2 ARG 79 101.653 8.436 13.698 626 HE ARG 79 HE ARG 79 102.816 8.318 15.774 627 HH11 ARG 79 HH11 ARG 79 104.318 9.128 17.256 628 HH12 ARG 79 HH12 ARG 79 105.496 10.317 16.747 629 HH21 ARG 79 HH21 ARG 79 104.355 10.412 13.458 630 HH22 ARG 79 HH22 ARG 79 105.517 11.041 14.605 631 H GLY 80 H GLY 80 106.351 8.457 9.719 632 HA2 GLY 80 HA3 GLY 80 107.981 7.894 11.955 633 HA3 GLY 80 HA2 GLY 80 108.093 6.456 10.905 634 H THR 81 H THR 81 109.767 6.570 9.488 635 HA THR 81 HA THR 81 110.122 8.691 7.618 636 HB THR 81 HB THR 81 112.472 9.210 9.185 637 HG1 THR 81 HG1 THR 81 111.624 9.845 11.106 638 HG21 THR 81 HG21 THR 81 111.499 11.542 9.162 639 HG22 THR 81 HG22 THR 81 111.554 10.766 7.561 640 HG23 THR 81 HG23 THR 81 110.016 10.859 8.452 641 H TRP 82 H TRP 82 112.117 8.488 6.367 642 HA TRP 82 HA TRP 82 113.278 5.724 6.691 643 HB2 TRP 82 HB3 TRP 82 113.657 7.535 4.286 644 HB3 TRP 82 HB2 TRP 82 113.789 5.763 4.375 645 HD1 TRP 82 HD1 TRP 82 111.049 8.435 4.990 646 HE1 TRP 82 HE1 TRP 82 108.801 7.537 4.117 647 HE3 TRP 82 HE3 TRP 82 112.581 3.825 3.432 648 HZ2 TRP 82 HZ2 TRP 82 107.812 5.112 2.889 649 HZ3 TRP 82 HZ3 TRP 82 110.972 2.240 2.414 650 HH2 TRP 82 HH2 TRP 82 108.591 2.879 2.138 651 H SER 83 H SER 83 115.500 5.426 6.863 652 HA SER 83 HA SER 83 117.194 7.921 6.887 653 HB2 SER 83 HB2 SER 83 116.606 6.058 9.150 654 HB3 SER 83 HB3 SER 83 118.315 6.509 8.935 655 HG SER 83 HG SER 83 117.157 8.018 10.263 656 H LEU 84 H LEU 84 119.526 7.385 6.551 657 HA LEU 84 HA LEU 84 119.702 4.813 5.014 658 HB2 LEU 84 HB3 LEU 84 120.700 6.265 3.572 659 HB3 LEU 84 HB2 LEU 84 120.955 7.485 4.841 660 HG LEU 84 HG LEU 84 122.866 6.083 5.704 661 HD11 LEU 84 HD11 LEU 84 123.265 4.658 3.182 662 HD12 LEU 84 HD12 LEU 84 121.751 4.159 3.974 663 HD13 LEU 84 HD13 LEU 84 123.296 4.033 4.849 664 HD21 LEU 84 HD21 LEU 84 124.420 6.743 3.886 665 HD22 LEU 84 HD22 LEU 84 123.036 6.981 2.792 666 HD23 LEU 84 HD23 LEU 84 123.236 8.030 4.216 667 H GLU 85 H GLU 85 120.779 3.106 5.858 668 HA GLU 85 HA GLU 85 122.676 3.652 8.146 669 HB2 GLU 85 HB2 GLU 85 120.345 1.763 7.956 670 HB3 GLU 85 HB3 GLU 85 121.800 1.199 8.812 671 HG2 GLU 85 HG3 GLU 85 121.732 3.360 10.148 672 HG3 GLU 85 HG2 GLU 85 120.148 3.689 9.407 673 H GLY 86 H GLY 86 124.676 3.020 7.527 674 HA2 GLY 86 HA3 GLY 86 126.354 1.764 6.436 675 HA3 GLY 86 HA2 GLY 86 125.229 0.385 6.501 676 H ASN 87 H ASN 87 124.303 -0.284 4.601 677 HA ASN 87 HA ASN 87 124.514 1.628 2.265 678 HB2 ASN 87 HB2 ASN 87 126.156 -0.370 2.306 679 HB3 ASN 87 HB3 ASN 87 124.727 -1.389 2.014 680 HD21 ASN 87 HD21 ASN 87 123.549 1.095 0.480 681 HD22 ASN 87 HD22 ASN 87 124.313 0.969 -1.088 682 H LYS 88 H LYS 88 122.173 1.210 4.036 683 HA LYS 88 HA LYS 88 120.315 0.320 1.852 684 HB2 LYS 88 HB3 LYS 88 118.984 -0.998 3.559 685 HB3 LYS 88 HB2 LYS 88 120.566 -1.704 3.156 686 HG2 LYS 88 HG3 LYS 88 120.500 0.244 5.429 687 HG3 LYS 88 HG2 LYS 88 119.739 -1.340 5.709 688 HD2 LYS 88 HD2 LYS 88 121.861 -2.419 4.839 689 HD3 LYS 88 HD3 LYS 88 122.604 -0.802 4.817 690 HE2 LYS 88 HE2 LYS 88 121.864 -0.634 7.295 691 HE3 LYS 88 HE3 LYS 88 121.610 -2.393 7.204 692 HZ1 LYS 88 HZ1 LYS 88 123.828 -1.853 7.959 693 HZ2 LYS 88 HZ2 LYS 88 124.134 -0.991 6.586 694 HZ3 LYS 88 HZ3 LYS 88 123.898 -2.622 6.501 695 H LEU 89 H LEU 89 118.264 1.303 1.949 696 HA LEU 89 HA LEU 89 118.170 3.682 3.770 697 HB2 LEU 89 HB3 LEU 89 116.979 2.909 1.156 698 HB3 LEU 89 HB2 LEU 89 115.886 3.807 2.236 699 HG LEU 89 HG LEU 89 118.725 4.766 1.834 700 HD11 LEU 89 HD11 LEU 89 117.794 4.435 -0.440 701 HD12 LEU 89 HD12 LEU 89 117.931 6.166 -0.052 702 HD13 LEU 89 HD13 LEU 89 116.345 5.361 0.018 703 HD21 LEU 89 HD21 LEU 89 117.638 6.948 2.302 704 HD22 LEU 89 HD22 LEU 89 117.294 5.772 3.593 705 HD23 LEU 89 HD23 LEU 89 116.053 6.142 2.373 706 H ILE 90 H ILE 90 117.242 3.348 5.722 707 HA ILE 90 HA ILE 90 115.345 1.093 6.063 708 HB ILE 90 HB ILE 90 115.288 2.210 8.473 709 HG12 ILE 90 HG13 ILE 90 117.944 3.180 7.357 710 HG13 ILE 90 HG12 ILE 90 116.533 4.238 7.612 711 HG21 ILE 90 HG21 ILE 90 116.234 -0.008 7.896 712 HG22 ILE 90 HG22 ILE 90 117.722 0.779 7.318 713 HG23 ILE 90 HG23 ILE 90 117.284 0.861 9.041 714 HD11 ILE 90 HD11 ILE 90 116.634 4.041 9.925 715 HD12 ILE 90 HD12 ILE 90 117.431 2.451 9.858 716 HD13 ILE 90 HD13 ILE 90 118.363 3.929 9.516 717 H GLY 91 H GLY 91 113.327 1.438 7.273 718 HA2 GLY 91 HA2 GLY 91 112.033 4.107 6.867 719 HA3 GLY 91 HA3 GLY 91 111.302 2.705 6.045 720 H LYS 92 H LYS 92 111.828 4.301 9.103 721 HA LYS 92 HA LYS 92 110.648 2.026 10.629 722 HB2 LYS 92 HB2 LYS 92 111.050 3.386 12.595 723 HB3 LYS 92 HB3 LYS 92 112.489 3.508 11.557 724 HG2 LYS 92 HG2 LYS 92 111.137 5.589 10.551 725 HG3 LYS 92 HG3 LYS 92 110.380 5.565 12.162 726 HD2 LYS 92 HD3 LYS 92 112.229 6.945 12.551 727 HD3 LYS 92 HD2 LYS 92 112.886 5.353 13.002 728 HE2 LYS 92 HE2 LYS 92 113.596 5.187 10.493 729 HE3 LYS 92 HE3 LYS 92 113.343 6.949 10.465 730 HZ1 LYS 92 HZ1 LYS 92 115.612 6.385 11.030 731 HZ2 LYS 92 HZ2 LYS 92 114.880 7.133 12.305 732 HZ3 LYS 92 HZ3 LYS 92 115.115 5.501 12.331 733 H PHE 93 H PHE 93 108.501 1.774 10.229 734 HA PHE 93 HA PHE 93 106.806 4.276 10.332 735 HB2 PHE 93 HB2 PHE 93 106.576 1.724 8.713 736 HB3 PHE 93 HB3 PHE 93 105.144 2.727 9.039 737 HD1 PHE 93 HD1 PHE 93 107.483 5.156 9.115 738 HD2 PHE 93 HD2 PHE 93 105.860 2.372 6.275 739 HE1 PHE 93 HE1 PHE 93 108.125 6.671 7.262 740 HE2 PHE 93 HE2 PHE 93 106.502 3.890 4.423 741 HZ PHE 93 HZ PHE 93 107.637 6.038 4.917 742 H LYS 94 H LYS 94 104.950 4.235 11.544 743 HA LYS 94 HA LYS 94 104.550 1.770 13.248 744 HB2 LYS 94 HB2 LYS 94 105.075 4.564 14.021 745 HB3 LYS 94 HB3 LYS 94 103.592 3.912 14.758 746 HG2 LYS 94 HG2 LYS 94 104.802 2.029 15.691 747 HG3 LYS 94 HG3 LYS 94 106.274 2.464 14.790 748 HD2 LYS 94 HD3 LYS 94 106.514 3.237 17.090 749 HD3 LYS 94 HD2 LYS 94 106.315 4.654 16.032 750 HE2 LYS 94 HE2 LYS 94 103.889 3.368 17.297 751 HE3 LYS 94 HE3 LYS 94 104.898 4.483 18.249 752 HZ1 LYS 94 HZ1 LYS 94 103.675 6.043 17.267 753 HZ2 LYS 94 HZ2 LYS 94 103.118 5.044 16.079 754 HZ3 LYS 94 HZ3 LYS 94 104.587 5.777 15.919 755 H ARG 95 H ARG 95 102.549 0.948 12.987 756 HA ARG 95 HA ARG 95 100.568 2.153 11.299 757 HB2 ARG 95 HB3 ARG 95 100.610 -0.075 13.312 758 HB3 ARG 95 HB2 ARG 95 99.019 0.558 12.826 759 HG2 ARG 95 HG2 ARG 95 99.720 0.263 10.415 760 HG3 ARG 95 HG3 ARG 95 101.195 -0.544 10.996 761 HD2 ARG 95 HD3 ARG 95 99.662 -2.317 10.553 762 HD3 ARG 95 HD2 ARG 95 99.614 -2.103 12.319 763 HE ARG 95 HE ARG 95 97.583 -0.419 11.195 764 HH11 ARG 95 HH11 ARG 95 95.450 -1.165 11.191 765 HH12 ARG 95 HH12 ARG 95 95.123 -2.879 11.324 766 HH21 ARG 95 HH21 ARG 95 98.484 -3.768 11.505 767 HH22 ARG 95 HH22 ARG 95 96.832 -4.346 11.501 768 H THR 96 H THR 96 99.521 4.036 11.685 769 HA THR 96 HA THR 96 99.408 5.202 14.358 770 HB THR 96 HB THR 96 97.507 6.575 12.977 771 HG1 THR 96 HG1 THR 96 97.988 4.919 11.228 772 HG21 THR 96 HG21 THR 96 99.349 8.073 12.271 773 HG22 THR 96 HG22 THR 96 100.525 6.772 12.577 774 HG23 THR 96 HG23 THR 96 99.609 7.480 13.929 775 H ASP 97 H ASP 97 97.665 2.841 12.781 776 HA ASP 97 HA ASP 97 95.085 3.314 14.154 777 HB2 ASP 97 HB2 ASP 97 95.326 2.213 11.877 778 HB3 ASP 97 HB3 ASP 97 96.039 0.809 12.707 779 H ASN 98 H ASN 98 97.788 0.959 14.393 780 HA ASN 98 HA ASN 98 96.858 0.444 17.221 781 HB2 ASN 98 HB2 ASN 98 96.330 -1.402 15.419 782 HB3 ASN 98 HB3 ASN 98 98.069 -1.758 15.540 783 HD21 ASN 98 HD21 ASN 98 98.861 -1.917 17.980 784 HD22 ASN 98 HD22 ASN 98 97.791 -2.799 19.048 785 H GLY 99 H GLY 99 99.219 1.810 15.472 786 HA2 GLY 99 HA2 GLY 99 101.578 2.006 15.739 787 HA3 GLY 99 HA3 GLY 99 101.169 1.947 17.470 788 H ASN 100 H ASN 100 100.812 -0.633 15.009 789 HA ASN 100 HA ASN 100 102.119 -2.536 16.844 790 HB2 ASN 100 HB2 ASN 100 100.817 -2.652 14.143 791 HB3 ASN 100 HB3 ASN 100 101.959 -3.950 14.566 792 HD21 ASN 100 HD21 ASN 100 100.276 -2.392 17.226 793 HD22 ASN 100 HD22 ASN 100 99.147 -3.693 17.528 794 H GLU 101 H GLU 101 103.505 -0.131 15.435 795 HA GLU 101 HA GLU 101 105.651 0.306 14.564 796 HB2 GLU 101 HB2 GLU 101 105.906 -2.082 16.333 797 HB3 GLU 101 HB3 GLU 101 107.271 -1.781 15.231 798 HG2 GLU 101 HG2 GLU 101 107.628 0.416 16.115 799 HG3 GLU 101 HG3 GLU 101 106.063 0.409 16.963 800 H LEU 102 H LEU 102 107.049 -0.140 12.808 801 HA LEU 102 HA LEU 102 106.711 -2.694 11.314 802 HB2 LEU 102 HB2 LEU 102 104.929 -1.675 10.198 803 HB3 LEU 102 HB3 LEU 102 105.590 -0.039 10.415 804 HG LEU 102 HG LEU 102 107.333 -0.496 8.733 805 HD11 LEU 102 HD11 LEU 102 106.197 -2.980 7.681 806 HD12 LEU 102 HD12 LEU 102 106.788 -3.190 9.347 807 HD13 LEU 102 HD13 LEU 102 107.888 -2.592 8.081 808 HD21 LEU 102 HD21 LEU 102 105.130 0.366 7.975 809 HD22 LEU 102 HD22 LEU 102 104.544 -1.304 7.784 810 HD23 LEU 102 HD23 LEU 102 105.858 -0.698 6.748 811 H ASN 103 H ASN 103 108.705 -3.213 10.501 812 HA ASN 103 HA ASN 103 110.674 -0.927 10.227 813 HB2 ASN 103 HB2 ASN 103 110.824 -3.448 11.664 814 HB3 ASN 103 HB3 ASN 103 112.071 -3.405 10.395 815 HD21 ASN 103 HD21 ASN 103 110.677 -1.266 12.985 816 HD22 ASN 103 HD22 ASN 103 112.211 -0.528 13.390 817 H THR 104 H THR 104 111.153 -0.519 8.127 818 HA THR 104 HA THR 104 111.147 -2.896 6.258 819 HB THR 104 HB THR 104 109.140 -1.675 5.754 820 HG1 THR 104 HG1 THR 104 109.852 -1.924 3.769 821 HG21 THR 104 HG21 THR 104 109.538 0.880 5.142 822 HG22 THR 104 HG22 THR 104 109.299 0.388 6.836 823 HG23 THR 104 HG23 THR 104 110.941 0.700 6.223 824 H VAL 105 H VAL 105 112.229 -2.166 4.089 825 HA VAL 105 HA VAL 105 114.487 -0.256 4.565 826 HB VAL 105 HB VAL 105 114.901 -3.141 3.660 827 HG11 VAL 105 HG11 VAL 105 117.359 -2.265 4.231 828 HG12 VAL 105 HG12 VAL 105 116.630 -0.684 3.862 829 HG13 VAL 105 HG13 VAL 105 116.630 -1.972 2.634 830 HG21 VAL 105 HG21 VAL 105 116.082 -3.403 5.824 831 HG22 VAL 105 HG22 VAL 105 114.375 -2.971 6.079 832 HG23 VAL 105 HG23 VAL 105 115.644 -1.736 6.267 833 H ARG 106 H ARG 106 115.610 0.258 2.485 834 HA ARG 106 HA ARG 106 113.935 -0.468 0.078 835 HB2 ARG 106 HB2 ARG 106 113.187 1.745 0.856 836 HB3 ARG 106 HB3 ARG 106 114.867 2.329 0.867 837 HG2 ARG 106 HG2 ARG 106 114.537 1.276 -1.713 838 HG3 ARG 106 HG3 ARG 106 112.987 2.084 -1.379 839 HD2 ARG 106 HD2 ARG 106 114.447 4.067 -0.524 840 HD3 ARG 106 HD3 ARG 106 115.781 3.269 -1.392 841 HE ARG 106 HE ARG 106 114.778 3.913 -3.456 842 HH11 ARG 106 HH11 ARG 106 113.174 4.989 -4.631 843 HH12 ARG 106 HH12 ARG 106 111.695 5.486 -3.840 844 HH21 ARG 106 HH21 ARG 106 112.628 4.221 -0.735 845 HH22 ARG 106 HH22 ARG 106 111.387 5.053 -1.645 846 H GLU 107 H GLU 107 115.146 -0.933 -1.715 847 HA GLU 107 HA GLU 107 118.019 -0.033 -1.749 848 HB2 GLU 107 HB2 GLU 107 117.050 -2.905 -2.099 849 HB3 GLU 107 HB3 GLU 107 118.701 -2.344 -2.460 850 HG2 GLU 107 HG3 GLU 107 118.966 -1.602 -0.111 851 HG3 GLU 107 HG2 GLU 107 117.313 -2.154 0.252 852 H ILE 108 H ILE 108 118.958 -0.169 -3.944 853 HA ILE 108 HA ILE 108 116.802 -0.232 -6.063 854 HB ILE 108 HB ILE 108 119.334 1.457 -6.080 855 HG12 ILE 108 HG12 ILE 108 117.298 1.840 -4.282 856 HG13 ILE 108 HG13 ILE 108 118.283 3.157 -4.959 857 HG21 ILE 108 HG21 ILE 108 118.461 1.079 -8.279 858 HG22 ILE 108 HG22 ILE 108 117.918 2.705 -7.802 859 HG23 ILE 108 HG23 ILE 108 116.787 1.333 -7.731 860 HD11 ILE 108 HD11 ILE 108 115.750 3.490 -5.091 861 HD12 ILE 108 HD12 ILE 108 116.627 3.654 -6.631 862 HD13 ILE 108 HD13 ILE 108 115.725 2.161 -6.275 863 H ILE 109 H ILE 109 117.385 -2.501 -6.322 864 HA ILE 109 HA ILE 109 120.099 -3.324 -6.894 865 HB ILE 109 HB ILE 109 117.369 -4.492 -7.516 866 HG12 ILE 109 HG12 ILE 109 119.701 -5.509 -5.835 867 HG13 ILE 109 HG13 ILE 109 118.366 -4.529 -5.184 868 HG21 ILE 109 HG21 ILE 109 118.855 -6.577 -8.134 869 HG22 ILE 109 HG22 ILE 109 118.556 -5.329 -9.367 870 HG23 ILE 109 HG23 ILE 109 120.102 -5.358 -8.486 871 HD11 ILE 109 HD11 ILE 109 118.373 -7.375 -6.126 872 HD12 ILE 109 HD12 ILE 109 116.913 -6.413 -6.463 873 HD13 ILE 109 HD13 ILE 109 117.475 -6.621 -4.786 874 H GLY 110 H GLY 110 121.013 -1.855 -8.351 875 HA2 GLY 110 HA2 GLY 110 121.515 -0.989 -10.489 876 HA3 GLY 110 HA3 GLY 110 120.838 -2.508 -11.121 877 H ASP 111 H ASP 111 118.457 -2.583 -11.462 878 HA ASP 111 HA ASP 111 117.289 0.182 -11.812 879 HB2 ASP 111 HB2 ASP 111 116.872 -2.080 -13.798 880 HB3 ASP 111 HB3 ASP 111 116.487 -0.353 -13.996 881 H GLU 112 H GLU 112 116.908 -1.921 -9.727 882 HA GLU 112 HA GLU 112 113.929 -2.228 -10.130 883 HB2 GLU 112 HB2 GLU 112 115.449 -4.320 -8.588 884 HB3 GLU 112 HB3 GLU 112 113.939 -4.472 -9.518 885 HG2 GLU 112 HG2 GLU 112 115.242 -4.197 -11.631 886 HG3 GLU 112 HG3 GLU 112 116.742 -4.124 -10.675 887 H LEU 113 H LEU 113 112.704 -1.769 -8.258 888 HA LEU 113 HA LEU 113 114.370 -0.719 -5.967 889 HB2 LEU 113 HB2 LEU 113 112.699 0.832 -6.965 890 HB3 LEU 113 HB3 LEU 113 111.406 -0.326 -6.574 891 HG LEU 113 HG LEU 113 112.380 -0.165 -4.127 892 HD11 LEU 113 HD11 LEU 113 114.375 1.160 -4.770 893 HD12 LEU 113 HD12 LEU 113 113.318 2.452 -5.388 894 HD13 LEU 113 HD13 LEU 113 113.337 2.073 -3.649 895 HD21 LEU 113 HD21 LEU 113 111.047 2.190 -4.031 896 HD22 LEU 113 HD22 LEU 113 110.577 1.669 -5.667 897 HD23 LEU 113 HD23 LEU 113 110.217 0.633 -4.265 898 H VAL 114 H VAL 114 114.680 -2.156 -4.353 899 HA VAL 114 HA VAL 114 112.514 -4.208 -3.906 900 HB VAL 114 HB VAL 114 115.338 -4.202 -2.769 901 HG11 VAL 114 HG11 VAL 114 114.883 -6.627 -2.518 902 HG12 VAL 114 HG12 VAL 114 113.260 -6.392 -3.209 903 HG13 VAL 114 HG13 VAL 114 113.676 -5.654 -1.644 904 HG21 VAL 114 HG21 VAL 114 114.377 -4.746 -5.504 905 HG22 VAL 114 HG22 VAL 114 115.236 -6.129 -4.785 906 HG23 VAL 114 HG23 VAL 114 116.041 -4.546 -4.905 907 H GLN 115 H GLN 115 111.077 -3.400 -2.446 908 HA GLN 115 HA GLN 115 112.215 -1.940 -0.061 909 HB2 GLN 115 HB2 GLN 115 110.439 -0.781 -1.418 910 HB3 GLN 115 HB3 GLN 115 109.325 -2.113 -1.027 911 HG2 GLN 115 HG2 GLN 115 109.356 -1.591 1.305 912 HG3 GLN 115 HG3 GLN 115 110.775 -0.531 1.127 913 HE21 GLN 115 HE21 GLN 115 110.407 1.471 -0.327 914 HE22 GLN 115 HE22 GLN 115 108.823 2.212 -0.266 915 H THR 116 H THR 116 112.643 -3.413 1.534 916 HA THR 116 HA THR 116 110.773 -5.749 1.797 917 HB THR 116 HB THR 116 113.163 -5.358 3.581 918 HG1 THR 116 HG1 THR 116 114.081 -4.894 1.616 919 HG21 THR 116 HG21 THR 116 113.290 -7.808 3.303 920 HG22 THR 116 HG22 THR 116 111.652 -7.321 3.801 921 HG23 THR 116 HG23 THR 116 111.976 -7.749 2.104 922 H TYR 117 H TYR 117 109.650 -6.179 3.711 923 HA TYR 117 HA TYR 117 109.616 -3.873 5.674 924 HB2 TYR 117 HB2 TYR 117 107.274 -5.718 5.063 925 HB3 TYR 117 HB3 TYR 117 107.261 -4.233 6.042 926 HD1 TYR 117 HD1 TYR 117 108.238 -5.402 2.651 927 HD2 TYR 117 HD2 TYR 117 106.522 -2.270 5.014 928 HE1 TYR 117 HE1 TYR 117 107.761 -4.115 0.585 929 HE2 TYR 117 HE2 TYR 117 106.044 -0.967 2.957 930 HH TYR 117 HH TYR 117 106.023 -2.245 -0.082 931 H VAL 118 H VAL 118 109.097 -4.463 7.837 932 HA VAL 118 HA VAL 118 109.530 -7.387 8.461 933 HB VAL 118 HB VAL 118 110.628 -5.127 10.165 934 HG11 VAL 118 HG11 VAL 118 111.599 -6.809 11.436 935 HG12 VAL 118 HG12 VAL 118 110.126 -7.646 10.891 936 HG13 VAL 118 HG13 VAL 118 111.676 -7.945 10.068 937 HG21 VAL 118 HG21 VAL 118 112.595 -6.746 8.695 938 HG22 VAL 118 HG22 VAL 118 112.513 -4.982 8.919 939 HG23 VAL 118 HG23 VAL 118 111.573 -5.759 7.622 940 H TYR 119 H TYR 119 108.388 -8.115 10.264 941 HA TYR 119 HA TYR 119 106.724 -6.090 11.699 942 HB2 TYR 119 HB2 TYR 119 105.634 -7.279 9.500 943 HB3 TYR 119 HB3 TYR 119 105.189 -8.458 10.757 944 HD1 TYR 119 HD1 TYR 119 104.019 -7.629 12.838 945 HD2 TYR 119 HD2 TYR 119 104.516 -5.184 9.348 946 HE1 TYR 119 HE1 TYR 119 102.203 -6.135 13.629 947 HE2 TYR 119 HE2 TYR 119 102.711 -3.681 10.141 948 HH TYR 119 HH TYR 119 100.736 -3.784 11.644 949 H GLU 120 H GLU 120 107.258 -6.518 13.721 950 HA GLU 120 HA GLU 120 107.746 -7.731 15.681 951 HB2 GLU 120 HB3 GLU 120 105.407 -9.281 14.510 952 HB3 GLU 120 HB2 GLU 120 106.046 -9.561 16.148 953 HG2 GLU 120 HG2 GLU 120 105.692 -7.118 16.642 954 HG3 GLU 120 HG3 GLU 120 104.917 -6.949 15.048 955 H GLY 121 H GLY 121 109.037 -8.689 13.046 956 HA2 GLY 121 HA3 GLY 121 110.960 -10.284 13.293 957 HA3 GLY 121 HA2 GLY 121 109.868 -11.367 14.191 958 H VAL 122 H VAL 122 108.771 -9.594 11.380 959 HA VAL 122 HA VAL 122 108.893 -12.169 9.810 960 HB VAL 122 HB VAL 122 106.560 -11.091 10.681 961 HG11 VAL 122 HG11 VAL 122 106.830 -9.931 7.892 962 HG12 VAL 122 HG12 VAL 122 105.574 -9.614 9.113 963 HG13 VAL 122 HG13 VAL 122 107.217 -8.967 9.337 964 HG21 VAL 122 HG21 VAL 122 105.496 -12.267 8.778 965 HG22 VAL 122 HG22 VAL 122 107.061 -12.304 7.931 966 HG23 VAL 122 HG23 VAL 122 106.849 -13.210 9.448 967 H GLU 123 H GLU 123 108.513 -11.484 7.358 968 HA GLU 123 HA GLU 123 109.683 -8.811 6.829 969 HB2 GLU 123 HB2 GLU 123 111.311 -11.275 6.855 970 HB3 GLU 123 HB3 GLU 123 111.441 -10.348 5.341 971 HG2 GLU 123 HG3 GLU 123 111.862 -8.278 6.739 972 HG3 GLU 123 HG2 GLU 123 111.927 -9.329 8.174 973 H ALA 124 H ALA 124 108.780 -8.034 5.017 974 HA ALA 124 HA ALA 124 107.782 -10.045 2.982 975 HB1 ALA 124 HB1 ALA 124 106.589 -7.514 2.498 976 HB2 ALA 124 HB2 ALA 124 106.513 -7.757 4.259 977 HB3 ALA 124 HB3 ALA 124 105.801 -8.965 3.163 978 H LYS 125 H LYS 125 107.987 -9.297 0.672 979 HA LYS 125 HA LYS 125 110.132 -7.191 0.399 980 HB2 LYS 125 HB2 LYS 125 110.958 -9.665 0.287 981 HB3 LYS 125 HB3 LYS 125 110.169 -9.687 -1.309 982 HG2 LYS 125 HG3 LYS 125 111.475 -7.558 -1.852 983 HG3 LYS 125 HG2 LYS 125 112.399 -7.843 -0.358 984 HD2 LYS 125 HD2 LYS 125 112.099 -10.067 -2.386 985 HD3 LYS 125 HD3 LYS 125 113.309 -8.788 -2.649 986 HE2 LYS 125 HE3 LYS 125 113.081 -10.394 -0.069 987 HE3 LYS 125 HE2 LYS 125 114.182 -10.817 -1.401 988 HZ1 LYS 125 HZ1 LYS 125 115.275 -9.461 0.260 989 HZ2 LYS 125 HZ2 LYS 125 115.191 -8.646 -1.171 990 HZ3 LYS 125 HZ3 LYS 125 114.170 -8.252 0.063 991 H ARG 126 H ARG 126 109.881 -5.825 -1.279 992 HA ARG 126 HA ARG 126 107.785 -6.510 -3.352 993 HB2 ARG 126 HB3 ARG 126 108.106 -4.038 -1.641 994 HB3 ARG 126 HB2 ARG 126 107.462 -3.876 -3.292 995 HG2 ARG 126 HG3 ARG 126 106.336 -5.995 -1.456 996 HG3 ARG 126 HG2 ARG 126 105.809 -4.305 -1.272 997 HD2 ARG 126 HD2 ARG 126 104.784 -4.253 -3.359 998 HD3 ARG 126 HD3 ARG 126 105.858 -5.500 -4.036 999 HE ARG 126 HE ARG 126 104.406 -6.870 -2.070 1000 HH11 ARG 126 HH11 ARG 126 102.450 -7.897 -2.542 1001 HH12 ARG 126 HH12 ARG 126 101.477 -7.350 -3.889 1002 HH21 ARG 126 HH21 ARG 126 103.695 -4.825 -4.799 1003 HH22 ARG 126 HH22 ARG 126 102.179 -5.618 -5.160 1004 H ILE 127 H ILE 127 108.897 -6.659 -5.269 1005 HA ILE 127 HA ILE 127 111.283 -4.819 -5.574 1006 HB ILE 127 HB ILE 127 110.692 -7.454 -6.987 1007 HG12 ILE 127 HG12 ILE 127 112.974 -7.151 -5.079 1008 HG13 ILE 127 HG13 ILE 127 111.348 -7.215 -4.357 1009 HG21 ILE 127 HG21 ILE 127 113.055 -7.262 -7.715 1010 HG22 ILE 127 HG22 ILE 127 112.092 -5.880 -8.290 1011 HG23 ILE 127 HG23 ILE 127 113.179 -5.688 -6.893 1012 HD11 ILE 127 HD11 ILE 127 112.322 -9.487 -4.562 1013 HD12 ILE 127 HD12 ILE 127 110.882 -9.314 -5.594 1014 HD13 ILE 127 HD13 ILE 127 112.508 -9.249 -6.316 1015 H PHE 128 H PHE 128 111.044 -3.208 -6.995 1016 HA PHE 128 HA PHE 128 108.940 -3.510 -9.142 1017 HB2 PHE 128 HB2 PHE 128 110.398 -0.959 -8.326 1018 HB3 PHE 128 HB3 PHE 128 108.910 -1.100 -9.288 1019 HD1 PHE 128 HD1 PHE 128 107.975 -3.465 -7.347 1020 HD2 PHE 128 HD2 PHE 128 109.165 0.610 -6.792 1021 HE1 PHE 128 HE1 PHE 128 106.598 -3.352 -5.291 1022 HE2 PHE 128 HE2 PHE 128 107.796 0.733 -4.726 1023 HZ PHE 128 HZ PHE 128 106.505 -1.249 -3.978 1024 H LYS 129 H LYS 129 109.611 -2.199 -11.209 1025 HA LYS 129 HA LYS 129 112.503 -2.177 -11.806 1026 HB2 LYS 129 HB2 LYS 129 111.851 -4.629 -11.973 1027 HB3 LYS 129 HB3 LYS 129 110.749 -4.176 -13.295 1028 HG2 LYS 129 HG2 LYS 129 112.610 -3.306 -14.614 1029 HG3 LYS 129 HG3 LYS 129 113.739 -3.577 -13.265 1030 HD2 LYS 129 HD3 LYS 129 113.062 -6.051 -13.381 1031 HD3 LYS 129 HD2 LYS 129 112.270 -5.660 -14.926 1032 HE2 LYS 129 HE3 LYS 129 114.385 -6.282 -15.681 1033 HE3 LYS 129 HE2 LYS 129 114.621 -4.531 -15.466 1034 HZ1 LYS 129 HZ1 LYS 129 116.377 -5.428 -14.325 1035 HZ2 LYS 129 HZ2 LYS 129 115.287 -5.238 -13.102 1036 HZ3 LYS 129 HZ3 LYS 129 115.531 -6.729 -13.764 1037 H LYS 130 H LYS 130 112.892 -1.367 -14.032 1038 HA LYS 130 HA LYS 130 111.295 0.845 -14.727 1039 HB2 LYS 130 HB3 LYS 130 112.229 0.356 -17.144 1040 HB3 LYS 130 HB2 LYS 130 113.363 0.753 -15.831 1041 HG2 LYS 130 HG2 LYS 130 113.883 -1.587 -15.476 1042 HG3 LYS 130 HG3 LYS 130 112.589 -2.096 -16.587 1043 HD2 LYS 130 HD2 LYS 130 113.830 -0.733 -18.394 1044 HD3 LYS 130 HD3 LYS 130 115.197 -0.682 -17.256 1045 HE2 LYS 130 HE2 LYS 130 115.217 -3.154 -17.158 1046 HE3 LYS 130 HE3 LYS 130 113.834 -3.216 -18.276 1047 HZ1 LYS 130 HZ1 LYS 130 115.924 -3.499 -19.430 1048 HZ2 LYS 130 HZ2 LYS 130 115.194 -2.102 -19.916 1049 HZ3 LYS 130 HZ3 LYS 130 116.476 -2.045 -18.880 1050 H ASP 131 H ASP 131 109.342 1.127 -15.707 1051 HA ASP 131 HA ASP 131 107.694 -1.229 -16.274 1052 HB2 ASP 131 HB3 ASP 131 106.712 0.885 -15.456 1053 HB3 ASP 131 HB2 ASP 131 107.254 1.719 -16.932 Start of MODEL 3 1 H1 ALA 1 H1 ALA 1 116.183 6.366 -7.590 2 H2 ALA 1 H2 ALA 1 117.190 5.077 -7.379 3 H3 ALA 1 H3 ALA 1 115.821 5.212 -6.469 4 HA ALA 1 HA ALA 1 115.905 3.625 -8.525 5 HB1 ALA 1 HB1 ALA 1 113.457 5.375 -8.268 6 HB2 ALA 1 HB2 ALA 1 113.566 3.607 -8.447 7 HB3 ALA 1 HB3 ALA 1 113.963 4.371 -6.889 8 H PHE 2 H PHE 2 114.095 4.193 -10.531 9 HA PHE 2 HA PHE 2 115.765 5.769 -12.354 10 HB2 PHE 2 HB2 PHE 2 112.891 4.794 -12.691 11 HB3 PHE 2 HB3 PHE 2 113.950 5.384 -13.991 12 HD1 PHE 2 HD1 PHE 2 112.549 2.536 -13.187 13 HD2 PHE 2 HD2 PHE 2 116.546 4.109 -13.264 14 HE1 PHE 2 HE1 PHE 2 113.446 0.243 -13.466 15 HE2 PHE 2 HE2 PHE 2 117.441 1.813 -13.545 16 HZ PHE 2 HZ PHE 2 115.891 -0.119 -13.645 17 H ASP 3 H ASP 3 114.501 7.046 -9.874 18 HA ASP 3 HA ASP 3 113.094 8.955 -9.406 19 HB2 ASP 3 HB3 ASP 3 115.377 9.805 -10.108 20 HB3 ASP 3 HB2 ASP 3 114.741 9.988 -11.760 21 H SER 4 H SER 4 111.426 7.359 -10.645 22 HA SER 4 HA SER 4 109.691 9.069 -12.198 23 HB2 SER 4 HB3 SER 4 111.715 8.387 -13.802 24 HB3 SER 4 HB2 SER 4 110.780 6.879 -13.956 25 HG SER 4 HG SER 4 110.152 8.479 -15.513 26 H THR 5 H THR 5 109.007 6.578 -13.909 27 HA THR 5 HA THR 5 107.182 5.432 -11.846 28 HB THR 5 HB THR 5 107.353 4.833 -14.827 29 HG1 THR 5 HG1 THR 5 105.644 6.396 -14.922 30 HG21 THR 5 HG21 THR 5 104.802 4.411 -14.234 31 HG22 THR 5 HG22 THR 5 106.016 3.149 -13.916 32 HG23 THR 5 HG23 THR 5 105.438 4.183 -12.587 33 H TRP 6 H TRP 6 107.018 3.261 -11.340 34 HA TRP 6 HA TRP 6 109.080 1.350 -12.405 35 HB2 TRP 6 HB3 TRP 6 108.757 2.248 -9.525 36 HB3 TRP 6 HB2 TRP 6 109.344 0.614 -9.905 37 HD1 TRP 6 HD1 TRP 6 110.217 4.255 -10.975 38 HE1 TRP 6 HE1 TRP 6 112.782 4.471 -11.108 39 HE3 TRP 6 HE3 TRP 6 111.497 -0.575 -9.954 40 HZ2 TRP 6 HZ2 TRP 6 115.077 2.744 -10.858 41 HZ3 TRP 6 HZ3 TRP 6 113.874 -1.268 -9.933 42 HH2 TRP 6 HH2 TRP 6 115.666 0.384 -10.373 43 H LYS 7 H LYS 7 108.454 -0.968 -11.525 44 HA LYS 7 HA LYS 7 105.598 -1.116 -10.665 45 HB2 LYS 7 HB2 LYS 7 104.764 -2.236 -12.573 46 HB3 LYS 7 HB3 LYS 7 105.748 -0.920 -13.255 47 HG2 LYS 7 HG3 LYS 7 107.694 -2.623 -13.281 48 HG3 LYS 7 HG2 LYS 7 106.450 -3.866 -13.006 49 HD2 LYS 7 HD2 LYS 7 105.290 -3.247 -15.050 50 HD3 LYS 7 HD3 LYS 7 106.353 -1.838 -15.282 51 HE2 LYS 7 HE3 LYS 7 106.785 -4.230 -16.495 52 HE3 LYS 7 HE2 LYS 7 108.102 -3.116 -16.055 53 HZ1 LYS 7 HZ1 LYS 7 108.320 -5.483 -15.285 54 HZ2 LYS 7 HZ2 LYS 7 107.110 -5.178 -14.207 55 HZ3 LYS 7 HZ3 LYS 7 108.522 -4.330 -14.122 56 H VAL 8 H VAL 8 105.426 -2.742 -9.216 57 HA VAL 8 HA VAL 8 107.495 -4.425 -8.390 58 HB VAL 8 HB VAL 8 105.663 -4.577 -6.988 59 HG11 VAL 8 HG11 VAL 8 103.317 -5.069 -7.969 60 HG12 VAL 8 HG12 VAL 8 104.010 -3.456 -8.265 61 HG13 VAL 8 HG13 VAL 8 104.044 -4.688 -9.549 62 HG21 VAL 8 HG21 VAL 8 106.440 -6.895 -7.583 63 HG22 VAL 8 HG22 VAL 8 105.152 -6.970 -8.809 64 HG23 VAL 8 HG23 VAL 8 104.733 -6.833 -7.085 65 H ASP 9 H ASP 9 108.774 -5.559 -9.741 66 HA ASP 9 HA ASP 9 107.524 -7.077 -11.996 67 HB2 ASP 9 HB2 ASP 9 109.599 -5.894 -12.503 68 HB3 ASP 9 HB3 ASP 9 110.420 -6.663 -11.123 69 H ARG 10 H ARG 10 109.015 -7.507 -8.830 70 HA ARG 10 HA ARG 10 107.993 -10.310 -8.821 71 HB2 ARG 10 HB3 ARG 10 110.916 -9.761 -8.161 72 HB3 ARG 10 HB2 ARG 10 110.098 -11.340 -8.236 73 HG2 ARG 10 HG2 ARG 10 109.661 -10.959 -10.671 74 HG3 ARG 10 HG3 ARG 10 110.575 -9.436 -10.572 75 HD2 ARG 10 HD2 ARG 10 111.694 -11.849 -11.230 76 HD3 ARG 10 HD3 ARG 10 112.597 -10.506 -10.488 77 HE ARG 10 HE ARG 10 112.621 -11.698 -8.401 78 HH11 ARG 10 HH11 ARG 10 112.354 -13.635 -7.270 79 HH12 ARG 10 HH12 ARG 10 111.379 -14.918 -7.950 80 HH21 ARG 10 HH21 ARG 10 110.599 -13.141 -10.843 81 HH22 ARG 10 HH22 ARG 10 110.389 -14.640 -9.965 82 H SER 11 H SER 11 108.568 -11.296 -6.525 83 HA SER 11 HA SER 11 109.011 -9.415 -4.338 84 HB2 SER 11 HB2 SER 11 106.826 -8.538 -4.790 85 HB3 SER 11 HB3 SER 11 106.149 -10.164 -5.052 86 HG SER 11 HG SER 11 105.700 -10.104 -2.987 87 H GLU 12 H GLU 12 108.131 -10.589 -2.171 88 HA GLU 12 HA GLU 12 108.087 -13.548 -2.509 89 HB2 GLU 12 HB3 GLU 12 110.279 -13.887 -2.098 90 HB3 GLU 12 HB2 GLU 12 110.542 -12.132 -1.997 91 HG2 GLU 12 HG2 GLU 12 109.909 -12.160 0.391 92 HG3 GLU 12 HG3 GLU 12 109.607 -13.912 0.299 93 H ASN 13 H ASN 13 107.493 -14.650 -0.540 94 HA ASN 13 HA ASN 13 106.214 -14.821 1.435 95 HB2 ASN 13 HB2 ASN 13 107.949 -12.399 1.941 96 HB3 ASN 13 HB3 ASN 13 106.687 -12.842 3.115 97 HD21 ASN 13 HD21 ASN 13 108.818 -13.200 4.465 98 HD22 ASN 13 HD22 ASN 13 109.511 -14.803 4.373 99 H TYR 14 H TYR 14 105.932 -11.529 2.245 100 HA TYR 14 HA TYR 14 104.172 -9.973 1.953 101 HB2 TYR 14 HB3 TYR 14 104.390 -11.098 -0.549 102 HB3 TYR 14 HB2 TYR 14 102.713 -11.512 -0.124 103 HD1 TYR 14 HD1 TYR 14 104.778 -8.518 0.818 104 HD2 TYR 14 HD2 TYR 14 101.361 -10.009 -1.315 105 HE1 TYR 14 HE1 TYR 14 104.075 -6.193 0.320 106 HE2 TYR 14 HE2 TYR 14 100.656 -7.684 -1.811 107 HH TYR 14 HH TYR 14 101.800 -5.016 -0.231 108 H ASP 15 H ASP 15 102.996 -13.352 1.440 109 HA ASP 15 HA ASP 15 100.463 -12.891 2.726 110 HB2 ASP 15 HB2 ASP 15 100.484 -15.385 3.128 111 HB3 ASP 15 HB3 ASP 15 100.835 -14.927 1.444 112 H LYS 16 H LYS 16 103.598 -14.042 4.036 113 HA LYS 16 HA LYS 16 102.664 -14.280 6.761 114 HB2 LYS 16 HB2 LYS 16 105.460 -13.463 5.854 115 HB3 LYS 16 HB3 LYS 16 105.012 -14.251 7.386 116 HG2 LYS 16 HG2 LYS 16 104.019 -16.129 5.854 117 HG3 LYS 16 HG3 LYS 16 105.040 -15.410 4.586 118 HD2 LYS 16 HD3 LYS 16 107.030 -15.668 6.050 119 HD3 LYS 16 HD2 LYS 16 106.005 -16.400 7.307 120 HE2 LYS 16 HE3 LYS 16 106.310 -17.498 4.477 121 HE3 LYS 16 HE2 LYS 16 107.207 -18.099 5.892 122 HZ1 LYS 16 HZ1 LYS 16 105.222 -19.392 5.482 123 HZ2 LYS 16 HZ2 LYS 16 105.100 -18.611 6.929 124 HZ3 LYS 16 HZ3 LYS 16 104.268 -18.054 5.619 125 H PHE 17 H PHE 17 103.840 -11.573 4.807 126 HA PHE 17 HA PHE 17 103.999 -9.667 7.013 127 HB2 PHE 17 HB2 PHE 17 105.064 -9.431 4.730 128 HB3 PHE 17 HB3 PHE 17 103.440 -9.155 4.060 129 HD1 PHE 17 HD1 PHE 17 105.841 -7.909 6.623 130 HD2 PHE 17 HD2 PHE 17 102.485 -6.994 4.113 131 HE1 PHE 17 HE1 PHE 17 106.023 -5.521 7.260 132 HE2 PHE 17 HE2 PHE 17 102.656 -4.603 4.753 133 HZ PHE 17 HZ PHE 17 104.429 -3.864 6.324 134 H MET 18 H MET 18 101.669 -9.886 4.310 135 HA MET 18 HA MET 18 99.692 -8.187 5.478 136 HB2 MET 18 HB2 MET 18 99.212 -10.608 3.683 137 HB3 MET 18 HB3 MET 18 98.115 -9.226 3.910 138 HG2 MET 18 HG3 MET 18 100.819 -8.357 3.180 139 HG3 MET 18 HG2 MET 18 100.126 -9.453 1.961 140 HE1 MET 18 HE1 MET 18 99.209 -5.130 2.767 141 HE2 MET 18 HE2 MET 18 99.669 -6.234 4.086 142 HE3 MET 18 HE3 MET 18 100.737 -6.038 2.675 143 H GLU 19 H GLU 19 100.547 -11.517 6.180 144 HA GLU 19 HA GLU 19 98.003 -12.030 7.619 145 HB2 GLU 19 HB3 GLU 19 99.167 -13.908 6.557 146 HB3 GLU 19 HB2 GLU 19 100.636 -13.568 7.504 147 HG2 GLU 19 HG2 GLU 19 99.567 -14.173 9.561 148 HG3 GLU 19 HG3 GLU 19 97.953 -14.163 8.810 149 H LYS 20 H LYS 20 101.160 -10.698 8.306 150 HA LYS 20 HA LYS 20 100.965 -11.152 11.213 151 HB2 LYS 20 HB3 LYS 20 102.995 -10.388 9.436 152 HB3 LYS 20 HB2 LYS 20 102.684 -8.919 10.391 153 HG2 LYS 20 HG3 LYS 20 104.303 -10.119 11.660 154 HG3 LYS 20 HG2 LYS 20 102.755 -10.476 12.464 155 HD2 LYS 20 HD2 LYS 20 102.691 -12.519 10.783 156 HD3 LYS 20 HD3 LYS 20 104.449 -12.250 10.699 157 HE2 LYS 20 HE3 LYS 20 104.233 -13.779 12.484 158 HE3 LYS 20 HE2 LYS 20 104.325 -12.208 13.315 159 HZ1 LYS 20 HZ1 LYS 20 102.503 -13.545 14.139 160 HZ2 LYS 20 HZ2 LYS 20 101.922 -12.188 13.404 161 HZ3 LYS 20 HZ3 LYS 20 101.836 -13.644 12.634 162 H MET 21 H MET 21 100.200 -8.508 8.942 163 HA MET 21 HA MET 21 99.580 -6.580 11.037 164 HB2 MET 21 HB3 MET 21 97.974 -6.317 8.577 165 HB3 MET 21 HB2 MET 21 99.143 -5.185 9.296 166 HG2 MET 21 HG2 MET 21 101.011 -6.530 8.365 167 HG3 MET 21 HG3 MET 21 99.835 -7.646 7.630 168 HE1 MET 21 HE1 MET 21 100.843 -3.327 6.633 169 HE2 MET 21 HE2 MET 21 101.081 -4.241 8.142 170 HE3 MET 21 HE3 MET 21 99.498 -3.512 7.783 171 H GLY 22 H GLY 22 98.081 -9.469 10.042 172 HA2 GLY 22 HA3 GLY 22 96.123 -10.450 10.994 173 HA3 GLY 22 HA2 GLY 22 95.792 -8.920 11.841 174 H VAL 23 H VAL 23 96.401 -9.105 8.359 175 HA VAL 23 HA VAL 23 93.803 -7.789 7.861 176 HB VAL 23 HB VAL 23 95.688 -8.962 5.782 177 HG11 VAL 23 HG11 VAL 23 93.482 -8.135 5.010 178 HG12 VAL 23 HG12 VAL 23 93.793 -6.571 5.801 179 HG13 VAL 23 HG13 VAL 23 94.798 -7.088 4.426 180 HG21 VAL 23 HG21 VAL 23 96.554 -6.463 5.851 181 HG22 VAL 23 HG22 VAL 23 95.947 -6.506 7.523 182 HG23 VAL 23 HG23 VAL 23 97.203 -7.654 7.003 183 H ASN 24 H ASN 24 91.939 -8.739 7.090 184 HA ASN 24 HA ASN 24 91.309 -11.421 7.527 185 HB2 ASN 24 HB3 ASN 24 90.291 -9.331 5.643 186 HB3 ASN 24 HB2 ASN 24 89.813 -11.009 5.295 187 HD21 ASN 24 HD21 ASN 24 89.599 -8.377 7.703 188 HD22 ASN 24 HD22 ASN 24 88.321 -9.118 8.640 189 H ILE 25 H ILE 25 90.981 -13.234 5.919 190 HA ILE 25 HA ILE 25 93.506 -13.592 4.405 191 HB ILE 25 HB ILE 25 91.151 -15.307 5.163 192 HG12 ILE 25 HG13 ILE 25 93.155 -15.142 6.616 193 HG13 ILE 25 HG12 ILE 25 92.960 -16.785 5.963 194 HG21 ILE 25 HG21 ILE 25 92.143 -17.134 3.706 195 HG22 ILE 25 HG22 ILE 25 93.106 -15.873 2.899 196 HG23 ILE 25 HG23 ILE 25 91.329 -15.828 2.812 197 HD11 ILE 25 HD11 ILE 25 95.325 -15.521 5.888 198 HD12 ILE 25 HD12 ILE 25 94.635 -14.841 4.395 199 HD13 ILE 25 HD13 ILE 25 94.808 -16.603 4.573 200 H VAL 26 H VAL 26 90.678 -12.072 3.803 201 HA VAL 26 HA VAL 26 90.279 -12.969 1.008 202 HB VAL 26 HB VAL 26 89.178 -10.509 2.436 203 HG11 VAL 26 HG11 VAL 26 89.008 -10.465 -0.038 204 HG12 VAL 26 HG12 VAL 26 88.241 -12.071 -0.013 205 HG13 VAL 26 HG13 VAL 26 87.407 -10.675 0.710 206 HG21 VAL 26 HG21 VAL 26 88.628 -12.601 3.650 207 HG22 VAL 26 HG22 VAL 26 87.185 -11.920 2.862 208 HG23 VAL 26 HG23 VAL 26 88.018 -13.317 2.139 209 H LYS 27 H LYS 27 91.180 -9.819 2.502 210 HA LYS 27 HA LYS 27 92.158 -8.720 0.001 211 HB2 LYS 27 HB3 LYS 27 92.598 -8.036 2.926 212 HB3 LYS 27 HB2 LYS 27 93.450 -7.156 1.635 213 HG2 LYS 27 HG2 LYS 27 91.475 -6.248 0.766 214 HG3 LYS 27 HG3 LYS 27 90.461 -7.545 1.442 215 HD2 LYS 27 HD3 LYS 27 91.925 -5.468 3.128 216 HD3 LYS 27 HD2 LYS 27 90.221 -5.328 2.634 217 HE2 LYS 27 HE2 LYS 27 90.210 -7.855 3.658 218 HE3 LYS 27 HE3 LYS 27 91.481 -7.118 4.664 219 HZ1 LYS 27 HZ1 LYS 27 89.295 -6.804 5.618 220 HZ2 LYS 27 HZ2 LYS 27 89.942 -5.348 5.194 221 HZ3 LYS 27 HZ3 LYS 27 88.765 -6.030 4.261 222 H ARG 28 H ARG 28 93.562 -10.782 2.475 223 HA ARG 28 HA ARG 28 96.336 -10.389 1.629 224 HB2 ARG 28 HB2 ARG 28 96.541 -11.428 3.631 225 HB3 ARG 28 HB3 ARG 28 94.854 -11.988 3.584 226 HG2 ARG 28 HG2 ARG 28 96.412 -13.905 3.675 227 HG3 ARG 28 HG3 ARG 28 95.531 -13.887 2.129 228 HD2 ARG 28 HD2 ARG 28 97.851 -12.293 1.732 229 HD3 ARG 28 HD3 ARG 28 98.394 -13.748 2.603 230 HE ARG 28 HE ARG 28 97.441 -13.651 -0.170 231 HH11 ARG 28 HH11 ARG 28 97.297 -15.649 -1.215 232 HH12 ARG 28 HH12 ARG 28 97.312 -17.128 -0.281 233 HH21 ARG 28 HH21 ARG 28 97.588 -15.493 2.781 234 HH22 ARG 28 HH22 ARG 28 97.477 -17.040 1.972 235 H LYS 29 H LYS 29 93.779 -12.786 0.862 236 HA LYS 29 HA LYS 29 95.458 -14.427 -0.834 237 HB2 LYS 29 HB3 LYS 29 93.095 -14.938 0.081 238 HB3 LYS 29 HB2 LYS 29 92.487 -13.952 -1.272 239 HG2 LYS 29 HG2 LYS 29 93.664 -15.409 -2.881 240 HG3 LYS 29 HG3 LYS 29 94.317 -16.380 -1.540 241 HD2 LYS 29 HD2 LYS 29 91.338 -15.966 -1.706 242 HD3 LYS 29 HD3 LYS 29 92.100 -17.131 -2.814 243 HE2 LYS 29 HE2 LYS 29 92.920 -18.467 -1.027 244 HE3 LYS 29 HE3 LYS 29 92.677 -17.169 0.167 245 HZ1 LYS 29 HZ1 LYS 29 90.954 -18.841 0.307 246 HZ2 LYS 29 HZ2 LYS 29 90.306 -17.398 -0.163 247 HZ3 LYS 29 HZ3 LYS 29 90.531 -18.601 -1.269 248 H LEU 30 H LEU 30 93.570 -11.473 -1.417 249 HA LEU 30 HA LEU 30 94.195 -11.583 -4.325 250 HB2 LEU 30 HB2 LEU 30 92.854 -9.401 -2.671 251 HB3 LEU 30 HB3 LEU 30 92.935 -9.467 -4.448 252 HG LEU 30 HG LEU 30 91.660 -11.613 -2.694 253 HD11 LEU 30 HD11 LEU 30 90.401 -9.478 -2.602 254 HD12 LEU 30 HD12 LEU 30 90.389 -9.409 -4.380 255 HD13 LEU 30 HD13 LEU 30 89.511 -10.705 -3.534 256 HD21 LEU 30 HD21 LEU 30 90.758 -12.417 -4.860 257 HD22 LEU 30 HD22 LEU 30 91.635 -11.120 -5.707 258 HD23 LEU 30 HD23 LEU 30 92.538 -12.409 -4.874 259 H ALA 31 H ALA 31 95.635 -10.522 -1.481 260 HA ALA 31 HA ALA 31 97.037 -8.172 -2.488 261 HB1 ALA 31 HB1 ALA 31 98.688 -9.033 -0.534 262 HB2 ALA 31 HB2 ALA 31 97.250 -9.997 -0.118 263 HB3 ALA 31 HB3 ALA 31 97.144 -8.221 -0.181 264 H ALA 32 H ALA 32 97.889 -11.647 -2.251 265 HA ALA 32 HA ALA 32 100.569 -11.598 -3.051 266 HB1 ALA 32 HB1 ALA 32 100.157 -13.770 -4.173 267 HB2 ALA 32 HB2 ALA 32 99.299 -13.681 -2.616 268 HB3 ALA 32 HB3 ALA 32 98.406 -13.455 -4.139 269 H HIS 33 H HIS 33 97.862 -10.406 -4.828 270 HA HIS 33 HA HIS 33 98.996 -10.725 -7.506 271 HB2 HIS 33 HB3 HIS 33 96.541 -10.173 -6.780 272 HB3 HIS 33 HB2 HIS 33 97.113 -8.489 -6.708 273 HD2 HIS 33 HD2 HIS 33 96.696 -11.344 -9.438 274 HE1 HIS 33 HE1 HIS 33 97.218 -7.645 -11.408 275 HE2 HIS 33 HE2 HIS 33 96.706 -10.122 -11.762 276 H ASP 34 H ASP 34 101.010 -9.788 -5.736 277 HA ASP 34 HA ASP 34 101.429 -6.990 -5.636 278 HB2 ASP 34 HB2 ASP 34 103.736 -8.748 -6.441 279 HB3 ASP 34 HB3 ASP 34 103.655 -7.486 -5.188 280 H ASN 35 H ASN 35 100.533 -6.013 -7.531 281 HA ASN 35 HA ASN 35 102.450 -6.033 -9.832 282 HB2 ASN 35 HB2 ASN 35 100.635 -7.752 -10.298 283 HB3 ASN 35 HB3 ASN 35 99.454 -6.422 -10.245 284 HD21 ASN 35 HD21 ASN 35 102.347 -5.126 -11.402 285 HD22 ASN 35 HD22 ASN 35 102.034 -5.281 -13.116 286 H LEU 36 H LEU 36 102.038 -4.039 -7.854 287 HA LEU 36 HA LEU 36 100.231 -2.047 -9.185 288 HB2 LEU 36 HB3 LEU 36 100.288 -0.816 -7.167 289 HB3 LEU 36 HB2 LEU 36 100.289 -2.511 -6.632 290 HG LEU 36 HG LEU 36 103.007 -1.930 -6.983 291 HD11 LEU 36 HD11 LEU 36 102.370 0.495 -7.181 292 HD12 LEU 36 HD12 LEU 36 101.644 0.399 -5.559 293 HD13 LEU 36 HD13 LEU 36 103.395 0.157 -5.766 294 HD21 LEU 36 HD21 LEU 36 101.962 -3.255 -5.162 295 HD22 LEU 36 HD22 LEU 36 101.306 -1.760 -4.453 296 HD23 LEU 36 HD23 LEU 36 103.066 -2.022 -4.506 297 H LYS 37 H LYS 37 101.173 0.301 -9.049 298 HA LYS 37 HA LYS 37 104.040 0.240 -10.016 299 HB2 LYS 37 HB3 LYS 37 101.566 1.397 -11.300 300 HB3 LYS 37 HB2 LYS 37 103.123 2.227 -11.526 301 HG2 LYS 37 HG2 LYS 37 104.053 0.454 -12.713 302 HG3 LYS 37 HG3 LYS 37 103.014 -0.757 -11.925 303 HD2 LYS 37 HD2 LYS 37 101.147 -0.209 -13.276 304 HD3 LYS 37 HD3 LYS 37 101.840 1.360 -13.753 305 HE2 LYS 37 HE3 LYS 37 103.606 0.202 -15.037 306 HE3 LYS 37 HE2 LYS 37 102.945 -1.374 -14.540 307 HZ1 LYS 37 HZ1 LYS 37 102.151 -0.721 -16.715 308 HZ2 LYS 37 HZ2 LYS 37 100.893 -0.789 -15.650 309 HZ3 LYS 37 HZ3 LYS 37 101.506 0.672 -16.110 310 H LEU 38 H LEU 38 105.226 2.204 -9.604 311 HA LEU 38 HA LEU 38 103.797 4.241 -7.920 312 HB2 LEU 38 HB2 LEU 38 105.683 4.181 -6.259 313 HB3 LEU 38 HB3 LEU 38 104.713 2.690 -6.276 314 HG LEU 38 HG LEU 38 107.083 2.810 -8.113 315 HD11 LEU 38 HD11 LEU 38 107.960 3.767 -5.998 316 HD12 LEU 38 HD12 LEU 38 108.601 2.130 -6.272 317 HD13 LEU 38 HD13 LEU 38 107.290 2.387 -5.096 318 HD21 LEU 38 HD21 LEU 38 105.479 0.859 -7.916 319 HD22 LEU 38 HD22 LEU 38 107.176 0.438 -7.583 320 HD23 LEU 38 HD23 LEU 38 106.031 0.647 -6.237 321 H THR 39 H THR 39 104.840 6.300 -7.910 322 HA THR 39 HA THR 39 106.940 6.548 -10.077 323 HB THR 39 HB THR 39 105.343 8.907 -9.113 324 HG1 THR 39 HG1 THR 39 103.698 7.449 -9.426 325 HG21 THR 39 HG21 THR 39 105.523 9.507 -11.512 326 HG22 THR 39 HG22 THR 39 107.123 9.146 -10.820 327 HG23 THR 39 HG23 THR 39 106.304 7.942 -11.844 328 H ILE 40 H ILE 40 108.911 6.630 -9.041 329 HA ILE 40 HA ILE 40 109.057 8.184 -6.474 330 HB ILE 40 HB ILE 40 111.498 6.914 -7.643 331 HG12 ILE 40 HG12 ILE 40 110.475 4.740 -6.414 332 HG13 ILE 40 HG13 ILE 40 108.960 5.450 -7.024 333 HG21 ILE 40 HG21 ILE 40 111.480 8.011 -5.418 334 HG22 ILE 40 HG22 ILE 40 110.194 6.903 -4.884 335 HG23 ILE 40 HG23 ILE 40 111.811 6.269 -5.273 336 HD11 ILE 40 HD11 ILE 40 111.052 4.051 -8.488 337 HD12 ILE 40 HD12 ILE 40 109.443 4.566 -9.046 338 HD13 ILE 40 HD13 ILE 40 110.821 5.689 -9.145 339 H THR 41 H THR 41 109.709 10.228 -6.477 340 HA THR 41 HA THR 41 111.526 11.159 -8.704 341 HB THR 41 HB THR 41 109.550 13.025 -7.395 342 HG1 THR 41 HG1 THR 41 108.175 11.429 -8.073 343 HG21 THR 41 HG21 THR 41 109.683 14.107 -9.620 344 HG22 THR 41 HG22 THR 41 110.731 12.790 -10.198 345 HG23 THR 41 HG23 THR 41 111.303 13.886 -8.918 346 H GLN 42 H GLN 42 113.041 12.838 -8.004 347 HA GLN 42 HA GLN 42 113.211 13.025 -4.985 348 HB2 GLN 42 HB3 GLN 42 115.527 12.751 -6.949 349 HB3 GLN 42 HB2 GLN 42 115.661 12.895 -5.179 350 HG2 GLN 42 HG2 GLN 42 114.354 10.806 -4.914 351 HG3 GLN 42 HG3 GLN 42 114.229 10.661 -6.684 352 HE21 GLN 42 HE21 GLN 42 115.539 8.811 -7.041 353 HE22 GLN 42 HE22 GLN 42 117.228 8.738 -6.593 354 H GLU 43 H GLU 43 114.020 14.979 -4.137 355 HA GLU 43 HA GLU 43 114.656 17.153 -6.106 356 HB2 GLU 43 HB2 GLU 43 112.574 17.527 -3.913 357 HB3 GLU 43 HB3 GLU 43 113.024 18.682 -5.190 358 HG2 GLU 43 HG3 GLU 43 112.293 16.836 -6.857 359 HG3 GLU 43 HG2 GLU 43 111.513 16.061 -5.458 360 H GLY 44 H GLY 44 116.787 16.704 -5.103 361 HA2 GLY 44 HA3 GLY 44 118.486 17.276 -3.566 362 HA3 GLY 44 HA2 GLY 44 117.437 18.626 -3.076 363 H ASN 45 H ASN 45 115.952 18.309 -1.321 364 HA ASN 45 HA ASN 45 116.575 15.852 0.338 365 HB2 ASN 45 HB3 ASN 45 115.949 18.648 1.382 366 HB3 ASN 45 HB2 ASN 45 116.432 17.228 2.341 367 HD21 ASN 45 HD21 ASN 45 117.706 18.771 -0.702 368 HD22 ASN 45 HD22 ASN 45 119.358 18.842 -0.130 369 H LYS 46 H LYS 46 114.364 16.410 -1.603 370 HA LYS 46 HA LYS 46 112.155 15.759 0.297 371 HB2 LYS 46 HB2 LYS 46 111.851 18.145 0.003 372 HB3 LYS 46 HB3 LYS 46 112.129 18.019 -1.751 373 HG2 LYS 46 HG2 LYS 46 109.997 16.220 -0.881 374 HG3 LYS 46 HG3 LYS 46 109.645 17.904 -0.427 375 HD2 LYS 46 HD2 LYS 46 110.217 18.568 -2.811 376 HD3 LYS 46 HD3 LYS 46 110.297 16.834 -3.205 377 HE2 LYS 46 HE2 LYS 46 108.071 17.351 -3.742 378 HE3 LYS 46 HE3 LYS 46 107.916 16.750 -2.074 379 HZ1 LYS 46 HZ1 LYS 46 106.749 18.829 -2.383 380 HZ2 LYS 46 HZ2 LYS 46 108.134 19.586 -2.861 381 HZ3 LYS 46 HZ3 LYS 46 107.991 19.029 -1.315 382 H PHE 47 H PHE 47 111.679 13.807 -0.435 383 HA PHE 47 HA PHE 47 111.876 13.208 -3.362 384 HB2 PHE 47 HB3 PHE 47 111.620 11.590 -0.823 385 HB3 PHE 47 HB2 PHE 47 111.142 10.861 -2.373 386 HD1 PHE 47 HD1 PHE 47 113.816 13.415 -2.086 387 HD2 PHE 47 HD2 PHE 47 112.931 9.224 -2.425 388 HE1 PHE 47 HE1 PHE 47 116.198 12.951 -2.597 389 HE2 PHE 47 HE2 PHE 47 115.311 8.763 -2.940 390 HZ PHE 47 HZ PHE 47 116.945 10.626 -3.023 391 H THR 48 H THR 48 109.997 11.716 -4.172 392 HA THR 48 HA THR 48 107.367 12.385 -2.953 393 HB THR 48 HB THR 48 108.095 13.250 -5.788 394 HG1 THR 48 HG1 THR 48 108.871 14.670 -4.164 395 HG21 THR 48 HG21 THR 48 105.797 14.175 -5.815 396 HG22 THR 48 HG22 THR 48 105.775 12.412 -5.570 397 HG23 THR 48 HG23 THR 48 105.509 13.505 -4.191 398 H VAL 49 H VAL 49 106.773 10.284 -2.783 399 HA VAL 49 HA VAL 49 107.163 8.494 -5.169 400 HB VAL 49 HB VAL 49 106.325 7.899 -2.296 401 HG11 VAL 49 HG11 VAL 49 106.567 5.524 -2.967 402 HG12 VAL 49 HG12 VAL 49 106.900 6.032 -4.640 403 HG13 VAL 49 HG13 VAL 49 105.301 6.334 -3.920 404 HG21 VAL 49 HG21 VAL 49 108.708 8.548 -2.562 405 HG22 VAL 49 HG22 VAL 49 108.899 7.324 -3.840 406 HG23 VAL 49 HG23 VAL 49 108.558 6.819 -2.167 407 H LYS 50 H LYS 50 105.472 8.231 -6.534 408 HA LYS 50 HA LYS 50 102.720 8.853 -5.446 409 HB2 LYS 50 HB2 LYS 50 103.889 10.023 -7.566 410 HB3 LYS 50 HB3 LYS 50 103.247 8.583 -8.392 411 HG2 LYS 50 HG3 LYS 50 101.053 9.243 -6.966 412 HG3 LYS 50 HG2 LYS 50 101.785 10.860 -7.094 413 HD2 LYS 50 HD2 LYS 50 101.876 10.672 -9.533 414 HD3 LYS 50 HD3 LYS 50 101.275 8.998 -9.456 415 HE2 LYS 50 HE2 LYS 50 99.276 10.117 -8.110 416 HE3 LYS 50 HE3 LYS 50 99.806 11.586 -8.965 417 HZ1 LYS 50 HZ1 LYS 50 98.158 10.367 -10.225 418 HZ2 LYS 50 HZ2 LYS 50 99.596 10.377 -11.034 419 HZ3 LYS 50 HZ3 LYS 50 99.105 9.017 -10.241 420 H GLU 51 H GLU 51 102.018 6.863 -4.676 421 HA GLU 51 HA GLU 51 102.583 4.359 -6.071 422 HB2 GLU 51 HB2 GLU 51 101.802 4.827 -3.582 423 HB3 GLU 51 HB3 GLU 51 100.171 4.723 -4.287 424 HG2 GLU 51 HG2 GLU 51 100.623 2.491 -3.672 425 HG3 GLU 51 HG3 GLU 51 101.053 2.522 -5.399 426 H SER 52 H SER 52 101.021 3.045 -7.265 427 HA SER 52 HA SER 52 98.502 4.339 -8.112 428 HB2 SER 52 HB2 SER 52 100.477 3.680 -10.313 429 HB3 SER 52 HB3 SER 52 99.019 4.699 -10.385 430 HG SER 52 HG SER 52 100.855 6.026 -10.291 431 H SER 53 H SER 53 97.290 2.627 -7.713 432 HA SER 53 HA SER 53 97.878 0.112 -9.241 433 HB2 SER 53 HB2 SER 53 96.755 -0.371 -6.551 434 HB3 SER 53 HB3 SER 53 98.079 -1.210 -7.396 435 HG SER 53 HG SER 53 98.921 -0.094 -5.611 436 H ALA 54 H ALA 54 95.960 -0.943 -9.907 437 HA ALA 54 HA ALA 54 93.613 0.669 -10.196 438 HB1 ALA 54 HB1 ALA 54 92.471 -1.440 -10.827 439 HB2 ALA 54 HB2 ALA 54 93.826 -2.376 -10.153 440 HB3 ALA 54 HB3 ALA 54 94.082 -1.339 -11.576 441 H PHE 55 H PHE 55 94.849 -0.215 -7.335 442 HA PHE 55 HA PHE 55 92.180 -0.911 -6.120 443 HB2 PHE 55 HB3 PHE 55 94.784 -0.936 -4.594 444 HB3 PHE 55 HB2 PHE 55 93.331 -1.938 -4.365 445 HD1 PHE 55 HD1 PHE 55 96.579 -2.307 -5.186 446 HD2 PHE 55 HD2 PHE 55 92.731 -3.026 -6.955 447 HE1 PHE 55 HE1 PHE 55 97.568 -4.071 -6.621 448 HE2 PHE 55 HE2 PHE 55 93.720 -4.790 -8.390 449 HZ PHE 55 HZ PHE 55 96.139 -5.312 -8.223 450 H ARG 56 H ARG 56 94.669 1.601 -6.233 451 HA ARG 56 HA ARG 56 93.115 3.713 -5.333 452 HB2 ARG 56 HB3 ARG 56 93.728 1.874 -3.091 453 HB3 ARG 56 HB2 ARG 56 94.170 3.569 -2.774 454 HG2 ARG 56 HG2 ARG 56 91.976 4.302 -2.861 455 HG3 ARG 56 HG3 ARG 56 91.493 3.055 -4.035 456 HD2 ARG 56 HD3 ARG 56 90.455 2.557 -1.878 457 HD3 ARG 56 HD2 ARG 56 91.703 1.334 -2.213 458 HE ARG 56 HE ARG 56 93.141 3.160 -0.747 459 HH11 ARG 56 HH11 ARG 56 93.167 3.255 1.510 460 HH12 ARG 56 HH12 ARG 56 91.795 2.674 2.426 461 HH21 ARG 56 HH21 ARG 56 89.976 1.750 -0.395 462 HH22 ARG 56 HH22 ARG 56 89.996 1.825 1.352 463 H ASN 57 H ASN 57 94.709 4.626 -6.731 464 HA ASN 57 HA ASN 57 97.548 4.522 -6.202 465 HB2 ASN 57 HB2 ASN 57 97.711 6.414 -7.736 466 HB3 ASN 57 HB3 ASN 57 96.475 5.292 -8.353 467 HD21 ASN 57 HD21 ASN 57 96.503 8.098 -9.057 468 HD22 ASN 57 HD22 ASN 57 95.082 8.833 -8.349 469 H ILE 58 H ILE 58 98.906 5.925 -5.041 470 HA ILE 58 HA ILE 58 97.518 8.032 -3.390 471 HB ILE 58 HB ILE 58 99.671 6.345 -2.140 472 HG12 ILE 58 HG12 ILE 58 96.789 5.552 -2.632 473 HG13 ILE 58 HG13 ILE 58 98.266 4.571 -2.807 474 HG21 ILE 58 HG21 ILE 58 98.510 8.520 -1.216 475 HG22 ILE 58 HG22 ILE 58 98.742 7.132 -0.127 476 HG23 ILE 58 HG23 ILE 58 97.149 7.429 -0.863 477 HD11 ILE 58 HD11 ILE 58 97.380 3.792 -0.771 478 HD12 ILE 58 HD12 ILE 58 98.557 5.016 -0.237 479 HD13 ILE 58 HD13 ILE 58 96.821 5.411 -0.285 480 H GLU 59 H GLU 59 99.259 9.321 -2.160 481 HA GLU 59 HA GLU 59 101.845 9.516 -3.643 482 HB2 GLU 59 HB2 GLU 59 101.142 11.223 -4.952 483 HB3 GLU 59 HB3 GLU 59 99.570 11.281 -4.124 484 HG2 GLU 59 HG3 GLU 59 100.493 12.706 -2.368 485 HG3 GLU 59 HG2 GLU 59 102.129 12.548 -3.051 486 H CYS 60 H CYS 60 103.439 9.975 -2.205 487 HA CYS 60 HA CYS 60 102.732 11.545 0.253 488 HB2 CYS 60 HB2 CYS 60 103.883 8.725 0.245 489 HB3 CYS 60 HB3 CYS 60 103.969 9.810 1.653 490 HG CYS 60 HG CYS 60 100.901 10.137 1.025 491 H VAL 61 H VAL 61 104.328 12.992 0.668 492 HA VAL 61 HA VAL 61 106.779 12.930 -0.960 493 HB VAL 61 HB VAL 61 106.042 15.111 -0.479 494 HG11 VAL 61 HG11 VAL 61 105.704 15.647 2.130 495 HG12 VAL 61 HG12 VAL 61 105.349 13.904 2.181 496 HG13 VAL 61 HG13 VAL 61 104.390 14.977 1.134 497 HG21 VAL 61 HG21 VAL 61 107.757 16.124 0.900 498 HG22 VAL 61 HG22 VAL 61 108.022 14.600 1.781 499 HG23 VAL 61 HG23 VAL 61 108.492 14.733 0.069 500 H PHE 62 H PHE 62 108.969 13.077 0.105 501 HA PHE 62 HA PHE 62 109.084 11.632 2.729 502 HB2 PHE 62 HB2 PHE 62 109.346 9.689 1.529 503 HB3 PHE 62 HB3 PHE 62 109.911 10.535 0.072 504 HD1 PHE 62 HD1 PHE 62 111.913 9.390 -0.440 505 HD2 PHE 62 HD2 PHE 62 111.259 10.815 3.558 506 HE1 PHE 62 HE1 PHE 62 114.255 8.824 0.144 507 HE2 PHE 62 HE2 PHE 62 113.603 10.252 4.141 508 HZ PHE 62 HZ PHE 62 115.100 9.257 2.435 509 H GLU 63 H GLU 63 110.348 12.868 3.958 510 HA GLU 63 HA GLU 63 112.700 14.248 2.640 511 HB2 GLU 63 HB2 GLU 63 110.834 15.074 4.881 512 HB3 GLU 63 HB3 GLU 63 112.471 15.763 4.763 513 HG2 GLU 63 HG3 GLU 63 112.018 16.836 2.737 514 HG3 GLU 63 HG2 GLU 63 110.714 15.702 2.310 515 H LEU 64 H LEU 64 114.449 14.733 4.457 516 HA LEU 64 HA LEU 64 114.892 12.080 5.807 517 HB2 LEU 64 HB3 LEU 64 116.792 14.372 5.151 518 HB3 LEU 64 HB2 LEU 64 117.263 12.876 5.993 519 HG LEU 64 HG LEU 64 115.828 12.754 3.329 520 HD11 LEU 64 HD11 LEU 64 118.045 12.674 2.223 521 HD12 LEU 64 HD12 LEU 64 117.782 14.245 3.016 522 HD13 LEU 64 HD13 LEU 64 118.834 13.029 3.779 523 HD21 LEU 64 HD21 LEU 64 116.081 10.691 4.685 524 HD22 LEU 64 HD22 LEU 64 117.840 10.951 4.751 525 HD23 LEU 64 HD23 LEU 64 117.050 10.600 3.195 526 H GLY 65 H GLY 65 114.445 11.957 7.929 527 HA2 GLY 65 HA2 GLY 65 114.697 12.586 10.229 528 HA3 GLY 65 HA3 GLY 65 115.312 14.173 9.718 529 H VAL 66 H VAL 66 112.622 13.839 7.869 530 HA VAL 66 HA VAL 66 110.985 15.290 9.947 531 HB VAL 66 HB VAL 66 110.242 15.193 7.028 532 HG11 VAL 66 HG11 VAL 66 108.797 16.338 8.688 533 HG12 VAL 66 HG12 VAL 66 109.508 17.504 7.547 534 HG13 VAL 66 HG13 VAL 66 110.174 17.347 9.190 535 HG21 VAL 66 HG21 VAL 66 111.760 17.302 6.840 536 HG22 VAL 66 HG22 VAL 66 112.544 15.706 6.758 537 HG23 VAL 66 HG23 VAL 66 112.601 16.649 8.267 538 H THR 67 H THR 67 109.736 13.799 11.021 539 HA THR 67 HA THR 67 108.755 11.344 9.870 540 HB THR 67 HB THR 67 107.136 12.763 11.966 541 HG1 THR 67 HG1 THR 67 109.176 13.308 12.650 542 HG21 THR 67 HG21 THR 67 106.924 10.571 12.871 543 HG22 THR 67 HG22 THR 67 108.356 9.981 11.994 544 HG23 THR 67 HG23 THR 67 106.853 10.334 11.108 545 H PHE 68 H PHE 68 106.870 10.825 8.875 546 HA PHE 68 HA PHE 68 104.798 12.936 8.478 547 HB2 PHE 68 HB2 PHE 68 104.896 12.033 5.925 548 HB3 PHE 68 HB3 PHE 68 105.785 13.476 6.466 549 HD1 PHE 68 HD1 PHE 68 106.156 9.740 6.286 550 HD2 PHE 68 HD2 PHE 68 108.082 13.574 6.112 551 HE1 PHE 68 HE1 PHE 68 108.302 8.637 5.705 552 HE2 PHE 68 HE2 PHE 68 110.226 12.471 5.535 553 HZ PHE 68 HZ PHE 68 110.332 10.004 5.329 554 H ASN 69 H ASN 69 103.159 11.619 6.707 555 HA ASN 69 HA ASN 69 102.982 8.827 7.810 556 HB2 ASN 69 HB2 ASN 69 100.712 9.076 8.491 557 HB3 ASN 69 HB3 ASN 69 101.546 10.511 9.132 558 HD21 ASN 69 HD21 ASN 69 101.768 11.828 6.455 559 HD22 ASN 69 HD22 ASN 69 100.150 12.365 6.061 560 H CYS 70 H CYS 70 101.754 7.388 6.527 561 HA CYS 70 HA CYS 70 100.594 8.341 3.972 562 HB2 CYS 70 HB3 CYS 70 103.156 8.085 3.634 563 HB3 CYS 70 HB2 CYS 70 102.878 6.338 3.833 564 HG CYS 70 HG CYS 70 101.749 5.889 1.466 565 H ASN 71 H ASN 71 99.029 6.857 3.290 566 HA ASN 71 HA ASN 71 98.689 4.530 5.154 567 HB2 ASN 71 HB3 ASN 71 96.434 4.391 3.826 568 HB3 ASN 71 HB2 ASN 71 96.666 5.716 4.992 569 HD21 ASN 71 HD21 ASN 71 98.367 5.622 1.855 570 HD22 ASN 71 HD22 ASN 71 97.499 6.971 1.156 571 H LEU 72 H LEU 72 98.611 2.401 4.458 572 HA LEU 72 HA LEU 72 99.826 1.942 1.758 573 HB2 LEU 72 HB3 LEU 72 99.304 0.138 4.156 574 HB3 LEU 72 HB2 LEU 72 99.933 -0.465 2.605 575 HG LEU 72 HG LEU 72 101.277 1.892 3.934 576 HD11 LEU 72 HD11 LEU 72 101.070 0.166 5.704 577 HD12 LEU 72 HD12 LEU 72 101.758 -1.048 4.599 578 HD13 LEU 72 HD13 LEU 72 102.755 0.318 5.153 579 HD21 LEU 72 HD21 LEU 72 101.914 1.199 1.636 580 HD22 LEU 72 HD22 LEU 72 103.248 0.921 2.781 581 HD23 LEU 72 HD23 LEU 72 102.251 -0.446 2.227 582 H ALA 73 H ALA 73 98.834 0.659 0.161 583 HA ALA 73 HA ALA 73 96.114 0.939 -0.355 584 HB1 ALA 73 HB1 ALA 73 96.278 -1.081 -1.783 585 HB2 ALA 73 HB2 ALA 73 97.724 -0.058 -1.952 586 HB3 ALA 73 HB3 ALA 73 97.791 -1.537 -0.964 587 H ASP 74 H ASP 74 97.625 -1.464 1.784 588 HA ASP 74 HA ASP 74 95.311 -3.138 2.144 589 HB2 ASP 74 HB2 ASP 74 96.578 -3.091 4.637 590 HB3 ASP 74 HB3 ASP 74 96.963 -4.190 3.291 591 H GLY 75 H GLY 75 95.283 0.069 2.465 592 HA2 GLY 75 HA2 GLY 75 93.723 1.491 3.544 593 HA3 GLY 75 HA3 GLY 75 92.937 0.043 4.217 594 H THR 76 H THR 76 96.378 0.570 4.664 595 HA THR 76 HA THR 76 95.828 0.901 7.601 596 HB THR 76 HB THR 76 98.628 0.600 6.687 597 HG1 THR 76 HG1 THR 76 96.663 -1.409 6.201 598 HG21 THR 76 HG21 THR 76 98.620 -1.093 8.496 599 HG22 THR 76 HG22 THR 76 96.855 -0.924 8.647 600 HG23 THR 76 HG23 THR 76 97.918 0.445 9.053 601 H GLU 77 H GLU 77 97.224 2.414 8.790 602 HA GLU 77 HA GLU 77 98.175 4.724 7.093 603 HB2 GLU 77 HB3 GLU 77 95.912 5.225 8.044 604 HB3 GLU 77 HB2 GLU 77 96.563 4.942 9.676 605 HG2 GLU 77 HG2 GLU 77 98.263 6.738 9.263 606 HG3 GLU 77 HG3 GLU 77 97.492 7.064 7.692 607 H LEU 78 H LEU 78 100.315 5.100 7.575 608 HA LEU 78 HA LEU 78 101.131 4.656 10.447 609 HB2 LEU 78 HB3 LEU 78 103.134 3.844 8.399 610 HB3 LEU 78 HB2 LEU 78 102.748 3.110 9.973 611 HG LEU 78 HG LEU 78 100.562 2.299 8.921 612 HD11 LEU 78 HD11 LEU 78 101.473 2.202 6.213 613 HD12 LEU 78 HD12 LEU 78 100.045 3.049 6.853 614 HD13 LEU 78 HD13 LEU 78 101.607 3.895 6.745 615 HD21 LEU 78 HD21 LEU 78 101.670 0.397 7.775 616 HD22 LEU 78 HD22 LEU 78 102.517 0.819 9.283 617 HD23 LEU 78 HD23 LEU 78 103.190 1.322 7.713 618 H ARG 79 H ARG 79 103.251 5.662 10.968 619 HA ARG 79 HA ARG 79 104.072 7.834 9.057 620 HB2 ARG 79 HB2 ARG 79 104.018 9.499 10.944 621 HB3 ARG 79 HB3 ARG 79 102.402 8.917 10.476 622 HG2 ARG 79 HG3 ARG 79 102.448 7.281 12.334 623 HG3 ARG 79 HG2 ARG 79 104.070 7.848 12.798 624 HD2 ARG 79 HD2 ARG 79 102.900 10.219 12.870 625 HD3 ARG 79 HD3 ARG 79 101.410 9.261 13.034 626 HE ARG 79 HE ARG 79 103.323 8.228 14.910 627 HH11 ARG 79 HH11 ARG 79 103.162 8.883 17.068 628 HH12 ARG 79 HH12 ARG 79 102.302 10.351 17.475 629 HH21 ARG 79 HH21 ARG 79 101.475 11.085 14.173 630 HH22 ARG 79 HH22 ARG 79 101.351 11.593 15.842 631 H GLY 80 H GLY 80 106.247 8.489 9.326 632 HA2 GLY 80 HA2 GLY 80 107.894 7.982 11.580 633 HA3 GLY 80 HA3 GLY 80 107.995 6.531 10.549 634 H THR 81 H THR 81 109.643 6.616 9.095 635 HA THR 81 HA THR 81 109.983 8.709 7.198 636 HB THR 81 HB THR 81 112.344 9.291 8.698 637 HG1 THR 81 HG1 THR 81 111.572 9.868 10.659 638 HG21 THR 81 HG21 THR 81 111.282 11.596 8.744 639 HG22 THR 81 HG22 THR 81 109.821 10.862 8.039 640 HG23 THR 81 HG23 THR 81 111.353 10.842 7.133 641 H TRP 82 H TRP 82 111.900 8.473 5.893 642 HA TRP 82 HA TRP 82 113.165 5.763 6.283 643 HB2 TRP 82 HB2 TRP 82 113.417 7.495 3.804 644 HB3 TRP 82 HB3 TRP 82 113.602 5.732 3.951 645 HD1 TRP 82 HD1 TRP 82 110.882 8.453 4.182 646 HE1 TRP 82 HE1 TRP 82 108.605 7.427 3.555 647 HE3 TRP 82 HE3 TRP 82 112.326 3.595 3.615 648 HZ2 TRP 82 HZ2 TRP 82 107.564 4.815 2.875 649 HZ3 TRP 82 HZ3 TRP 82 110.681 1.857 2.971 650 HH2 TRP 82 HH2 TRP 82 108.304 2.460 2.600 651 H SER 83 H SER 83 115.399 5.558 6.449 652 HA SER 83 HA SER 83 117.012 8.095 6.253 653 HB2 SER 83 HB2 SER 83 116.780 8.111 8.575 654 HB3 SER 83 HB3 SER 83 116.613 6.342 8.674 655 HG SER 83 HG SER 83 118.691 7.144 9.405 656 H LEU 84 H LEU 84 119.353 7.612 5.951 657 HA LEU 84 HA LEU 84 119.608 4.989 4.555 658 HB2 LEU 84 HB2 LEU 84 120.824 6.353 3.209 659 HB3 LEU 84 HB3 LEU 84 120.935 7.615 4.458 660 HG LEU 84 HG LEU 84 122.716 6.211 5.590 661 HD11 LEU 84 HD11 LEU 84 123.423 4.755 3.157 662 HD12 LEU 84 HD12 LEU 84 121.814 4.274 3.745 663 HD13 LEU 84 HD13 LEU 84 123.228 4.146 4.819 664 HD21 LEU 84 HD21 LEU 84 124.486 6.843 3.970 665 HD22 LEU 84 HD22 LEU 84 123.276 8.139 4.137 666 HD23 LEU 84 HD23 LEU 84 123.249 7.074 2.711 667 H GLU 85 H GLU 85 120.597 3.251 5.453 668 HA GLU 85 HA GLU 85 122.270 3.720 7.920 669 HB2 GLU 85 HB2 GLU 85 120.574 2.745 9.089 670 HB3 GLU 85 HB3 GLU 85 119.769 2.174 7.610 671 HG2 GLU 85 HG2 GLU 85 121.187 0.230 7.487 672 HG3 GLU 85 HG3 GLU 85 122.269 0.863 8.751 673 H GLY 86 H GLY 86 124.272 2.884 7.594 674 HA2 GLY 86 HA3 GLY 86 125.977 1.560 6.627 675 HA3 GLY 86 HA2 GLY 86 124.760 0.262 6.527 676 H ASN 87 H ASN 87 124.045 -0.310 4.510 677 HA ASN 87 HA ASN 87 124.593 1.662 2.280 678 HB2 ASN 87 HB2 ASN 87 124.856 -1.376 2.202 679 HB3 ASN 87 HB3 ASN 87 125.091 -0.280 0.819 680 HD21 ASN 87 HD21 ASN 87 127.326 -0.261 0.452 681 HD22 ASN 87 HD22 ASN 87 128.521 0.023 1.698 682 H LYS 88 H LYS 88 122.071 1.295 3.793 683 HA LYS 88 HA LYS 88 120.389 0.621 1.407 684 HB2 LYS 88 HB2 LYS 88 118.854 -0.711 3.003 685 HB3 LYS 88 HB3 LYS 88 120.356 -1.504 2.474 686 HG2 LYS 88 HG2 LYS 88 120.541 0.164 4.948 687 HG3 LYS 88 HG3 LYS 88 119.603 -1.342 5.083 688 HD2 LYS 88 HD2 LYS 88 121.544 -2.587 4.092 689 HD3 LYS 88 HD3 LYS 88 122.479 -1.073 4.100 690 HE2 LYS 88 HE2 LYS 88 122.704 -1.063 6.403 691 HE3 LYS 88 HE3 LYS 88 121.153 -1.897 6.665 692 HZ1 LYS 88 HZ1 LYS 88 123.025 -3.328 7.143 693 HZ2 LYS 88 HZ2 LYS 88 123.615 -3.143 5.614 694 HZ3 LYS 88 HZ3 LYS 88 122.178 -3.916 5.856 695 H LEU 89 H LEU 89 118.132 1.367 1.675 696 HA LEU 89 HA LEU 89 118.076 3.807 3.435 697 HB2 LEU 89 HB2 LEU 89 116.663 2.929 0.923 698 HB3 LEU 89 HB3 LEU 89 115.829 4.069 2.006 699 HG LEU 89 HG LEU 89 118.712 4.582 1.279 700 HD11 LEU 89 HD11 LEU 89 117.579 4.115 -0.877 701 HD12 LEU 89 HD12 LEU 89 116.297 5.274 -0.454 702 HD13 LEU 89 HD13 LEU 89 117.962 5.846 -0.718 703 HD21 LEU 89 HD21 LEU 89 117.554 5.970 2.979 704 HD22 LEU 89 HD22 LEU 89 116.282 6.357 1.795 705 HD23 LEU 89 HD23 LEU 89 117.947 6.928 1.531 706 H ILE 90 H ILE 90 117.195 3.460 5.417 707 HA ILE 90 HA ILE 90 115.338 1.187 5.802 708 HB ILE 90 HB ILE 90 115.225 2.397 8.182 709 HG12 ILE 90 HG12 ILE 90 117.891 3.320 7.049 710 HG13 ILE 90 HG13 ILE 90 116.483 4.387 7.282 711 HG21 ILE 90 HG21 ILE 90 116.165 0.154 7.697 712 HG22 ILE 90 HG22 ILE 90 117.665 0.912 7.110 713 HG23 ILE 90 HG23 ILE 90 117.205 1.059 8.823 714 HD11 ILE 90 HD11 ILE 90 118.007 4.488 9.228 715 HD12 ILE 90 HD12 ILE 90 116.430 3.797 9.679 716 HD13 ILE 90 HD13 ILE 90 117.836 2.730 9.449 717 H GLY 91 H GLY 91 113.296 1.506 6.984 718 HA2 GLY 91 HA3 GLY 91 111.933 4.125 6.499 719 HA3 GLY 91 HA2 GLY 91 111.255 2.691 5.688 720 H LYS 92 H LYS 92 111.670 4.359 8.722 721 HA LYS 92 HA LYS 92 110.505 2.083 10.265 722 HB2 LYS 92 HB2 LYS 92 111.670 4.786 10.924 723 HB3 LYS 92 HB3 LYS 92 110.574 4.014 12.095 724 HG2 LYS 92 HG2 LYS 92 111.983 2.040 12.209 725 HG3 LYS 92 HG3 LYS 92 113.001 2.631 10.874 726 HD2 LYS 92 HD2 LYS 92 114.144 3.072 12.986 727 HD3 LYS 92 HD3 LYS 92 113.607 4.621 12.293 728 HE2 LYS 92 HE3 LYS 92 111.803 3.132 14.207 729 HE3 LYS 92 HE2 LYS 92 113.152 4.105 14.843 730 HZ1 LYS 92 HZ1 LYS 92 111.727 5.783 14.638 731 HZ2 LYS 92 HZ2 LYS 92 112.026 5.723 13.017 732 HZ3 LYS 92 HZ3 LYS 92 110.702 4.963 13.640 733 H PHE 93 H PHE 93 108.346 1.811 9.876 734 HA PHE 93 HA PHE 93 106.653 4.319 9.909 735 HB2 PHE 93 HB2 PHE 93 106.493 1.761 8.327 736 HB3 PHE 93 HB3 PHE 93 104.982 2.598 8.744 737 HD1 PHE 93 HD1 PHE 93 107.344 5.144 8.661 738 HD2 PHE 93 HD2 PHE 93 105.278 2.475 6.000 739 HE1 PHE 93 HE1 PHE 93 107.710 6.725 6.788 740 HE2 PHE 93 HE2 PHE 93 105.644 4.060 4.130 741 HZ PHE 93 HZ PHE 93 106.860 6.185 4.524 742 H LYS 94 H LYS 94 105.027 4.443 11.348 743 HA LYS 94 HA LYS 94 104.615 2.020 13.109 744 HB2 LYS 94 HB3 LYS 94 104.719 4.982 13.698 745 HB3 LYS 94 HB2 LYS 94 103.752 3.908 14.736 746 HG2 LYS 94 HG2 LYS 94 105.834 3.848 15.807 747 HG3 LYS 94 HG3 LYS 94 105.937 2.422 14.747 748 HD2 LYS 94 HD3 LYS 94 107.998 3.640 14.462 749 HD3 LYS 94 HD2 LYS 94 107.023 3.942 13.004 750 HE2 LYS 94 HE2 LYS 94 106.644 6.155 13.547 751 HE3 LYS 94 HE3 LYS 94 106.669 5.839 15.299 752 HZ1 LYS 94 HZ1 LYS 94 108.623 7.048 14.584 753 HZ2 LYS 94 HZ2 LYS 94 109.030 5.852 13.525 754 HZ3 LYS 94 HZ3 LYS 94 109.053 5.559 15.148 755 H ARG 95 H ARG 95 102.679 1.095 12.769 756 HA ARG 95 HA ARG 95 100.590 2.247 11.181 757 HB2 ARG 95 HB2 ARG 95 100.797 -0.025 13.136 758 HB3 ARG 95 HB3 ARG 95 99.165 0.539 12.705 759 HG2 ARG 95 HG2 ARG 95 99.855 0.350 10.262 760 HG3 ARG 95 HG3 ARG 95 101.344 -0.452 10.819 761 HD2 ARG 95 HD2 ARG 95 99.880 -2.259 10.381 762 HD3 ARG 95 HD3 ARG 95 99.733 -2.028 12.140 763 HE ARG 95 HE ARG 95 97.745 -0.401 10.809 764 HH11 ARG 95 HH11 ARG 95 95.619 -1.168 10.798 765 HH12 ARG 95 HH12 ARG 95 95.299 -2.863 11.092 766 HH21 ARG 95 HH21 ARG 95 98.656 -3.691 11.493 767 HH22 ARG 95 HH22 ARG 95 97.010 -4.284 11.484 768 H THR 96 H THR 96 99.472 4.070 11.651 769 HA THR 96 HA THR 96 99.322 5.069 14.413 770 HB THR 96 HB THR 96 97.492 6.560 13.049 771 HG1 THR 96 HG1 THR 96 99.366 5.629 11.108 772 HG21 THR 96 HG21 THR 96 99.371 8.098 12.558 773 HG22 THR 96 HG22 THR 96 100.527 6.771 12.823 774 HG23 THR 96 HG23 THR 96 99.542 7.377 14.176 775 H ASP 97 H ASP 97 97.635 2.860 12.575 776 HA ASP 97 HA ASP 97 95.043 3.237 14.008 777 HB2 ASP 97 HB2 ASP 97 95.096 2.643 11.577 778 HB3 ASP 97 HB3 ASP 97 95.897 1.109 11.995 779 H ASN 98 H ASN 98 97.819 1.002 13.909 780 HA ASN 98 HA ASN 98 96.691 -0.243 16.419 781 HB2 ASN 98 HB2 ASN 98 96.382 -1.725 14.384 782 HB3 ASN 98 HB3 ASN 98 98.154 -1.779 14.232 783 HD21 ASN 98 HD21 ASN 98 97.327 -1.474 17.524 784 HD22 ASN 98 HD22 ASN 98 97.409 -3.168 17.953 785 H GLY 99 H GLY 99 99.124 1.598 15.190 786 HA2 GLY 99 HA3 GLY 99 101.427 1.850 15.758 787 HA3 GLY 99 HA2 GLY 99 100.823 1.519 17.399 788 H ASN 100 H ASN 100 100.622 -0.870 14.795 789 HA ASN 100 HA ASN 100 102.139 -2.777 16.459 790 HB2 ASN 100 HB2 ASN 100 100.302 -2.921 14.288 791 HB3 ASN 100 HB3 ASN 100 101.815 -3.665 13.719 792 HD21 ASN 100 HD21 ASN 100 99.232 -5.037 14.423 793 HD22 ASN 100 HD22 ASN 100 99.643 -6.160 15.700 794 H GLU 101 H GLU 101 103.320 -0.244 15.197 795 HA GLU 101 HA GLU 101 105.295 0.399 14.081 796 HB2 GLU 101 HB3 GLU 101 107.276 -0.634 14.961 797 HB3 GLU 101 HB2 GLU 101 106.058 -0.672 16.255 798 HG2 GLU 101 HG2 GLU 101 105.610 -2.996 15.904 799 HG3 GLU 101 HG3 GLU 101 106.480 -3.005 14.351 800 H LEU 102 H LEU 102 106.985 -0.174 12.488 801 HA LEU 102 HA LEU 102 106.662 -2.708 10.996 802 HB2 LEU 102 HB3 LEU 102 104.947 -1.808 9.730 803 HB3 LEU 102 HB2 LEU 102 105.441 -0.133 10.063 804 HG LEU 102 HG LEU 102 107.366 -0.400 8.503 805 HD11 LEU 102 HD11 LEU 102 106.371 -2.810 7.176 806 HD12 LEU 102 HD12 LEU 102 106.859 -3.149 8.853 807 HD13 LEU 102 HD13 LEU 102 108.021 -2.420 7.718 808 HD21 LEU 102 HD21 LEU 102 105.193 0.466 7.673 809 HD22 LEU 102 HD22 LEU 102 104.673 -1.197 7.308 810 HD23 LEU 102 HD23 LEU 102 106.034 -0.474 6.416 811 H ASN 103 H ASN 103 108.675 -3.210 10.235 812 HA ASN 103 HA ASN 103 110.615 -0.897 9.980 813 HB2 ASN 103 HB3 ASN 103 110.767 -3.258 11.573 814 HB3 ASN 103 HB2 ASN 103 111.929 -3.471 10.243 815 HD21 ASN 103 HD21 ASN 103 112.064 -2.596 13.319 816 HD22 ASN 103 HD22 ASN 103 113.170 -1.243 13.251 817 H THR 104 H THR 104 111.033 -0.496 7.866 818 HA THR 104 HA THR 104 111.173 -2.905 6.043 819 HB THR 104 HB THR 104 109.127 -1.748 5.508 820 HG1 THR 104 HG1 THR 104 109.860 -2.052 3.536 821 HG21 THR 104 HG21 THR 104 109.462 0.792 4.818 822 HG22 THR 104 HG22 THR 104 110.877 0.682 5.893 823 HG23 THR 104 HG23 THR 104 109.248 0.353 6.530 824 H VAL 105 H VAL 105 112.242 -2.178 3.876 825 HA VAL 105 HA VAL 105 114.414 -0.164 4.298 826 HB VAL 105 HB VAL 105 114.974 -3.074 3.564 827 HG11 VAL 105 HG11 VAL 105 117.385 -2.070 4.072 828 HG12 VAL 105 HG12 VAL 105 116.595 -0.533 3.647 829 HG13 VAL 105 HG13 VAL 105 116.641 -1.866 2.468 830 HG21 VAL 105 HG21 VAL 105 116.166 -3.132 5.746 831 HG22 VAL 105 HG22 VAL 105 115.610 -1.476 6.085 832 HG23 VAL 105 HG23 VAL 105 114.430 -2.802 5.961 833 H ARG 106 H ARG 106 115.459 0.398 2.233 834 HA ARG 106 HA ARG 106 113.895 -0.580 -0.165 835 HB2 ARG 106 HB2 ARG 106 112.941 1.559 0.234 836 HB3 ARG 106 HB3 ARG 106 114.507 2.266 0.698 837 HG2 ARG 106 HG2 ARG 106 115.295 2.266 -1.553 838 HG3 ARG 106 HG3 ARG 106 114.007 1.161 -2.088 839 HD2 ARG 106 HD3 ARG 106 113.837 3.792 -2.528 840 HD3 ARG 106 HD2 ARG 106 112.394 2.835 -2.118 841 HE ARG 106 HE ARG 106 113.831 3.974 0.221 842 HH11 ARG 106 HH11 ARG 106 112.609 5.474 1.391 843 HH12 ARG 106 HH12 ARG 106 111.130 6.115 0.714 844 HH21 ARG 106 HH21 ARG 106 111.383 4.284 -2.236 845 HH22 ARG 106 HH22 ARG 106 110.439 5.445 -1.330 846 H GLU 107 H GLU 107 115.164 -1.097 -1.902 847 HA GLU 107 HA GLU 107 117.959 0.007 -1.987 848 HB2 GLU 107 HB3 GLU 107 117.186 -2.932 -1.899 849 HB3 GLU 107 HB2 GLU 107 118.729 -2.381 -2.595 850 HG2 GLU 107 HG3 GLU 107 119.131 -1.133 -0.399 851 HG3 GLU 107 HG2 GLU 107 117.732 -2.016 0.259 852 H ILE 108 H ILE 108 118.927 -0.245 -4.157 853 HA ILE 108 HA ILE 108 116.833 -0.774 -6.265 854 HB ILE 108 HB ILE 108 119.025 1.246 -6.688 855 HG12 ILE 108 HG12 ILE 108 116.666 1.483 -4.829 856 HG13 ILE 108 HG13 ILE 108 118.282 2.217 -4.705 857 HG21 ILE 108 HG21 ILE 108 117.300 0.353 -8.403 858 HG22 ILE 108 HG22 ILE 108 116.102 1.304 -7.493 859 HG23 ILE 108 HG23 ILE 108 117.482 2.119 -8.267 860 HD11 ILE 108 HD11 ILE 108 116.863 4.037 -5.247 861 HD12 ILE 108 HD12 ILE 108 117.599 3.587 -6.804 862 HD13 ILE 108 HD13 ILE 108 115.936 3.076 -6.424 863 H ILE 109 H ILE 109 117.750 -2.902 -6.368 864 HA ILE 109 HA ILE 109 120.571 -3.355 -6.833 865 HB ILE 109 HB ILE 109 118.111 -4.995 -7.575 866 HG12 ILE 109 HG12 ILE 109 118.851 -4.427 -5.100 867 HG13 ILE 109 HG13 ILE 109 118.403 -6.094 -5.530 868 HG21 ILE 109 HG21 ILE 109 119.792 -5.819 -9.020 869 HG22 ILE 109 HG22 ILE 109 119.930 -6.869 -7.590 870 HG23 ILE 109 HG23 ILE 109 121.084 -5.535 -7.829 871 HD11 ILE 109 HD11 ILE 109 120.619 -5.712 -4.198 872 HD12 ILE 109 HD12 ILE 109 120.657 -6.811 -5.598 873 HD13 ILE 109 HD13 ILE 109 121.277 -5.149 -5.753 874 H GLY 110 H GLY 110 121.299 -1.902 -8.402 875 HA2 GLY 110 HA2 GLY 110 121.733 -1.166 -10.602 876 HA3 GLY 110 HA3 GLY 110 121.279 -2.810 -11.107 877 H ASP 111 H ASP 111 118.943 -3.234 -11.479 878 HA ASP 111 HA ASP 111 117.445 -0.685 -12.114 879 HB2 ASP 111 HB2 ASP 111 118.085 -3.048 -13.855 880 HB3 ASP 111 HB3 ASP 111 116.495 -2.272 -14.052 881 H GLU 112 H GLU 112 117.297 -2.580 -9.807 882 HA GLU 112 HA GLU 112 114.377 -3.269 -10.154 883 HB2 GLU 112 HB3 GLU 112 116.656 -5.005 -9.216 884 HB3 GLU 112 HB2 GLU 112 115.060 -5.209 -8.455 885 HG2 GLU 112 HG2 GLU 112 114.055 -5.444 -10.748 886 HG3 GLU 112 HG3 GLU 112 115.698 -5.387 -11.432 887 H LEU 113 H LEU 113 113.126 -2.434 -8.486 888 HA LEU 113 HA LEU 113 114.654 -1.156 -6.231 889 HB2 LEU 113 HB3 LEU 113 112.622 -0.147 -7.709 890 HB3 LEU 113 HB2 LEU 113 111.671 -0.932 -6.426 891 HG LEU 113 HG LEU 113 114.043 0.726 -5.605 892 HD11 LEU 113 HD11 LEU 113 111.346 2.008 -6.153 893 HD12 LEU 113 HD12 LEU 113 112.619 1.973 -7.397 894 HD13 LEU 113 HD13 LEU 113 112.912 2.798 -5.847 895 HD21 LEU 113 HD21 LEU 113 112.686 -0.534 -3.955 896 HD22 LEU 113 HD22 LEU 113 111.223 0.313 -4.511 897 HD23 LEU 113 HD23 LEU 113 112.525 1.221 -3.706 898 H VAL 114 H VAL 114 114.987 -2.479 -4.507 899 HA VAL 114 HA VAL 114 112.890 -4.574 -3.981 900 HB VAL 114 HB VAL 114 115.640 -4.296 -2.701 901 HG11 VAL 114 HG11 VAL 114 113.992 -5.704 -1.494 902 HG12 VAL 114 HG12 VAL 114 115.287 -6.699 -2.203 903 HG13 VAL 114 HG13 VAL 114 113.690 -6.627 -2.986 904 HG21 VAL 114 HG21 VAL 114 115.845 -4.517 -5.164 905 HG22 VAL 114 HG22 VAL 114 116.367 -6.007 -4.343 906 HG23 VAL 114 HG23 VAL 114 114.770 -5.935 -5.126 907 H GLN 115 H GLN 115 111.316 -3.774 -2.694 908 HA GLN 115 HA GLN 115 112.175 -2.083 -0.341 909 HB2 GLN 115 HB2 GLN 115 109.692 -2.252 -2.028 910 HB3 GLN 115 HB3 GLN 115 109.489 -1.860 -0.303 911 HG2 GLN 115 HG2 GLN 115 110.774 0.113 -0.474 912 HG3 GLN 115 HG3 GLN 115 111.558 -0.415 -1.982 913 HE21 GLN 115 HE21 GLN 115 110.717 1.896 -2.622 914 HE22 GLN 115 HE22 GLN 115 109.102 1.959 -3.293 915 H THR 116 H THR 116 112.584 -3.478 1.340 916 HA THR 116 HA THR 116 110.719 -5.828 1.636 917 HB THR 116 HB THR 116 113.139 -5.465 3.378 918 HG1 THR 116 HG1 THR 116 114.038 -5.009 1.399 919 HG21 THR 116 HG21 THR 116 113.237 -7.920 3.079 920 HG22 THR 116 HG22 THR 116 111.891 -7.835 1.918 921 HG23 THR 116 HG23 THR 116 111.621 -7.410 3.625 922 H TYR 117 H TYR 117 109.593 -6.183 3.542 923 HA TYR 117 HA TYR 117 109.705 -3.906 5.533 924 HB2 TYR 117 HB2 TYR 117 107.194 -5.516 4.992 925 HB3 TYR 117 HB3 TYR 117 107.354 -3.947 5.816 926 HD1 TYR 117 HD1 TYR 117 108.193 -5.535 2.555 927 HD2 TYR 117 HD2 TYR 117 106.780 -2.046 4.597 928 HE1 TYR 117 HE1 TYR 117 107.835 -4.411 0.374 929 HE2 TYR 117 HE2 TYR 117 106.418 -0.908 2.423 930 HH TYR 117 HH TYR 117 107.653 -1.394 -0.156 931 H VAL 118 H VAL 118 109.217 -4.465 7.671 932 HA VAL 118 HA VAL 118 109.422 -7.425 8.272 933 HB VAL 118 HB VAL 118 110.505 -5.215 10.053 934 HG11 VAL 118 HG11 VAL 118 111.344 -6.936 11.364 935 HG12 VAL 118 HG12 VAL 118 111.469 -8.063 9.993 936 HG13 VAL 118 HG13 VAL 118 109.882 -7.727 10.727 937 HG21 VAL 118 HG21 VAL 118 112.491 -6.889 8.675 938 HG22 VAL 118 HG22 VAL 118 112.453 -5.125 8.903 939 HG23 VAL 118 HG23 VAL 118 111.556 -5.868 7.557 940 H TYR 119 H TYR 119 108.172 -8.121 10.022 941 HA TYR 119 HA TYR 119 106.483 -6.035 11.340 942 HB2 TYR 119 HB2 TYR 119 105.510 -7.265 9.104 943 HB3 TYR 119 HB3 TYR 119 104.949 -8.384 10.369 944 HD1 TYR 119 HD1 TYR 119 103.654 -7.475 12.317 945 HD2 TYR 119 HD2 TYR 119 104.505 -5.117 8.836 946 HE1 TYR 119 HE1 TYR 119 101.838 -5.904 12.941 947 HE2 TYR 119 HE2 TYR 119 102.700 -3.534 9.463 948 HH TYR 119 HH TYR 119 100.533 -4.177 12.187 949 H GLU 120 H GLU 120 106.879 -6.424 13.394 950 HA GLU 120 HA GLU 120 107.207 -7.587 15.413 951 HB2 GLU 120 HB2 GLU 120 104.903 -8.993 14.061 952 HB3 GLU 120 HB3 GLU 120 105.511 -9.583 15.626 953 HG2 GLU 120 HG2 GLU 120 104.791 -6.666 15.137 954 HG3 GLU 120 HG3 GLU 120 103.614 -7.858 15.741 955 H GLY 121 H GLY 121 108.674 -8.587 12.880 956 HA2 GLY 121 HA2 GLY 121 110.607 -10.135 13.273 957 HA3 GLY 121 HA3 GLY 121 109.491 -11.211 14.148 958 H VAL 122 H VAL 122 108.511 -9.542 11.230 959 HA VAL 122 HA VAL 122 108.742 -12.164 9.754 960 HB VAL 122 HB VAL 122 106.359 -11.093 10.478 961 HG11 VAL 122 HG11 VAL 122 106.713 -10.034 7.663 962 HG12 VAL 122 HG12 VAL 122 107.067 -9.011 9.076 963 HG13 VAL 122 HG13 VAL 122 105.430 -9.670 8.842 964 HG21 VAL 122 HG21 VAL 122 105.401 -12.350 8.571 965 HG22 VAL 122 HG22 VAL 122 107.005 -12.392 7.799 966 HG23 VAL 122 HG23 VAL 122 106.734 -13.248 9.336 967 H GLU 123 H GLU 123 108.456 -11.561 7.266 968 HA GLU 123 HA GLU 123 109.653 -8.906 6.700 969 HB2 GLU 123 HB3 GLU 123 111.266 -11.378 6.859 970 HB3 GLU 123 HB2 GLU 123 111.461 -10.490 5.329 971 HG2 GLU 123 HG2 GLU 123 111.847 -8.389 6.680 972 HG3 GLU 123 HG3 GLU 123 111.833 -9.392 8.151 973 H ALA 124 H ALA 124 108.778 -8.188 4.858 974 HA ALA 124 HA ALA 124 107.919 -10.252 2.814 975 HB1 ALA 124 HB1 ALA 124 106.659 -7.740 2.302 976 HB2 ALA 124 HB2 ALA 124 106.491 -8.051 4.046 977 HB3 ALA 124 HB3 ALA 124 105.893 -9.243 2.868 978 H LYS 125 H LYS 125 108.419 -9.731 0.576 979 HA LYS 125 HA LYS 125 110.348 -7.415 0.324 980 HB2 LYS 125 HB2 LYS 125 111.450 -9.727 0.438 981 HB3 LYS 125 HB3 LYS 125 110.677 -10.064 -1.128 982 HG2 LYS 125 HG3 LYS 125 111.999 -8.534 -2.267 983 HG3 LYS 125 HG2 LYS 125 112.200 -7.487 -0.842 984 HD2 LYS 125 HD2 LYS 125 114.335 -8.521 -1.211 985 HD3 LYS 125 HD3 LYS 125 113.612 -9.369 0.176 986 HE2 LYS 125 HE3 LYS 125 114.216 -11.218 -1.065 987 HE3 LYS 125 HE2 LYS 125 112.633 -10.911 -1.819 988 HZ1 LYS 125 HZ1 LYS 125 114.370 -11.155 -3.464 989 HZ2 LYS 125 HZ2 LYS 125 113.760 -9.623 -3.507 990 HZ3 LYS 125 HZ3 LYS 125 115.227 -9.907 -2.809 991 H ARG 126 H ARG 126 110.144 -6.183 -1.477 992 HA ARG 126 HA ARG 126 108.256 -7.169 -3.622 993 HB2 ARG 126 HB3 ARG 126 107.719 -5.101 -1.750 994 HB3 ARG 126 HB2 ARG 126 108.114 -4.281 -3.279 995 HG2 ARG 126 HG2 ARG 126 106.466 -5.724 -4.463 996 HG3 ARG 126 HG3 ARG 126 106.051 -6.502 -2.916 997 HD2 ARG 126 HD2 ARG 126 105.900 -3.490 -3.245 998 HD3 ARG 126 HD3 ARG 126 104.548 -4.538 -3.739 999 HE ARG 126 HE ARG 126 105.034 -5.430 -1.172 1000 HH11 ARG 126 HH11 ARG 126 104.175 -4.463 0.681 1001 HH12 ARG 126 HH12 ARG 126 103.747 -2.767 0.665 1002 HH21 ARG 126 HH21 ARG 126 104.719 -2.290 -2.645 1003 HH22 ARG 126 HH22 ARG 126 104.054 -1.542 -1.210 1004 H ILE 127 H ILE 127 109.459 -7.268 -5.464 1005 HA ILE 127 HA ILE 127 111.729 -5.295 -5.741 1006 HB ILE 127 HB ILE 127 111.225 -7.786 -7.411 1007 HG12 ILE 127 HG12 ILE 127 113.224 -7.677 -5.151 1008 HG13 ILE 127 HG13 ILE 127 111.520 -8.043 -4.785 1009 HG21 ILE 127 HG21 ILE 127 113.653 -7.561 -7.859 1010 HG22 ILE 127 HG22 ILE 127 113.707 -6.111 -6.828 1011 HG23 ILE 127 HG23 ILE 127 112.772 -6.092 -8.343 1012 HD11 ILE 127 HD11 ILE 127 112.809 -10.122 -5.194 1013 HD12 ILE 127 HD12 ILE 127 111.561 -9.888 -6.441 1014 HD13 ILE 127 HD13 ILE 127 113.264 -9.523 -6.807 1015 H PHE 128 H PHE 128 111.465 -3.630 -7.118 1016 HA PHE 128 HA PHE 128 109.232 -3.822 -9.136 1017 HB2 PHE 128 HB2 PHE 128 110.827 -1.352 -8.339 1018 HB3 PHE 128 HB3 PHE 128 109.296 -1.405 -9.238 1019 HD1 PHE 128 HD1 PHE 128 108.398 -3.811 -7.273 1020 HD2 PHE 128 HD2 PHE 128 109.680 0.245 -6.762 1021 HE1 PHE 128 HE1 PHE 128 107.115 -3.679 -5.158 1022 HE2 PHE 128 HE2 PHE 128 108.408 0.383 -4.636 1023 HZ PHE 128 HZ PHE 128 107.121 -1.581 -3.834 1024 H LYS 129 H LYS 129 109.759 -2.374 -11.151 1025 HA LYS 129 HA LYS 129 112.586 -2.544 -12.051 1026 HB2 LYS 129 HB2 LYS 129 111.622 -4.833 -12.508 1027 HB3 LYS 129 HB3 LYS 129 110.398 -4.059 -13.542 1028 HG2 LYS 129 HG2 LYS 129 111.972 -3.420 -15.155 1029 HG3 LYS 129 HG3 LYS 129 113.325 -3.465 -13.998 1030 HD2 LYS 129 HD2 LYS 129 113.499 -5.804 -14.093 1031 HD3 LYS 129 HD3 LYS 129 111.823 -6.006 -14.655 1032 HE2 LYS 129 HE3 LYS 129 112.408 -5.064 -16.844 1033 HE3 LYS 129 HE2 LYS 129 114.067 -4.738 -16.287 1034 HZ1 LYS 129 HZ1 LYS 129 113.932 -6.794 -17.527 1035 HZ2 LYS 129 HZ2 LYS 129 114.353 -7.102 -15.963 1036 HZ3 LYS 129 HZ3 LYS 129 112.816 -7.405 -16.478 1037 H LYS 130 H LYS 130 112.709 -1.609 -14.364 1038 HA LYS 130 HA LYS 130 111.509 0.954 -14.453 1039 HB2 LYS 130 HB3 LYS 130 111.875 0.656 -17.050 1040 HB3 LYS 130 HB2 LYS 130 113.283 0.661 -15.962 1041 HG2 LYS 130 HG2 LYS 130 113.343 -1.778 -15.947 1042 HG3 LYS 130 HG3 LYS 130 111.835 -1.859 -16.889 1043 HD2 LYS 130 HD2 LYS 130 113.737 -2.200 -18.393 1044 HD3 LYS 130 HD3 LYS 130 112.989 -0.625 -18.749 1045 HE2 LYS 130 HE3 LYS 130 114.751 0.580 -17.793 1046 HE3 LYS 130 HE2 LYS 130 115.239 -0.771 -16.741 1047 HZ1 LYS 130 HZ1 LYS 130 116.770 -0.470 -18.571 1048 HZ2 LYS 130 HZ2 LYS 130 115.562 -0.678 -19.674 1049 HZ3 LYS 130 HZ3 LYS 130 116.014 -1.930 -18.700 1050 H ASP 131 H ASP 131 109.571 1.781 -15.210 1051 HA ASP 131 HA ASP 131 107.218 0.268 -15.204 1052 HB2 ASP 131 HB3 ASP 131 107.028 2.651 -15.320 1053 HB3 ASP 131 HB2 ASP 131 107.956 2.725 -16.837 Start of MODEL 4 1 H1 ALA 1 H1 ALA 1 118.062 7.951 -9.045 2 H2 ALA 1 H2 ALA 1 118.964 8.489 -7.773 3 H3 ALA 1 H3 ALA 1 117.385 8.945 -7.917 4 HA ALA 1 HA ALA 1 118.336 6.193 -7.427 5 HB1 ALA 1 HB1 ALA 1 117.294 6.503 -5.199 6 HB2 ALA 1 HB2 ALA 1 118.591 7.691 -5.468 7 HB3 ALA 1 HB3 ALA 1 116.888 8.183 -5.623 8 H PHE 2 H PHE 2 116.988 4.986 -8.709 9 HA PHE 2 HA PHE 2 114.953 4.317 -9.750 10 HB2 PHE 2 HB2 PHE 2 114.845 4.005 -6.999 11 HB3 PHE 2 HB3 PHE 2 113.355 4.920 -7.330 12 HD1 PHE 2 HD1 PHE 2 115.294 2.168 -9.038 13 HD2 PHE 2 HD2 PHE 2 111.488 3.595 -7.648 14 HE1 PHE 2 HE1 PHE 2 114.204 0.113 -9.905 15 HE2 PHE 2 HE2 PHE 2 110.404 1.541 -8.511 16 HZ PHE 2 HZ PHE 2 111.761 -0.198 -9.640 17 H ASP 3 H ASP 3 115.599 7.170 -10.015 18 HA ASP 3 HA ASP 3 113.089 8.659 -9.603 19 HB2 ASP 3 HB2 ASP 3 115.293 9.795 -9.616 20 HB3 ASP 3 HB3 ASP 3 115.536 9.305 -11.310 21 H SER 4 H SER 4 111.423 7.594 -10.723 22 HA SER 4 HA SER 4 110.823 8.294 -13.349 23 HB2 SER 4 HB3 SER 4 112.799 6.043 -13.248 24 HB3 SER 4 HB2 SER 4 111.459 5.893 -14.411 25 HG SER 4 HG SER 4 112.407 7.364 -15.594 26 H THR 5 H THR 5 109.693 5.970 -14.459 27 HA THR 5 HA THR 5 107.628 5.392 -12.357 28 HB THR 5 HB THR 5 107.687 4.922 -15.370 29 HG1 THR 5 HG1 THR 5 106.050 6.561 -15.260 30 HG21 THR 5 HG21 THR 5 105.174 4.463 -14.913 31 HG22 THR 5 HG22 THR 5 106.330 3.173 -14.502 32 HG23 THR 5 HG23 THR 5 105.663 4.213 -13.220 33 H TRP 6 H TRP 6 107.142 3.296 -11.686 34 HA TRP 6 HA TRP 6 108.661 1.021 -12.897 35 HB2 TRP 6 HB2 TRP 6 108.820 1.481 -9.906 36 HB3 TRP 6 HB3 TRP 6 109.801 0.395 -10.918 37 HD1 TRP 6 HD1 TRP 6 109.172 4.202 -10.505 38 HE1 TRP 6 HE1 TRP 6 111.372 5.460 -10.984 39 HE3 TRP 6 HE3 TRP 6 112.094 0.242 -11.845 40 HZ2 TRP 6 HZ2 TRP 6 114.050 4.807 -11.847 41 HZ3 TRP 6 HZ3 TRP 6 114.459 0.579 -12.486 42 HH2 TRP 6 HH2 TRP 6 115.444 2.855 -12.489 43 H LYS 7 H LYS 7 107.947 -1.094 -11.763 44 HA LYS 7 HA LYS 7 105.334 -0.855 -10.354 45 HB2 LYS 7 HB2 LYS 7 103.992 -1.894 -11.981 46 HB3 LYS 7 HB3 LYS 7 105.003 -0.804 -12.959 47 HG2 LYS 7 HG2 LYS 7 106.613 -2.757 -13.272 48 HG3 LYS 7 HG3 LYS 7 105.375 -3.797 -12.527 49 HD2 LYS 7 HD3 LYS 7 104.606 -1.983 -14.816 50 HD3 LYS 7 HD2 LYS 7 105.451 -3.511 -15.158 51 HE2 LYS 7 HE2 LYS 7 102.960 -3.335 -13.415 52 HE3 LYS 7 HE3 LYS 7 102.906 -3.659 -15.164 53 HZ1 LYS 7 HZ1 LYS 7 102.938 -5.694 -13.882 54 HZ2 LYS 7 HZ2 LYS 7 104.362 -5.272 -13.166 55 HZ3 LYS 7 HZ3 LYS 7 104.312 -5.573 -14.787 56 H VAL 8 H VAL 8 105.083 -2.531 -8.943 57 HA VAL 8 HA VAL 8 107.095 -4.240 -8.154 58 HB VAL 8 HB VAL 8 105.219 -4.425 -6.803 59 HG11 VAL 8 HG11 VAL 8 102.916 -4.981 -7.864 60 HG12 VAL 8 HG12 VAL 8 103.572 -3.347 -8.121 61 HG13 VAL 8 HG13 VAL 8 103.685 -4.564 -9.415 62 HG21 VAL 8 HG21 VAL 8 106.080 -6.720 -7.387 63 HG22 VAL 8 HG22 VAL 8 104.818 -6.827 -8.638 64 HG23 VAL 8 HG23 VAL 8 104.361 -6.705 -6.922 65 H ASP 9 H ASP 9 108.420 -5.312 -9.506 66 HA ASP 9 HA ASP 9 107.196 -6.893 -11.752 67 HB2 ASP 9 HB2 ASP 9 109.134 -5.419 -12.279 68 HB3 ASP 9 HB3 ASP 9 110.117 -6.297 -11.082 69 H ARG 10 H ARG 10 108.950 -7.152 -8.701 70 HA ARG 10 HA ARG 10 108.276 -10.070 -8.697 71 HB2 ARG 10 HB2 ARG 10 111.021 -9.438 -7.719 72 HB3 ARG 10 HB3 ARG 10 110.423 -10.865 -8.598 73 HG2 ARG 10 HG2 ARG 10 110.325 -9.523 -10.690 74 HG3 ARG 10 HG3 ARG 10 110.951 -8.111 -9.805 75 HD2 ARG 10 HD2 ARG 10 113.018 -9.339 -9.266 76 HD3 ARG 10 HD3 ARG 10 112.389 -10.789 -10.085 77 HE ARG 10 HE ARG 10 112.444 -8.401 -11.823 78 HH11 ARG 10 HH11 ARG 10 113.924 -8.519 -13.526 79 HH12 ARG 10 HH12 ARG 10 115.177 -9.740 -13.514 80 HH21 ARG 10 HH21 ARG 10 114.166 -11.111 -10.476 81 HH22 ARG 10 HH22 ARG 10 115.313 -11.201 -11.794 82 H SER 11 H SER 11 108.608 -11.012 -6.463 83 HA SER 11 HA SER 11 108.982 -9.151 -4.218 84 HB2 SER 11 HB3 SER 11 106.803 -8.339 -4.553 85 HB3 SER 11 HB2 SER 11 106.201 -9.910 -5.135 86 HG SER 11 HG SER 11 105.610 -9.292 -2.899 87 H GLU 12 H GLU 12 108.106 -10.401 -2.095 88 HA GLU 12 HA GLU 12 108.158 -13.347 -2.446 89 HB2 GLU 12 HB2 GLU 12 110.373 -13.630 -2.139 90 HB3 GLU 12 HB3 GLU 12 110.600 -11.874 -1.977 91 HG2 GLU 12 HG2 GLU 12 110.048 -12.009 0.427 92 HG3 GLU 12 HG3 GLU 12 109.762 -13.759 0.275 93 H ASN 13 H ASN 13 107.662 -14.476 -0.464 94 HA ASN 13 HA ASN 13 106.473 -14.699 1.558 95 HB2 ASN 13 HB3 ASN 13 108.180 -12.255 2.000 96 HB3 ASN 13 HB2 ASN 13 106.939 -12.666 3.208 97 HD21 ASN 13 HD21 ASN 13 108.602 -13.272 4.794 98 HD22 ASN 13 HD22 ASN 13 109.500 -14.762 4.612 99 H TYR 14 H TYR 14 106.100 -11.408 2.377 100 HA TYR 14 HA TYR 14 104.275 -9.928 2.162 101 HB2 TYR 14 HB2 TYR 14 104.485 -10.916 -0.349 102 HB3 TYR 14 HB3 TYR 14 102.890 -11.575 0.085 103 HD1 TYR 14 HD1 TYR 14 104.538 -8.380 1.154 104 HD2 TYR 14 HD2 TYR 14 101.334 -10.216 -1.041 105 HE1 TYR 14 HE1 TYR 14 103.514 -6.152 0.784 106 HE2 TYR 14 HE2 TYR 14 100.310 -7.989 -1.412 107 HH TYR 14 HH TYR 14 100.558 -5.558 0.087 108 H ASP 15 H ASP 15 103.209 -13.347 1.679 109 HA ASP 15 HA ASP 15 100.680 -12.971 2.999 110 HB2 ASP 15 HB2 ASP 15 101.594 -15.025 1.663 111 HB3 ASP 15 HB3 ASP 15 102.267 -15.542 3.227 112 H LYS 16 H LYS 16 103.822 -14.130 4.308 113 HA LYS 16 HA LYS 16 102.908 -14.334 7.030 114 HB2 LYS 16 HB2 LYS 16 105.700 -13.464 6.180 115 HB3 LYS 16 HB3 LYS 16 105.233 -14.352 7.650 116 HG2 LYS 16 HG2 LYS 16 104.576 -16.297 6.320 117 HG3 LYS 16 HG3 LYS 16 104.879 -15.408 4.809 118 HD2 LYS 16 HD3 LYS 16 106.900 -16.528 4.993 119 HD3 LYS 16 HD2 LYS 16 107.294 -15.072 5.937 120 HE2 LYS 16 HE2 LYS 16 106.194 -17.649 7.141 121 HE3 LYS 16 HE3 LYS 16 107.922 -17.226 7.092 122 HZ1 LYS 16 HZ1 LYS 16 107.253 -16.424 9.118 123 HZ2 LYS 16 HZ2 LYS 16 105.761 -15.951 8.597 124 HZ3 LYS 16 HZ3 LYS 16 107.095 -15.070 8.188 125 H PHE 17 H PHE 17 104.004 -11.603 5.067 126 HA PHE 17 HA PHE 17 104.162 -9.717 7.297 127 HB2 PHE 17 HB2 PHE 17 105.275 -9.347 5.113 128 HB3 PHE 17 HB3 PHE 17 103.687 -9.284 4.313 129 HD1 PHE 17 HD1 PHE 17 106.020 -7.569 6.561 130 HD2 PHE 17 HD2 PHE 17 102.205 -7.351 4.618 131 HE1 PHE 17 HE1 PHE 17 105.896 -5.151 7.089 132 HE2 PHE 17 HE2 PHE 17 102.070 -4.931 5.149 133 HZ PHE 17 HZ PHE 17 103.920 -3.828 6.382 134 H MET 18 H MET 18 101.832 -9.943 4.594 135 HA MET 18 HA MET 18 99.839 -8.267 5.745 136 HB2 MET 18 HB2 MET 18 99.703 -10.610 3.821 137 HB3 MET 18 HB3 MET 18 98.229 -9.754 4.332 138 HG2 MET 18 HG2 MET 18 100.615 -8.191 3.325 139 HG3 MET 18 HG3 MET 18 99.498 -8.954 2.168 140 HE1 MET 18 HE1 MET 18 100.427 -6.280 4.382 141 HE2 MET 18 HE2 MET 18 100.084 -5.575 2.784 142 HE3 MET 18 HE3 MET 18 99.154 -5.049 4.208 143 H GLU 19 H GLU 19 100.721 -11.587 6.512 144 HA GLU 19 HA GLU 19 98.191 -12.148 7.923 145 HB2 GLU 19 HB2 GLU 19 99.626 -13.953 6.972 146 HB3 GLU 19 HB3 GLU 19 100.904 -13.526 8.135 147 HG2 GLU 19 HG2 GLU 19 99.480 -14.106 10.013 148 HG3 GLU 19 HG3 GLU 19 98.075 -14.324 8.942 149 H LYS 20 H LYS 20 101.420 -10.934 8.775 150 HA LYS 20 HA LYS 20 101.022 -11.103 11.649 151 HB2 LYS 20 HB3 LYS 20 102.814 -9.364 9.909 152 HB3 LYS 20 HB2 LYS 20 102.860 -9.335 11.689 153 HG2 LYS 20 HG2 LYS 20 103.007 -11.995 10.279 154 HG3 LYS 20 HG3 LYS 20 104.459 -10.966 10.316 155 HD2 LYS 20 HD2 LYS 20 104.296 -10.824 12.784 156 HD3 LYS 20 HD3 LYS 20 102.842 -11.850 12.748 157 HE2 LYS 20 HE3 LYS 20 105.353 -12.838 11.402 158 HE3 LYS 20 HE2 LYS 20 105.242 -12.918 13.177 159 HZ1 LYS 20 HZ1 LYS 20 104.393 -14.916 12.141 160 HZ2 LYS 20 HZ2 LYS 20 103.178 -14.126 12.928 161 HZ3 LYS 20 HZ3 LYS 20 103.280 -14.051 11.284 162 H MET 21 H MET 21 100.380 -8.543 9.229 163 HA MET 21 HA MET 21 99.540 -6.593 11.227 164 HB2 MET 21 HB2 MET 21 99.222 -6.897 8.240 165 HB3 MET 21 HB3 MET 21 98.262 -5.670 9.101 166 HG2 MET 21 HG3 MET 21 100.130 -4.429 9.703 167 HG3 MET 21 HG2 MET 21 101.202 -5.850 9.708 168 HE1 MET 21 HE1 MET 21 99.408 -3.844 5.995 169 HE2 MET 21 HE2 MET 21 98.762 -5.410 6.541 170 HE3 MET 21 HE3 MET 21 98.719 -4.001 7.629 171 H GLY 22 H GLY 22 98.191 -9.531 10.280 172 HA2 GLY 22 HA2 GLY 22 96.119 -10.488 10.926 173 HA3 GLY 22 HA3 GLY 22 95.747 -8.987 11.805 174 H VAL 23 H VAL 23 96.587 -9.094 8.358 175 HA VAL 23 HA VAL 23 94.110 -7.646 7.712 176 HB VAL 23 HB VAL 23 95.954 -9.011 5.719 177 HG11 VAL 23 HG11 VAL 23 93.871 -7.964 4.873 178 HG12 VAL 23 HG12 VAL 23 94.315 -6.437 5.671 179 HG13 VAL 23 HG13 VAL 23 95.306 -7.061 4.331 180 HG21 VAL 23 HG21 VAL 23 97.078 -6.624 5.806 181 HG22 VAL 23 HG22 VAL 23 96.403 -6.574 7.452 182 HG23 VAL 23 HG23 VAL 23 97.549 -7.859 6.999 183 H ASN 24 H ASN 24 92.171 -8.508 7.124 184 HA ASN 24 HA ASN 24 91.429 -11.174 7.471 185 HB2 ASN 24 HB3 ASN 24 90.083 -9.005 6.651 186 HB3 ASN 24 HB2 ASN 24 90.287 -9.781 5.062 187 HD21 ASN 24 HD21 ASN 24 89.911 -12.412 5.367 188 HD22 ASN 24 HD22 ASN 24 88.406 -12.781 6.178 189 H ILE 25 H ILE 25 90.920 -12.891 5.815 190 HA ILE 25 HA ILE 25 93.329 -13.317 4.146 191 HB ILE 25 HB ILE 25 90.901 -14.920 4.924 192 HG12 ILE 25 HG12 ILE 25 93.239 -14.779 6.102 193 HG13 ILE 25 HG13 ILE 25 92.496 -16.377 5.858 194 HG21 ILE 25 HG21 ILE 25 91.719 -16.720 3.326 195 HG22 ILE 25 HG22 ILE 25 92.722 -15.474 2.546 196 HG23 ILE 25 HG23 ILE 25 90.949 -15.320 2.541 197 HD11 ILE 25 HD11 ILE 25 95.011 -16.036 5.193 198 HD12 ILE 25 HD12 ILE 25 94.347 -15.210 3.763 199 HD13 ILE 25 HD13 ILE 25 93.941 -16.915 4.074 200 H VAL 26 H VAL 26 90.569 -11.599 3.767 201 HA VAL 26 HA VAL 26 90.011 -12.307 0.942 202 HB VAL 26 HB VAL 26 89.086 -9.877 2.536 203 HG11 VAL 26 HG11 VAL 26 88.788 -9.738 0.078 204 HG12 VAL 26 HG12 VAL 26 87.221 -9.910 0.903 205 HG13 VAL 26 HG13 VAL 26 87.957 -11.312 0.090 206 HG21 VAL 26 HG21 VAL 26 88.515 -11.988 3.707 207 HG22 VAL 26 HG22 VAL 26 87.061 -11.223 3.021 208 HG23 VAL 26 HG23 VAL 26 87.798 -12.625 2.207 209 H LYS 27 H LYS 27 91.115 -9.298 2.588 210 HA LYS 27 HA LYS 27 91.990 -7.994 0.193 211 HB2 LYS 27 HB3 LYS 27 93.090 -7.815 3.036 212 HB3 LYS 27 HB2 LYS 27 93.497 -6.683 1.724 213 HG2 LYS 27 HG2 LYS 27 90.851 -6.503 1.501 214 HG3 LYS 27 HG3 LYS 27 90.891 -7.055 3.193 215 HD2 LYS 27 HD2 LYS 27 91.066 -4.773 3.546 216 HD3 LYS 27 HD3 LYS 27 92.792 -5.163 3.362 217 HE2 LYS 27 HE2 LYS 27 90.903 -3.883 1.374 218 HE3 LYS 27 HE3 LYS 27 92.525 -3.354 1.882 219 HZ1 LYS 27 HZ1 LYS 27 92.570 -4.340 -0.304 220 HZ2 LYS 27 HZ2 LYS 27 91.923 -5.747 0.262 221 HZ3 LYS 27 HZ3 LYS 27 93.428 -5.277 0.747 222 H ARG 28 H ARG 28 93.615 -10.305 2.354 223 HA ARG 28 HA ARG 28 96.224 -10.162 1.137 224 HB2 ARG 28 HB2 ARG 28 96.145 -11.335 3.176 225 HB3 ARG 28 HB3 ARG 28 94.705 -12.264 2.700 226 HG2 ARG 28 HG3 ARG 28 96.759 -13.672 2.692 227 HG3 ARG 28 HG2 ARG 28 96.044 -13.540 1.068 228 HD2 ARG 28 HD3 ARG 28 97.665 -11.755 0.497 229 HD3 ARG 28 HD2 ARG 28 98.379 -11.882 2.122 230 HE ARG 28 HE ARG 28 98.509 -14.500 1.115 231 HH11 ARG 28 HH11 ARG 28 100.304 -15.236 -0.041 232 HH12 ARG 28 HH12 ARG 28 101.345 -14.094 -0.861 233 HH21 ARG 28 HH21 ARG 28 99.496 -11.312 0.123 234 HH22 ARG 28 HH22 ARG 28 100.889 -11.882 -0.769 235 H LYS 29 H LYS 29 93.496 -12.446 0.523 236 HA LYS 29 HA LYS 29 94.674 -13.900 -1.596 237 HB2 LYS 29 HB2 LYS 29 92.229 -13.926 -0.477 238 HB3 LYS 29 HB3 LYS 29 91.827 -13.009 -1.949 239 HG2 LYS 29 HG2 LYS 29 93.254 -15.706 -1.885 240 HG3 LYS 29 HG3 LYS 29 91.536 -15.460 -2.281 241 HD2 LYS 29 HD3 LYS 29 92.501 -13.742 -4.052 242 HD3 LYS 29 HD2 LYS 29 93.993 -14.693 -3.861 243 HE2 LYS 29 HE2 LYS 29 92.337 -16.752 -4.154 244 HE3 LYS 29 HE3 LYS 29 91.312 -15.536 -4.954 245 HZ1 LYS 29 HZ1 LYS 29 92.790 -16.618 -6.513 246 HZ2 LYS 29 HZ2 LYS 29 93.166 -15.016 -6.395 247 HZ3 LYS 29 HZ3 LYS 29 94.116 -16.143 -5.654 248 H LEU 30 H LEU 30 93.162 -10.675 -1.667 249 HA LEU 30 HA LEU 30 93.632 -10.479 -4.599 250 HB2 LEU 30 HB2 LEU 30 92.712 -8.297 -2.687 251 HB3 LEU 30 HB3 LEU 30 92.534 -8.332 -4.457 252 HG LEU 30 HG LEU 30 91.232 -10.251 -2.473 253 HD11 LEU 30 HD11 LEU 30 90.206 -7.994 -2.545 254 HD12 LEU 30 HD12 LEU 30 89.133 -9.209 -3.280 255 HD13 LEU 30 HD13 LEU 30 90.076 -8.110 -4.316 256 HD21 LEU 30 HD21 LEU 30 89.985 -10.774 -4.785 257 HD22 LEU 30 HD22 LEU 30 91.534 -10.225 -5.467 258 HD23 LEU 30 HD23 LEU 30 91.496 -11.605 -4.343 259 H ALA 31 H ALA 31 95.328 -9.955 -1.746 260 HA ALA 31 HA ALA 31 96.977 -7.701 -2.703 261 HB1 ALA 31 HB1 ALA 31 98.189 -7.952 -0.662 262 HB2 ALA 31 HB2 ALA 31 96.504 -8.350 -0.250 263 HB3 ALA 31 HB3 ALA 31 97.693 -9.653 -0.487 264 H ALA 32 H ALA 32 97.486 -11.235 -2.247 265 HA ALA 32 HA ALA 32 100.134 -11.512 -3.049 266 HB1 ALA 32 HB1 ALA 32 99.503 -13.681 -4.071 267 HB2 ALA 32 HB2 ALA 32 98.647 -13.426 -2.532 268 HB3 ALA 32 HB3 ALA 32 97.795 -13.182 -4.076 269 H HIS 33 H HIS 33 97.504 -10.278 -4.973 270 HA HIS 33 HA HIS 33 98.791 -10.752 -7.571 271 HB2 HIS 33 HB2 HIS 33 96.340 -10.359 -7.319 272 HB3 HIS 33 HB3 HIS 33 96.678 -8.698 -6.776 273 HD2 HIS 33 HD2 HIS 33 97.551 -10.812 -10.068 274 HE1 HIS 33 HE1 HIS 33 96.956 -6.763 -11.111 275 HE2 HIS 33 HE2 HIS 33 97.462 -9.086 -12.044 276 H ASP 34 H ASP 34 100.551 -9.573 -5.563 277 HA ASP 34 HA ASP 34 100.949 -6.807 -5.654 278 HB2 ASP 34 HB2 ASP 34 103.336 -8.560 -6.207 279 HB3 ASP 34 HB3 ASP 34 103.159 -7.220 -5.048 280 H ASN 35 H ASN 35 100.160 -5.954 -7.657 281 HA ASN 35 HA ASN 35 102.231 -6.039 -9.817 282 HB2 ASN 35 HB2 ASN 35 100.356 -7.816 -10.199 283 HB3 ASN 35 HB3 ASN 35 99.312 -6.417 -10.546 284 HD21 ASN 35 HD21 ASN 35 102.260 -8.160 -11.618 285 HD22 ASN 35 HD22 ASN 35 102.293 -7.444 -13.213 286 H LEU 36 H LEU 36 101.632 -3.955 -7.985 287 HA LEU 36 HA LEU 36 99.860 -2.096 -9.533 288 HB2 LEU 36 HB3 LEU 36 99.948 -0.650 -7.590 289 HB3 LEU 36 HB2 LEU 36 99.644 -2.310 -7.028 290 HG LEU 36 HG LEU 36 102.514 -1.508 -7.243 291 HD11 LEU 36 HD11 LEU 36 101.485 0.547 -6.307 292 HD12 LEU 36 HD12 LEU 36 102.441 -0.308 -5.074 293 HD13 LEU 36 HD13 LEU 36 100.665 -0.430 -5.066 294 HD21 LEU 36 HD21 LEU 36 101.776 -3.722 -6.397 295 HD22 LEU 36 HD22 LEU 36 100.835 -2.918 -5.118 296 HD23 LEU 36 HD23 LEU 36 102.611 -2.797 -5.125 297 H LYS 37 H LYS 37 100.655 0.207 -9.731 298 HA LYS 37 HA LYS 37 103.529 0.149 -10.667 299 HB2 LYS 37 HB3 LYS 37 101.048 1.151 -11.817 300 HB3 LYS 37 HB2 LYS 37 102.214 2.481 -11.626 301 HG2 LYS 37 HG2 LYS 37 103.927 1.189 -12.828 302 HG3 LYS 37 HG3 LYS 37 102.816 -0.195 -12.962 303 HD2 LYS 37 HD3 LYS 37 101.199 1.442 -14.145 304 HD3 LYS 37 HD2 LYS 37 102.598 2.533 -14.283 305 HE2 LYS 37 HE2 LYS 37 102.271 -0.257 -15.447 306 HE3 LYS 37 HE3 LYS 37 102.568 1.268 -16.316 307 HZ1 LYS 37 HZ1 LYS 37 104.644 0.349 -16.211 308 HZ2 LYS 37 HZ2 LYS 37 104.678 1.291 -14.858 309 HZ3 LYS 37 HZ3 LYS 37 104.425 -0.333 -14.726 310 H LEU 38 H LEU 38 104.954 1.748 -9.930 311 HA LEU 38 HA LEU 38 103.805 3.780 -8.021 312 HB2 LEU 38 HB2 LEU 38 106.360 2.245 -7.423 313 HB3 LEU 38 HB3 LEU 38 105.422 3.291 -6.330 314 HG LEU 38 HG LEU 38 103.490 1.509 -6.940 315 HD11 LEU 38 HD11 LEU 38 104.956 0.208 -8.464 316 HD12 LEU 38 HD12 LEU 38 106.100 -0.065 -7.127 317 HD13 LEU 38 HD13 LEU 38 104.465 -0.767 -7.057 318 HD21 LEU 38 HD21 LEU 38 104.313 2.086 -4.670 319 HD22 LEU 38 HD22 LEU 38 104.090 0.329 -4.844 320 HD23 LEU 38 HD23 LEU 38 105.724 1.030 -4.915 321 H THR 39 H THR 39 104.591 5.781 -8.434 322 HA THR 39 HA THR 39 106.989 5.961 -10.260 323 HB THR 39 HB THR 39 105.255 8.317 -9.506 324 HG1 THR 39 HG1 THR 39 103.702 6.865 -10.112 325 HG21 THR 39 HG21 THR 39 105.803 8.971 -11.834 326 HG22 THR 39 HG22 THR 39 106.660 7.428 -12.065 327 HG23 THR 39 HG23 THR 39 107.280 8.625 -10.903 328 H ILE 40 H ILE 40 108.904 6.416 -9.262 329 HA ILE 40 HA ILE 40 108.732 7.795 -6.578 330 HB ILE 40 HB ILE 40 110.952 6.087 -7.783 331 HG12 ILE 40 HG12 ILE 40 110.227 4.656 -5.716 332 HG13 ILE 40 HG13 ILE 40 108.724 5.605 -5.782 333 HG21 ILE 40 HG21 ILE 40 111.955 6.257 -5.520 334 HG22 ILE 40 HG22 ILE 40 110.640 7.347 -5.019 335 HG23 ILE 40 HG23 ILE 40 111.797 7.864 -6.269 336 HD11 ILE 40 HD11 ILE 40 109.215 3.295 -7.233 337 HD12 ILE 40 HD12 ILE 40 109.594 4.572 -8.414 338 HD13 ILE 40 HD13 ILE 40 107.990 4.519 -7.644 339 H THR 41 H THR 41 109.266 9.891 -6.568 340 HA THR 41 HA THR 41 111.301 10.828 -8.602 341 HB THR 41 HB THR 41 109.377 12.726 -7.271 342 HG1 THR 41 HG1 THR 41 107.949 11.195 -8.001 343 HG21 THR 41 HG21 THR 41 109.579 13.852 -9.470 344 HG22 THR 41 HG22 THR 41 111.181 13.543 -8.761 345 HG23 THR 41 HG23 THR 41 110.572 12.503 -10.070 346 H GLN 42 H GLN 42 112.858 12.392 -7.808 347 HA GLN 42 HA GLN 42 112.965 12.516 -4.782 348 HB2 GLN 42 HB2 GLN 42 115.358 12.175 -4.856 349 HB3 GLN 42 HB3 GLN 42 114.610 10.878 -5.819 350 HG2 GLN 42 HG2 GLN 42 114.948 12.443 -7.855 351 HG3 GLN 42 HG3 GLN 42 116.035 13.377 -6.800 352 HE21 GLN 42 HE21 GLN 42 117.400 11.449 -5.359 353 HE22 GLN 42 HE22 GLN 42 118.266 10.383 -6.442 354 H GLU 43 H GLU 43 113.714 14.480 -3.902 355 HA GLU 43 HA GLU 43 114.512 16.608 -5.876 356 HB2 GLU 43 HB2 GLU 43 112.471 17.168 -3.698 357 HB3 GLU 43 HB3 GLU 43 112.887 18.167 -5.111 358 HG2 GLU 43 HG3 GLU 43 112.082 16.087 -6.498 359 HG3 GLU 43 HG2 GLU 43 111.262 15.616 -4.990 360 H GLY 44 H GLY 44 116.612 16.104 -4.839 361 HA2 GLY 44 HA3 GLY 44 118.302 16.608 -3.273 362 HA3 GLY 44 HA2 GLY 44 117.326 18.038 -2.866 363 H ASN 45 H ASN 45 115.666 17.808 -1.198 364 HA ASN 45 HA ASN 45 116.212 15.455 0.628 365 HB2 ASN 45 HB2 ASN 45 115.506 18.246 1.597 366 HB3 ASN 45 HB3 ASN 45 116.175 16.887 2.532 367 HD21 ASN 45 HD21 ASN 45 117.074 19.815 1.260 368 HD22 ASN 45 HD22 ASN 45 118.760 19.484 0.933 369 H LYS 46 H LYS 46 114.067 15.928 -1.406 370 HA LYS 46 HA LYS 46 111.801 15.346 0.432 371 HB2 LYS 46 HB3 LYS 46 111.461 17.702 0.231 372 HB3 LYS 46 HB2 LYS 46 111.946 17.706 -1.480 373 HG2 LYS 46 HG3 LYS 46 109.723 15.889 -1.135 374 HG3 LYS 46 HG2 LYS 46 109.311 17.461 -0.409 375 HD2 LYS 46 HD2 LYS 46 110.213 18.521 -2.581 376 HD3 LYS 46 HD3 LYS 46 110.179 16.879 -3.267 377 HE2 LYS 46 HE2 LYS 46 107.740 18.030 -1.883 378 HE3 LYS 46 HE3 LYS 46 108.079 18.407 -3.589 379 HZ1 LYS 46 HZ1 LYS 46 107.641 16.308 -4.199 380 HZ2 LYS 46 HZ2 LYS 46 108.265 15.626 -2.833 381 HZ3 LYS 46 HZ3 LYS 46 106.745 16.267 -2.815 382 H PHE 47 H PHE 47 111.299 13.410 -0.362 383 HA PHE 47 HA PHE 47 111.512 12.924 -3.313 384 HB2 PHE 47 HB2 PHE 47 111.264 11.172 -0.862 385 HB3 PHE 47 HB3 PHE 47 110.849 10.525 -2.467 386 HD1 PHE 47 HD1 PHE 47 113.542 12.649 -0.906 387 HD2 PHE 47 HD2 PHE 47 112.566 9.469 -3.624 388 HE1 PHE 47 HE1 PHE 47 115.952 12.330 -1.396 389 HE2 PHE 47 HE2 PHE 47 114.977 9.150 -4.115 390 HZ PHE 47 HZ PHE 47 116.670 10.578 -3.000 391 H THR 48 H THR 48 109.660 11.422 -4.165 392 HA THR 48 HA THR 48 107.012 12.036 -2.954 393 HB THR 48 HB THR 48 107.707 12.927 -5.787 394 HG1 THR 48 HG1 THR 48 108.622 14.392 -4.398 395 HG21 THR 48 HG21 THR 48 105.457 13.963 -5.697 396 HG22 THR 48 HG22 THR 48 105.361 12.203 -5.456 397 HG23 THR 48 HG23 THR 48 105.218 13.300 -4.062 398 H VAL 49 H VAL 49 106.439 9.918 -2.855 399 HA VAL 49 HA VAL 49 106.876 8.214 -5.294 400 HB VAL 49 HB VAL 49 105.885 7.427 -2.519 401 HG11 VAL 49 HG11 VAL 49 105.264 5.867 -4.344 402 HG12 VAL 49 HG12 VAL 49 106.493 5.147 -3.278 403 HG13 VAL 49 HG13 VAL 49 106.965 5.800 -4.865 404 HG21 VAL 49 HG21 VAL 49 108.199 6.599 -2.175 405 HG22 VAL 49 HG22 VAL 49 108.669 7.254 -3.761 406 HG23 VAL 49 HG23 VAL 49 108.184 8.357 -2.451 407 H LYS 50 H LYS 50 105.220 8.183 -6.722 408 HA LYS 50 HA LYS 50 102.448 8.700 -5.660 409 HB2 LYS 50 HB2 LYS 50 103.153 8.490 -8.593 410 HB3 LYS 50 HB3 LYS 50 101.871 9.445 -7.811 411 HG2 LYS 50 HG3 LYS 50 103.914 10.664 -6.641 412 HG3 LYS 50 HG2 LYS 50 104.827 10.022 -8.028 413 HD2 LYS 50 HD3 LYS 50 103.221 11.081 -9.584 414 HD3 LYS 50 HD2 LYS 50 102.292 11.712 -8.203 415 HE2 LYS 50 HE2 LYS 50 104.573 12.767 -7.462 416 HE3 LYS 50 HE3 LYS 50 105.062 12.491 -9.151 417 HZ1 LYS 50 HZ1 LYS 50 104.081 14.666 -8.853 418 HZ2 LYS 50 HZ2 LYS 50 102.682 14.006 -8.281 419 HZ3 LYS 50 HZ3 LYS 50 103.135 13.750 -9.846 420 H GLU 51 H GLU 51 101.711 6.715 -4.929 421 HA GLU 51 HA GLU 51 102.289 4.210 -6.316 422 HB2 GLU 51 HB2 GLU 51 100.300 5.077 -4.196 423 HB3 GLU 51 HB3 GLU 51 100.211 3.451 -4.912 424 HG2 GLU 51 HG3 GLU 51 102.081 2.738 -3.813 425 HG3 GLU 51 HG2 GLU 51 102.943 4.268 -4.101 426 H SER 52 H SER 52 100.673 2.887 -7.485 427 HA SER 52 HA SER 52 98.234 4.245 -8.440 428 HB2 SER 52 HB2 SER 52 100.265 3.495 -10.562 429 HB3 SER 52 HB3 SER 52 98.825 4.532 -10.711 430 HG SER 52 HG SER 52 100.969 5.620 -10.537 431 H SER 53 H SER 53 96.961 2.575 -8.047 432 HA SER 53 HA SER 53 97.546 0.006 -9.493 433 HB2 SER 53 HB3 SER 53 97.993 0.180 -6.800 434 HB3 SER 53 HB2 SER 53 96.263 -0.242 -6.808 435 HG SER 53 HG SER 53 96.716 -2.117 -7.856 436 H ALA 54 H ALA 54 95.647 -1.008 -10.253 437 HA ALA 54 HA ALA 54 93.386 0.666 -10.766 438 HB1 ALA 54 HB1 ALA 54 92.216 -1.427 -11.402 439 HB2 ALA 54 HB2 ALA 54 93.486 -2.381 -10.598 440 HB3 ALA 54 HB3 ALA 54 93.880 -1.407 -12.036 441 H PHE 55 H PHE 55 94.370 -0.137 -7.785 442 HA PHE 55 HA PHE 55 91.584 -0.678 -6.764 443 HB2 PHE 55 HB2 PHE 55 93.584 -2.206 -6.166 444 HB3 PHE 55 HB3 PHE 55 94.144 -0.859 -5.145 445 HD1 PHE 55 HD1 PHE 55 93.023 -0.300 -3.095 446 HD2 PHE 55 HD2 PHE 55 91.370 -3.269 -5.723 447 HE1 PHE 55 HE1 PHE 55 91.428 -0.980 -1.323 448 HE2 PHE 55 HE2 PHE 55 89.772 -3.947 -3.951 449 HZ PHE 55 HZ PHE 55 89.802 -2.803 -1.751 450 H ARG 56 H ARG 56 94.213 1.691 -6.734 451 HA ARG 56 HA ARG 56 92.718 3.900 -5.982 452 HB2 ARG 56 HB2 ARG 56 93.042 2.074 -3.678 453 HB3 ARG 56 HB3 ARG 56 93.599 3.731 -3.347 454 HG2 ARG 56 HG2 ARG 56 90.962 3.337 -4.760 455 HG3 ARG 56 HG3 ARG 56 91.043 3.068 -3.002 456 HD2 ARG 56 HD2 ARG 56 91.518 5.293 -2.544 457 HD3 ARG 56 HD3 ARG 56 92.320 5.554 -4.112 458 HE ARG 56 HE ARG 56 90.217 6.168 -5.032 459 HH11 ARG 56 HH11 ARG 56 87.980 6.462 -4.889 460 HH12 ARG 56 HH12 ARG 56 87.095 5.793 -3.537 461 HH21 ARG 56 HH21 ARG 56 89.919 4.404 -2.046 462 HH22 ARG 56 HH22 ARG 56 88.188 4.632 -1.934 463 H ASN 57 H ASN 57 94.430 4.737 -7.250 464 HA ASN 57 HA ASN 57 97.226 4.474 -6.572 465 HB2 ASN 57 HB2 ASN 57 97.577 6.359 -8.076 466 HB3 ASN 57 HB3 ASN 57 96.296 5.331 -8.764 467 HD21 ASN 57 HD21 ASN 57 96.804 8.315 -6.784 468 HD22 ASN 57 HD22 ASN 57 95.293 9.058 -7.257 469 H ILE 58 H ILE 58 98.622 5.901 -5.415 470 HA ILE 58 HA ILE 58 97.215 7.966 -3.727 471 HB ILE 58 HB ILE 58 99.389 6.279 -2.515 472 HG12 ILE 58 HG12 ILE 58 96.490 5.477 -2.938 473 HG13 ILE 58 HG13 ILE 58 97.962 4.527 -3.264 474 HG21 ILE 58 HG21 ILE 58 98.177 8.429 -1.559 475 HG22 ILE 58 HG22 ILE 58 96.867 7.283 -1.186 476 HG23 ILE 58 HG23 ILE 58 98.487 7.040 -0.490 477 HD11 ILE 58 HD11 ILE 58 97.255 3.620 -1.220 478 HD12 ILE 58 HD12 ILE 58 98.408 4.865 -0.685 479 HD13 ILE 58 HD13 ILE 58 96.658 5.185 -0.618 480 H GLU 59 H GLU 59 98.938 9.243 -2.470 481 HA GLU 59 HA GLU 59 101.530 9.495 -3.929 482 HB2 GLU 59 HB3 GLU 59 100.801 11.211 -5.220 483 HB3 GLU 59 HB2 GLU 59 99.237 11.256 -4.375 484 HG2 GLU 59 HG3 GLU 59 100.153 12.666 -2.622 485 HG3 GLU 59 HG2 GLU 59 101.797 12.495 -3.281 486 H CYS 60 H CYS 60 103.090 9.874 -2.426 487 HA CYS 60 HA CYS 60 102.331 11.418 0.035 488 HB2 CYS 60 HB3 CYS 60 102.243 8.694 0.142 489 HB3 CYS 60 HB2 CYS 60 103.959 8.966 0.529 490 HG CYS 60 HG CYS 60 101.546 10.833 2.147 491 H VAL 61 H VAL 61 103.943 12.786 0.624 492 HA VAL 61 HA VAL 61 106.482 12.683 -0.922 493 HB VAL 61 HB VAL 61 105.984 14.608 1.349 494 HG11 VAL 61 HG11 VAL 61 107.174 16.134 -0.137 495 HG12 VAL 61 HG12 VAL 61 108.087 14.609 -0.040 496 HG13 VAL 61 HG13 VAL 61 107.089 14.960 -1.472 497 HG21 VAL 61 HG21 VAL 61 104.763 16.021 -0.471 498 HG22 VAL 61 HG22 VAL 61 104.492 14.463 -1.289 499 HG23 VAL 61 HG23 VAL 61 103.841 14.735 0.345 500 H PHE 62 H PHE 62 108.594 12.580 0.131 501 HA PHE 62 HA PHE 62 108.473 11.477 2.937 502 HB2 PHE 62 HB2 PHE 62 109.855 10.251 0.520 503 HB3 PHE 62 HB3 PHE 62 110.296 9.832 2.192 504 HD1 PHE 62 HD1 PHE 62 108.020 9.482 3.725 505 HD2 PHE 62 HD2 PHE 62 108.398 8.758 -0.492 506 HE1 PHE 62 HE1 PHE 62 106.115 7.899 3.827 507 HE2 PHE 62 HE2 PHE 62 106.493 7.173 -0.388 508 HZ PHE 62 HZ PHE 62 105.353 6.742 1.771 509 H GLU 63 H GLU 63 109.704 12.771 4.174 510 HA GLU 63 HA GLU 63 112.067 14.136 2.880 511 HB2 GLU 63 HB3 GLU 63 110.168 14.819 5.085 512 HB3 GLU 63 HB2 GLU 63 111.864 15.290 5.346 513 HG2 GLU 63 HG2 GLU 63 110.729 17.129 4.230 514 HG3 GLU 63 HG3 GLU 63 111.840 16.373 3.063 515 H LEU 64 H LEU 64 113.949 14.452 4.561 516 HA LEU 64 HA LEU 64 114.443 11.722 5.745 517 HB2 LEU 64 HB2 LEU 64 116.298 13.957 4.836 518 HB3 LEU 64 HB3 LEU 64 116.867 12.543 5.755 519 HG LEU 64 HG LEU 64 115.316 12.375 3.135 520 HD11 LEU 64 HD11 LEU 64 117.502 11.776 2.126 521 HD12 LEU 64 HD12 LEU 64 117.538 13.421 2.806 522 HD13 LEU 64 HD13 LEU 64 118.303 12.076 3.687 523 HD21 LEU 64 HD21 LEU 64 115.111 10.402 4.628 524 HD22 LEU 64 HD22 LEU 64 116.081 10.015 3.187 525 HD23 LEU 64 HD23 LEU 64 116.885 10.309 4.748 526 H GLY 65 H GLY 65 113.963 11.648 7.892 527 HA2 GLY 65 HA2 GLY 65 114.653 12.199 10.169 528 HA3 GLY 65 HA3 GLY 65 115.145 13.814 9.613 529 H VAL 66 H VAL 66 112.626 14.225 8.079 530 HA VAL 66 HA VAL 66 111.029 15.186 10.389 531 HB VAL 66 HB VAL 66 110.349 15.333 7.423 532 HG11 VAL 66 HG11 VAL 66 108.517 15.865 9.007 533 HG12 VAL 66 HG12 VAL 66 109.066 17.326 8.152 534 HG13 VAL 66 HG13 VAL 66 109.572 17.036 9.833 535 HG21 VAL 66 HG21 VAL 66 111.459 17.551 7.471 536 HG22 VAL 66 HG22 VAL 66 111.964 17.261 9.153 537 HG23 VAL 66 HG23 VAL 66 112.615 16.250 7.841 538 H THR 67 H THR 67 109.740 13.713 11.408 539 HA THR 67 HA THR 67 108.780 11.279 10.210 540 HB THR 67 HB THR 67 107.144 12.644 12.328 541 HG1 THR 67 HG1 THR 67 109.176 13.181 13.034 542 HG21 THR 67 HG21 THR 67 106.923 10.435 13.174 543 HG22 THR 67 HG22 THR 67 108.372 9.867 12.310 544 HG23 THR 67 HG23 THR 67 106.882 10.231 11.407 545 H PHE 68 H PHE 68 106.903 10.755 9.210 546 HA PHE 68 HA PHE 68 104.786 12.818 8.857 547 HB2 PHE 68 HB2 PHE 68 104.946 12.069 6.264 548 HB3 PHE 68 HB3 PHE 68 105.791 13.501 6.896 549 HD1 PHE 68 HD1 PHE 68 106.297 9.780 6.646 550 HD2 PHE 68 HD2 PHE 68 108.054 13.693 6.435 551 HE1 PHE 68 HE1 PHE 68 108.477 8.770 6.020 552 HE2 PHE 68 HE2 PHE 68 110.232 12.683 5.815 553 HZ PHE 68 HZ PHE 68 110.441 10.223 5.608 554 H ASN 69 H ASN 69 103.221 11.538 6.991 555 HA ASN 69 HA ASN 69 103.128 8.690 7.958 556 HB2 ASN 69 HB2 ASN 69 100.767 8.843 8.480 557 HB3 ASN 69 HB3 ASN 69 101.607 10.141 9.361 558 HD21 ASN 69 HD21 ASN 69 98.733 10.035 8.402 559 HD22 ASN 69 HD22 ASN 69 98.553 11.442 7.378 560 H CYS 70 H CYS 70 102.075 7.253 6.562 561 HA CYS 70 HA CYS 70 100.950 8.296 4.009 562 HB2 CYS 70 HB2 CYS 70 103.435 6.525 4.122 563 HB3 CYS 70 HB3 CYS 70 102.493 6.858 2.649 564 HG CYS 70 HG CYS 70 104.867 8.736 4.048 565 H ASN 71 H ASN 71 99.346 6.892 3.309 566 HA ASN 71 HA ASN 71 99.007 4.443 5.010 567 HB2 ASN 71 HB2 ASN 71 96.717 4.406 3.826 568 HB3 ASN 71 HB3 ASN 71 97.023 5.759 4.941 569 HD21 ASN 71 HD21 ASN 71 98.245 7.711 3.684 570 HD22 ASN 71 HD22 ASN 71 97.512 8.127 2.151 571 H LEU 72 H LEU 72 98.793 2.371 4.138 572 HA LEU 72 HA LEU 72 100.002 2.090 1.405 573 HB2 LEU 72 HB3 LEU 72 99.382 0.036 3.575 574 HB3 LEU 72 HB2 LEU 72 100.185 -0.324 2.028 575 HG LEU 72 HG LEU 72 101.279 1.856 3.814 576 HD11 LEU 72 HD11 LEU 72 100.999 -0.135 5.269 577 HD12 LEU 72 HD12 LEU 72 102.718 0.162 4.915 578 HD13 LEU 72 HD13 LEU 72 101.845 -1.134 4.063 579 HD21 LEU 72 HD21 LEU 72 102.156 1.557 1.512 580 HD22 LEU 72 HD22 LEU 72 102.519 -0.147 1.872 581 HD23 LEU 72 HD23 LEU 72 103.393 1.148 2.724 582 H ALA 73 H ALA 73 98.962 0.959 -0.276 583 HA ALA 73 HA ALA 73 96.230 1.330 -0.710 584 HB1 ALA 73 HB1 ALA 73 96.342 -0.546 -2.326 585 HB2 ALA 73 HB2 ALA 73 97.866 -1.092 -1.586 586 HB3 ALA 73 HB3 ALA 73 97.797 0.475 -2.429 587 H ASP 74 H ASP 74 97.771 -1.288 1.137 588 HA ASP 74 HA ASP 74 95.479 -2.989 1.409 589 HB2 ASP 74 HB2 ASP 74 97.657 -2.384 3.460 590 HB3 ASP 74 HB3 ASP 74 96.563 -3.787 3.492 591 H GLY 75 H GLY 75 95.566 0.216 2.090 592 HA2 GLY 75 HA2 GLY 75 93.939 1.522 3.234 593 HA3 GLY 75 HA3 GLY 75 93.184 0.020 3.819 594 H THR 76 H THR 76 96.629 0.544 4.245 595 HA THR 76 HA THR 76 96.119 0.678 7.206 596 HB THR 76 HB THR 76 98.908 0.454 6.239 597 HG1 THR 76 HG1 THR 76 97.934 -0.784 4.633 598 HG21 THR 76 HG21 THR 76 98.930 -1.361 7.926 599 HG22 THR 76 HG22 THR 76 97.166 -1.212 8.107 600 HG23 THR 76 HG23 THR 76 98.227 0.131 8.596 601 H GLU 77 H GLU 77 97.512 2.119 8.475 602 HA GLU 77 HA GLU 77 98.445 4.535 6.926 603 HB2 GLU 77 HB2 GLU 77 96.131 4.841 7.983 604 HB3 GLU 77 HB3 GLU 77 96.932 4.679 9.565 605 HG2 GLU 77 HG3 GLU 77 98.467 6.558 8.928 606 HG3 GLU 77 HG2 GLU 77 97.542 6.759 7.421 607 H LEU 78 H LEU 78 100.568 4.955 7.463 608 HA LEU 78 HA LEU 78 101.384 4.285 10.293 609 HB2 LEU 78 HB3 LEU 78 103.347 3.741 8.087 610 HB3 LEU 78 HB2 LEU 78 103.173 2.956 9.674 611 HG LEU 78 HG LEU 78 100.926 2.043 8.782 612 HD11 LEU 78 HD11 LEU 78 101.701 1.907 6.041 613 HD12 LEU 78 HD12 LEU 78 100.283 2.734 6.727 614 HD13 LEU 78 HD13 LEU 78 101.813 3.619 6.513 615 HD21 LEU 78 HD21 LEU 78 102.077 0.167 7.635 616 HD22 LEU 78 HD22 LEU 78 103.546 1.161 7.488 617 HD23 LEU 78 HD23 LEU 78 102.961 0.668 9.096 618 H ARG 79 H ARG 79 103.445 5.338 10.935 619 HA ARG 79 HA ARG 79 104.198 7.701 9.239 620 HB2 ARG 79 HB2 ARG 79 103.898 9.280 11.069 621 HB3 ARG 79 HB3 ARG 79 102.360 8.427 10.803 622 HG2 ARG 79 HG3 ARG 79 102.985 6.832 12.643 623 HG3 ARG 79 HG2 ARG 79 104.435 7.816 12.953 624 HD2 ARG 79 HD2 ARG 79 101.593 8.353 13.628 625 HD3 ARG 79 HD3 ARG 79 103.081 8.937 14.412 626 HE ARG 79 HE ARG 79 101.605 10.286 12.212 627 HH11 ARG 79 HH11 ARG 79 102.414 12.333 11.701 628 HH12 ARG 79 HH12 ARG 79 103.967 12.841 12.326 629 HH21 ARG 79 HH21 ARG 79 104.538 9.863 14.040 630 HH22 ARG 79 HH22 ARG 79 105.165 11.448 13.645 631 H GLY 80 H GLY 80 106.337 8.393 9.577 632 HA2 GLY 80 HA3 GLY 80 107.963 7.879 11.825 633 HA3 GLY 80 HA2 GLY 80 108.122 6.442 10.781 634 H THR 81 H THR 81 109.764 6.587 9.327 635 HA THR 81 HA THR 81 110.093 8.732 7.484 636 HB THR 81 HB THR 81 112.432 9.305 9.021 637 HG1 THR 81 HG1 THR 81 111.637 9.814 10.990 638 HG21 THR 81 HG21 THR 81 111.332 11.595 9.124 639 HG22 THR 81 HG22 THR 81 111.439 10.889 7.493 640 HG23 THR 81 HG23 THR 81 109.894 10.859 8.377 641 H TRP 82 H TRP 82 112.051 8.553 6.202 642 HA TRP 82 HA TRP 82 113.312 5.833 6.534 643 HB2 TRP 82 HB3 TRP 82 113.630 7.628 4.110 644 HB3 TRP 82 HB2 TRP 82 113.780 5.859 4.215 645 HD1 TRP 82 HD1 TRP 82 111.075 8.594 4.561 646 HE1 TRP 82 HE1 TRP 82 108.810 7.637 3.795 647 HE3 TRP 82 HE3 TRP 82 112.510 3.786 3.645 648 HZ2 TRP 82 HZ2 TRP 82 107.775 5.092 2.888 649 HZ3 TRP 82 HZ3 TRP 82 110.873 2.116 2.827 650 HH2 TRP 82 HH2 TRP 82 108.509 2.763 2.449 651 H SER 83 H SER 83 115.559 5.617 6.663 652 HA SER 83 HA SER 83 117.166 8.163 6.619 653 HB2 SER 83 HB2 SER 83 117.640 6.152 8.822 654 HB3 SER 83 HB3 SER 83 118.028 7.889 8.778 655 HG SER 83 HG SER 83 116.230 7.718 10.058 656 H LEU 84 H LEU 84 119.516 7.689 6.326 657 HA LEU 84 HA LEU 84 119.775 5.136 4.803 658 HB2 LEU 84 HB2 LEU 84 120.958 6.580 3.509 659 HB3 LEU 84 HB3 LEU 84 121.093 7.773 4.821 660 HG LEU 84 HG LEU 84 122.890 6.313 5.847 661 HD11 LEU 84 HD11 LEU 84 123.547 4.976 3.333 662 HD12 LEU 84 HD12 LEU 84 123.385 4.289 4.967 663 HD13 LEU 84 HD13 LEU 84 121.949 4.469 3.931 664 HD21 LEU 84 HD21 LEU 84 124.632 7.021 4.229 665 HD22 LEU 84 HD22 LEU 84 123.374 7.314 3.004 666 HD23 LEU 84 HD23 LEU 84 123.429 8.309 4.480 667 H GLU 85 H GLU 85 120.752 3.368 5.638 668 HA GLU 85 HA GLU 85 122.456 3.743 8.101 669 HB2 GLU 85 HB2 GLU 85 120.768 2.709 9.232 670 HB3 GLU 85 HB3 GLU 85 119.970 2.178 7.734 671 HG2 GLU 85 HG2 GLU 85 121.409 0.262 7.542 672 HG3 GLU 85 HG3 GLU 85 122.498 0.870 8.811 673 H GLY 86 H GLY 86 124.472 3.011 7.645 674 HA2 GLY 86 HA2 GLY 86 126.177 1.736 6.612 675 HA3 GLY 86 HA3 GLY 86 124.984 0.419 6.503 676 H ASN 87 H ASN 87 124.207 -0.102 4.494 677 HA ASN 87 HA ASN 87 124.684 1.931 2.302 678 HB2 ASN 87 HB3 ASN 87 125.201 -1.056 2.363 679 HB3 ASN 87 HB2 ASN 87 124.933 -0.199 0.825 680 HD21 ASN 87 HD21 ASN 87 126.538 1.388 0.138 681 HD22 ASN 87 HD22 ASN 87 128.110 1.468 0.902 682 H LYS 88 H LYS 88 122.202 1.515 3.860 683 HA LYS 88 HA LYS 88 120.468 0.876 1.501 684 HB2 LYS 88 HB3 LYS 88 119.075 -0.684 2.747 685 HB3 LYS 88 HB2 LYS 88 120.760 -1.253 2.815 686 HG2 LYS 88 HG2 LYS 88 120.660 0.397 5.017 687 HG3 LYS 88 HG3 LYS 88 119.002 -0.249 4.992 688 HD2 LYS 88 HD3 LYS 88 120.160 -1.864 6.256 689 HD3 LYS 88 HD2 LYS 88 120.181 -2.566 4.620 690 HE2 LYS 88 HE2 LYS 88 122.436 -1.234 4.364 691 HE3 LYS 88 HE3 LYS 88 122.416 -1.211 6.144 692 HZ1 LYS 88 HZ1 LYS 88 123.576 -3.139 5.291 693 HZ2 LYS 88 HZ2 LYS 88 122.221 -3.609 6.106 694 HZ3 LYS 88 HZ3 LYS 88 122.239 -3.629 4.457 695 H LEU 89 H LEU 89 118.266 1.685 1.755 696 HA LEU 89 HA LEU 89 118.213 4.033 3.628 697 HB2 LEU 89 HB2 LEU 89 116.837 3.271 1.073 698 HB3 LEU 89 HB3 LEU 89 115.922 4.287 2.213 699 HG LEU 89 HG LEU 89 118.785 4.991 1.549 700 HD11 LEU 89 HD11 LEU 89 117.652 4.664 -0.632 701 HD12 LEU 89 HD12 LEU 89 116.324 5.724 -0.101 702 HD13 LEU 89 HD13 LEU 89 117.960 6.390 -0.324 703 HD21 LEU 89 HD21 LEU 89 117.585 6.173 3.371 704 HD22 LEU 89 HD22 LEU 89 116.286 6.604 2.234 705 HD23 LEU 89 HD23 LEU 89 117.921 7.270 2.010 706 H ILE 90 H ILE 90 117.400 3.550 5.620 707 HA ILE 90 HA ILE 90 115.538 1.287 5.941 708 HB ILE 90 HB ILE 90 115.414 2.439 8.351 709 HG12 ILE 90 HG12 ILE 90 118.086 3.388 7.255 710 HG13 ILE 90 HG13 ILE 90 116.676 4.451 7.490 711 HG21 ILE 90 HG21 ILE 90 116.354 0.209 7.806 712 HG22 ILE 90 HG22 ILE 90 117.854 0.983 7.240 713 HG23 ILE 90 HG23 ILE 90 117.394 1.083 8.957 714 HD11 ILE 90 HD11 ILE 90 118.184 4.524 9.452 715 HD12 ILE 90 HD12 ILE 90 116.603 3.828 9.881 716 HD13 ILE 90 HD13 ILE 90 118.011 2.764 9.647 717 H GLY 91 H GLY 91 113.494 1.558 7.143 718 HA2 GLY 91 HA2 GLY 91 112.098 4.168 6.696 719 HA3 GLY 91 HA3 GLY 91 111.440 2.737 5.863 720 H LYS 92 H LYS 92 111.833 4.358 8.926 721 HA LYS 92 HA LYS 92 110.697 2.047 10.431 722 HB2 LYS 92 HB2 LYS 92 111.816 4.757 11.118 723 HB3 LYS 92 HB3 LYS 92 110.692 3.991 12.267 724 HG2 LYS 92 HG2 LYS 92 112.104 1.958 12.298 725 HG3 LYS 92 HG3 LYS 92 113.226 2.716 11.144 726 HD2 LYS 92 HD3 LYS 92 113.521 4.603 12.827 727 HD3 LYS 92 HD2 LYS 92 112.603 3.614 13.988 728 HE2 LYS 92 HE3 LYS 92 114.830 3.027 14.472 729 HE3 LYS 92 HE2 LYS 92 114.326 1.734 13.357 730 HZ1 LYS 92 HZ1 LYS 92 116.450 2.672 12.732 731 HZ2 LYS 92 HZ2 LYS 92 115.328 2.981 11.563 732 HZ3 LYS 92 HZ3 LYS 92 115.794 4.179 12.596 733 H PHE 93 H PHE 93 108.554 1.727 9.985 734 HA PHE 93 HA PHE 93 106.790 4.184 10.075 735 HB2 PHE 93 HB2 PHE 93 106.706 1.685 8.380 736 HB3 PHE 93 HB3 PHE 93 105.194 2.541 8.756 737 HD1 PHE 93 HD1 PHE 93 107.484 5.095 8.891 738 HD2 PHE 93 HD2 PHE 93 105.735 2.440 6.002 739 HE1 PHE 93 HE1 PHE 93 107.969 6.731 7.093 740 HE2 PHE 93 HE2 PHE 93 106.220 4.078 4.206 741 HZ PHE 93 HZ PHE 93 107.335 6.225 4.752 742 H LYS 94 H LYS 94 105.046 4.156 11.387 743 HA LYS 94 HA LYS 94 104.620 1.630 12.996 744 HB2 LYS 94 HB3 LYS 94 104.887 4.506 13.813 745 HB3 LYS 94 HB2 LYS 94 103.702 3.506 14.689 746 HG2 LYS 94 HG2 LYS 94 105.337 2.068 15.533 747 HG3 LYS 94 HG3 LYS 94 106.475 2.417 14.210 748 HD2 LYS 94 HD2 LYS 94 107.005 4.577 15.113 749 HD3 LYS 94 HD3 LYS 94 105.651 4.502 16.266 750 HE2 LYS 94 HE2 LYS 94 108.223 3.859 16.918 751 HE3 LYS 94 HE3 LYS 94 106.800 3.162 17.730 752 HZ1 LYS 94 HZ1 LYS 94 108.482 1.547 16.855 753 HZ2 LYS 94 HZ2 LYS 94 108.003 1.954 15.330 754 HZ3 LYS 94 HZ3 LYS 94 106.927 1.272 16.378 755 H ARG 95 H ARG 95 102.651 0.784 12.631 756 HA ARG 95 HA ARG 95 100.644 1.989 11.014 757 HB2 ARG 95 HB2 ARG 95 100.930 -0.393 12.598 758 HB3 ARG 95 HB3 ARG 95 99.362 0.343 13.003 759 HG2 ARG 95 HG3 ARG 95 98.667 0.340 10.697 760 HG3 ARG 95 HG2 ARG 95 100.305 -0.072 10.138 761 HD2 ARG 95 HD2 ARG 95 100.055 -2.297 10.631 762 HD3 ARG 95 HD3 ARG 95 99.110 -1.968 12.103 763 HE ARG 95 HE ARG 95 97.572 -1.288 9.717 764 HH11 ARG 95 HH11 ARG 95 95.901 -2.712 9.175 765 HH12 ARG 95 HH12 ARG 95 95.870 -4.323 9.855 766 HH21 ARG 95 HH21 ARG 95 98.793 -3.881 11.693 767 HH22 ARG 95 HH22 ARG 95 97.500 -4.982 11.275 768 H THR 96 H THR 96 99.607 3.879 11.401 769 HA THR 96 HA THR 96 99.490 5.046 14.075 770 HB THR 96 HB THR 96 97.582 6.401 12.646 771 HG1 THR 96 HG1 THR 96 99.491 5.554 10.718 772 HG21 THR 96 HG21 THR 96 99.422 7.945 12.041 773 HG22 THR 96 HG22 THR 96 100.610 6.666 12.388 774 HG23 THR 96 HG23 THR 96 99.617 7.340 13.703 775 H ASP 97 H ASP 97 97.751 2.693 12.488 776 HA ASP 97 HA ASP 97 95.149 3.171 13.801 777 HB2 ASP 97 HB2 ASP 97 96.340 0.967 12.097 778 HB3 ASP 97 HB3 ASP 97 94.788 0.728 12.936 779 H ASN 98 H ASN 98 97.824 0.794 14.155 780 HA ASN 98 HA ASN 98 96.873 0.408 16.996 781 HB2 ASN 98 HB2 ASN 98 97.840 -1.785 15.110 782 HB3 ASN 98 HB3 ASN 98 97.356 -1.999 16.810 783 HD21 ASN 98 HD21 ASN 98 96.198 -2.449 13.729 784 HD22 ASN 98 HD22 ASN 98 94.490 -2.215 14.027 785 H GLY 99 H GLY 99 99.249 1.718 15.275 786 HA2 GLY 99 HA2 GLY 99 101.601 1.922 15.569 787 HA3 GLY 99 HA3 GLY 99 101.200 1.771 17.297 788 H ASN 100 H ASN 100 100.894 -0.632 14.653 789 HA ASN 100 HA ASN 100 102.180 -2.658 16.385 790 HB2 ASN 100 HB3 ASN 100 100.903 -2.609 13.660 791 HB3 ASN 100 HB2 ASN 100 101.983 -3.962 14.074 792 HD21 ASN 100 HD21 ASN 100 99.274 -4.548 13.671 793 HD22 ASN 100 HD22 ASN 100 98.519 -4.907 15.208 794 H GLU 101 H GLU 101 103.606 -0.204 15.245 795 HA GLU 101 HA GLU 101 105.666 0.313 14.215 796 HB2 GLU 101 HB2 GLU 101 107.515 -0.817 15.205 797 HB3 GLU 101 HB3 GLU 101 106.217 -0.872 16.419 798 HG2 GLU 101 HG2 GLU 101 105.695 -3.166 15.870 799 HG3 GLU 101 HG3 GLU 101 106.753 -3.125 14.439 800 H LEU 102 H LEU 102 107.301 -0.264 12.633 801 HA LEU 102 HA LEU 102 107.013 -2.791 11.129 802 HB2 LEU 102 HB2 LEU 102 105.096 -1.391 10.262 803 HB3 LEU 102 HB3 LEU 102 106.280 -0.164 9.755 804 HG LEU 102 HG LEU 102 106.465 -3.069 8.870 805 HD11 LEU 102 HD11 LEU 102 104.282 -2.140 8.143 806 HD12 LEU 102 HD12 LEU 102 105.116 -0.733 7.441 807 HD13 LEU 102 HD13 LEU 102 105.381 -2.356 6.760 808 HD21 LEU 102 HD21 LEU 102 107.553 -1.519 6.898 809 HD22 LEU 102 HD22 LEU 102 108.492 -2.184 8.256 810 HD23 LEU 102 HD23 LEU 102 107.896 -0.508 8.322 811 H ASN 103 H ASN 103 109.079 -3.249 10.471 812 HA ASN 103 HA ASN 103 110.931 -0.870 10.162 813 HB2 ASN 103 HB3 ASN 103 111.221 -2.933 11.930 814 HB3 ASN 103 HB2 ASN 103 112.088 -3.598 10.525 815 HD21 ASN 103 HD21 ASN 103 112.487 -1.652 13.275 816 HD22 ASN 103 HD22 ASN 103 113.919 -0.786 12.764 817 H THR 104 H THR 104 111.262 -0.452 8.033 818 HA THR 104 HA THR 104 111.535 -2.862 6.225 819 HB THR 104 HB THR 104 109.439 -1.824 5.685 820 HG1 THR 104 HG1 THR 104 110.164 -2.036 3.702 821 HG21 THR 104 HG21 THR 104 109.568 0.727 5.050 822 HG22 THR 104 HG22 THR 104 109.475 0.266 6.766 823 HG23 THR 104 HG23 THR 104 111.040 0.718 6.050 824 H VAL 105 H VAL 105 112.559 -2.092 4.043 825 HA VAL 105 HA VAL 105 114.634 0.019 4.452 826 HB VAL 105 HB VAL 105 115.345 -2.866 3.754 827 HG11 VAL 105 HG11 VAL 105 117.694 -1.737 4.291 828 HG12 VAL 105 HG12 VAL 105 116.833 -0.246 3.840 829 HG13 VAL 105 HG13 VAL 105 116.966 -1.584 2.674 830 HG21 VAL 105 HG21 VAL 105 116.501 -2.856 5.952 831 HG22 VAL 105 HG22 VAL 105 115.873 -1.221 6.271 832 HG23 VAL 105 HG23 VAL 105 114.751 -2.597 6.144 833 H ARG 106 H ARG 106 115.660 0.619 2.399 834 HA ARG 106 HA ARG 106 114.091 -0.389 0.012 835 HB2 ARG 106 HB2 ARG 106 114.758 2.405 0.919 836 HB3 ARG 106 HB3 ARG 106 114.698 2.071 -0.828 837 HG2 ARG 106 HG2 ARG 106 112.415 1.076 -0.513 838 HG3 ARG 106 HG3 ARG 106 112.479 1.554 1.200 839 HD2 ARG 106 HD3 ARG 106 112.608 3.898 0.619 840 HD3 ARG 106 HD2 ARG 106 112.837 3.515 -1.104 841 HE ARG 106 HE ARG 106 110.393 2.328 -0.567 842 HH11 ARG 106 HH11 ARG 106 108.426 3.437 -0.664 843 HH12 ARG 106 HH12 ARG 106 108.384 5.168 -0.412 844 HH21 ARG 106 HH21 ARG 106 111.820 5.437 0.084 845 HH22 ARG 106 HH22 ARG 106 110.298 6.295 0.009 846 H GLU 107 H GLU 107 115.308 -1.034 -1.709 847 HA GLU 107 HA GLU 107 118.210 -0.208 -1.749 848 HB2 GLU 107 HB2 GLU 107 118.749 -2.322 -1.116 849 HB3 GLU 107 HB3 GLU 107 117.080 -2.894 -1.333 850 HG2 GLU 107 HG3 GLU 107 117.437 -3.189 -3.726 851 HG3 GLU 107 HG2 GLU 107 119.053 -2.449 -3.615 852 H ILE 108 H ILE 108 119.162 -0.402 -3.942 853 HA ILE 108 HA ILE 108 117.022 -0.373 -6.078 854 HB ILE 108 HB ILE 108 119.630 1.198 -6.074 855 HG12 ILE 108 HG12 ILE 108 117.581 1.685 -4.315 856 HG13 ILE 108 HG13 ILE 108 118.639 2.950 -4.981 857 HG21 ILE 108 HG21 ILE 108 118.778 0.838 -8.285 858 HG22 ILE 108 HG22 ILE 108 118.302 2.492 -7.830 859 HG23 ILE 108 HG23 ILE 108 117.108 1.174 -7.767 860 HD11 ILE 108 HD11 ILE 108 116.129 3.400 -5.164 861 HD12 ILE 108 HD12 ILE 108 116.063 2.064 -6.338 862 HD13 ILE 108 HD13 ILE 108 117.040 3.509 -6.689 863 H ILE 109 H ILE 109 117.499 -2.670 -6.334 864 HA ILE 109 HA ILE 109 120.175 -3.623 -6.876 865 HB ILE 109 HB ILE 109 117.392 -4.652 -7.479 866 HG12 ILE 109 HG12 ILE 109 119.744 -5.793 -5.906 867 HG13 ILE 109 HG13 ILE 109 118.434 -4.825 -5.191 868 HG21 ILE 109 HG21 ILE 109 119.121 -6.754 -8.077 869 HG22 ILE 109 HG22 ILE 109 118.225 -5.783 -9.269 870 HG23 ILE 109 HG23 ILE 109 119.904 -5.360 -8.858 871 HD11 ILE 109 HD11 ILE 109 118.379 -7.628 -6.267 872 HD12 ILE 109 HD12 ILE 109 116.918 -6.633 -6.478 873 HD13 ILE 109 HD13 ILE 109 117.558 -6.940 -4.845 874 H GLY 110 H GLY 110 121.183 -2.201 -8.313 875 HA2 GLY 110 HA2 GLY 110 121.752 -1.335 -10.433 876 HA3 GLY 110 HA3 GLY 110 121.044 -2.832 -11.081 877 H ASP 111 H ASP 111 118.674 -2.832 -11.491 878 HA ASP 111 HA ASP 111 117.631 -0.025 -11.915 879 HB2 ASP 111 HB2 ASP 111 117.104 -2.333 -13.819 880 HB3 ASP 111 HB3 ASP 111 116.827 -0.595 -14.087 881 H GLU 112 H GLU 112 117.126 -2.031 -9.759 882 HA GLU 112 HA GLU 112 114.135 -2.145 -10.150 883 HB2 GLU 112 HB2 GLU 112 115.913 -4.372 -9.059 884 HB3 GLU 112 HB3 GLU 112 114.135 -4.368 -8.984 885 HG2 GLU 112 HG3 GLU 112 114.299 -3.944 -11.580 886 HG3 GLU 112 HG2 GLU 112 115.945 -4.596 -11.395 887 H LEU 113 H LEU 113 112.950 -1.743 -8.214 888 HA LEU 113 HA LEU 113 114.713 -0.746 -5.970 889 HB2 LEU 113 HB3 LEU 113 113.091 0.875 -6.963 890 HB3 LEU 113 HB2 LEU 113 111.759 -0.206 -6.493 891 HG LEU 113 HG LEU 113 112.819 -0.046 -4.092 892 HD11 LEU 113 HD11 LEU 113 114.879 1.126 -4.827 893 HD12 LEU 113 HD12 LEU 113 113.945 2.129 -3.692 894 HD13 LEU 113 HD13 LEU 113 113.893 2.476 -5.437 895 HD21 LEU 113 HD21 LEU 113 111.454 1.979 -3.648 896 HD22 LEU 113 HD22 LEU 113 111.405 2.328 -5.392 897 HD23 LEU 113 HD23 LEU 113 110.609 0.870 -4.754 898 H VAL 114 H VAL 114 114.984 -2.190 -4.362 899 HA VAL 114 HA VAL 114 112.783 -4.187 -3.895 900 HB VAL 114 HB VAL 114 115.605 -4.093 -2.739 901 HG11 VAL 114 HG11 VAL 114 115.140 -6.469 -2.203 902 HG12 VAL 114 HG12 VAL 114 113.500 -6.299 -2.872 903 HG13 VAL 114 HG13 VAL 114 113.964 -5.393 -1.412 904 HG21 VAL 114 HG21 VAL 114 114.554 -4.926 -5.363 905 HG22 VAL 114 HG22 VAL 114 116.238 -4.687 -4.839 906 HG23 VAL 114 HG23 VAL 114 115.418 -6.234 -4.520 907 H GLN 115 H GLN 115 111.289 -3.444 -2.480 908 HA GLN 115 HA GLN 115 112.291 -1.862 -0.107 909 HB2 GLN 115 HB3 GLN 115 110.470 -0.901 -1.652 910 HB3 GLN 115 HB2 GLN 115 109.405 -2.183 -1.026 911 HG2 GLN 115 HG2 GLN 115 109.626 -1.361 1.239 912 HG3 GLN 115 HG3 GLN 115 110.907 -0.222 0.760 913 HE21 GLN 115 HE21 GLN 115 108.368 0.552 2.031 914 HE22 GLN 115 HE22 GLN 115 107.516 1.548 0.872 915 H THR 116 H THR 116 112.786 -3.368 1.456 916 HA THR 116 HA THR 116 110.874 -5.669 1.788 917 HB THR 116 HB THR 116 113.374 -5.424 3.426 918 HG1 THR 116 HG1 THR 116 114.193 -4.864 1.436 919 HG21 THR 116 HG21 THR 116 113.428 -7.862 2.969 920 HG22 THR 116 HG22 THR 116 111.858 -7.361 3.641 921 HG23 THR 116 HG23 THR 116 112.017 -7.687 1.898 922 H TYR 117 H TYR 117 109.828 -6.054 3.738 923 HA TYR 117 HA TYR 117 110.163 -3.895 5.824 924 HB2 TYR 117 HB3 TYR 117 107.474 -5.186 5.460 925 HB3 TYR 117 HB2 TYR 117 107.884 -3.563 6.063 926 HD1 TYR 117 HD1 TYR 117 108.301 -5.609 2.971 927 HD2 TYR 117 HD2 TYR 117 107.407 -1.774 4.657 928 HE1 TYR 117 HE1 TYR 117 107.899 -4.710 0.696 929 HE2 TYR 117 HE2 TYR 117 107.008 -0.859 2.386 930 HH TYR 117 HH TYR 117 106.305 -1.890 0.068 931 H VAL 118 H VAL 118 109.773 -4.528 7.935 932 HA VAL 118 HA VAL 118 109.742 -7.524 8.366 933 HB VAL 118 HB VAL 118 110.947 -5.489 10.272 934 HG11 VAL 118 HG11 VAL 118 111.725 -7.333 11.447 935 HG12 VAL 118 HG12 VAL 118 110.225 -8.014 10.774 936 HG13 VAL 118 HG13 VAL 118 111.788 -8.364 9.998 937 HG21 VAL 118 HG21 VAL 118 113.161 -6.109 9.350 938 HG22 VAL 118 HG22 VAL 118 112.146 -5.328 8.114 939 HG23 VAL 118 HG23 VAL 118 112.364 -7.094 8.100 940 H TYR 119 H TYR 119 108.489 -8.251 10.093 941 HA TYR 119 HA TYR 119 106.876 -6.155 11.501 942 HB2 TYR 119 HB2 TYR 119 105.857 -7.344 9.259 943 HB3 TYR 119 HB3 TYR 119 105.293 -8.466 10.521 944 HD1 TYR 119 HD1 TYR 119 104.037 -7.563 12.488 945 HD2 TYR 119 HD2 TYR 119 104.891 -5.171 9.031 946 HE1 TYR 119 HE1 TYR 119 102.256 -5.972 13.154 947 HE2 TYR 119 HE2 TYR 119 103.120 -3.569 9.698 948 HH TYR 119 HH TYR 119 101.104 -3.490 11.056 949 H GLU 120 H GLU 120 107.299 -6.585 13.542 950 HA GLU 120 HA GLU 120 107.633 -7.788 15.538 951 HB2 GLU 120 HB3 GLU 120 105.351 -9.281 14.204 952 HB3 GLU 120 HB2 GLU 120 105.918 -9.682 15.843 953 HG2 GLU 120 HG2 GLU 120 105.273 -7.597 16.716 954 HG3 GLU 120 HG3 GLU 120 105.280 -6.814 15.118 955 H GLY 121 H GLY 121 109.045 -8.757 12.954 956 HA2 GLY 121 HA3 GLY 121 110.974 -10.325 13.281 957 HA3 GLY 121 HA2 GLY 121 109.869 -11.406 14.166 958 H VAL 122 H VAL 122 108.839 -9.687 11.295 959 HA VAL 122 HA VAL 122 108.999 -12.293 9.783 960 HB VAL 122 HB VAL 122 106.651 -11.186 10.562 961 HG11 VAL 122 HG11 VAL 122 106.985 -10.092 7.756 962 HG12 VAL 122 HG12 VAL 122 105.724 -9.723 8.957 963 HG13 VAL 122 HG13 VAL 122 107.375 -9.097 9.180 964 HG21 VAL 122 HG21 VAL 122 105.634 -12.393 8.655 965 HG22 VAL 122 HG22 VAL 122 106.962 -13.330 9.380 966 HG23 VAL 122 HG23 VAL 122 107.221 -12.455 7.852 967 H GLU 123 H GLU 123 108.670 -11.650 7.306 968 HA GLU 123 HA GLU 123 109.943 -9.024 6.755 969 HB2 GLU 123 HB2 GLU 123 111.982 -10.106 7.145 970 HB3 GLU 123 HB3 GLU 123 111.396 -11.661 6.507 971 HG2 GLU 123 HG2 GLU 123 111.680 -11.008 4.282 972 HG3 GLU 123 HG3 GLU 123 111.539 -9.276 4.663 973 H ALA 124 H ALA 124 108.971 -8.245 4.996 974 HA ALA 124 HA ALA 124 108.062 -10.222 2.890 975 HB1 ALA 124 HB1 ALA 124 106.720 -7.742 2.522 976 HB2 ALA 124 HB2 ALA 124 106.651 -8.083 4.267 977 HB3 ALA 124 HB3 ALA 124 106.018 -9.272 3.103 978 H LYS 125 H LYS 125 108.287 -9.414 0.619 979 HA LYS 125 HA LYS 125 110.245 -7.127 0.441 980 HB2 LYS 125 HB2 LYS 125 111.338 -9.474 0.397 981 HB3 LYS 125 HB3 LYS 125 110.589 -9.645 -1.209 982 HG2 LYS 125 HG3 LYS 125 111.674 -7.419 -1.826 983 HG3 LYS 125 HG2 LYS 125 112.586 -7.532 -0.302 984 HD2 LYS 125 HD2 LYS 125 112.582 -9.670 -2.478 985 HD3 LYS 125 HD3 LYS 125 113.850 -8.438 -2.278 986 HE2 LYS 125 HE2 LYS 125 113.095 -10.693 -0.386 987 HE3 LYS 125 HE3 LYS 125 114.678 -10.356 -1.128 988 HZ1 LYS 125 HZ1 LYS 125 114.911 -9.507 0.972 989 HZ2 LYS 125 HZ2 LYS 125 113.353 -8.976 1.085 990 HZ3 LYS 125 HZ3 LYS 125 114.440 -8.154 0.155 991 H ARG 126 H ARG 126 109.984 -5.807 -1.284 992 HA ARG 126 HA ARG 126 108.062 -6.693 -3.445 993 HB2 ARG 126 HB2 ARG 126 107.673 -4.601 -1.502 994 HB3 ARG 126 HB3 ARG 126 107.918 -3.840 -3.092 995 HG2 ARG 126 HG2 ARG 126 106.207 -5.506 -4.015 996 HG3 ARG 126 HG3 ARG 126 105.845 -5.937 -2.326 997 HD2 ARG 126 HD3 ARG 126 105.830 -3.037 -3.194 998 HD3 ARG 126 HD2 ARG 126 104.414 -4.072 -3.502 999 HE ARG 126 HE ARG 126 105.510 -3.402 -0.769 1000 HH11 ARG 126 HH11 ARG 126 103.927 -3.537 0.828 1001 HH12 ARG 126 HH12 ARG 126 102.334 -4.145 0.436 1002 HH21 ARG 126 HH21 ARG 126 103.079 -4.675 -2.923 1003 HH22 ARG 126 HH22 ARG 126 101.856 -4.786 -1.676 1004 H ILE 127 H ILE 127 109.276 -6.757 -5.293 1005 HA ILE 127 HA ILE 127 111.528 -4.749 -5.510 1006 HB ILE 127 HB ILE 127 111.123 -7.356 -7.034 1007 HG12 ILE 127 HG12 ILE 127 113.329 -7.055 -5.051 1008 HG13 ILE 127 HG13 ILE 127 111.691 -7.169 -4.363 1009 HG21 ILE 127 HG21 ILE 127 113.499 -7.016 -7.664 1010 HG22 ILE 127 HG22 ILE 127 112.487 -5.661 -8.219 1011 HG23 ILE 127 HG23 ILE 127 113.512 -5.473 -6.776 1012 HD11 ILE 127 HD11 ILE 127 112.840 -9.405 -4.685 1013 HD12 ILE 127 HD12 ILE 127 111.278 -9.260 -5.525 1014 HD13 ILE 127 HD13 ILE 127 112.798 -9.108 -6.439 1015 H PHE 128 H PHE 128 111.254 -3.117 -6.912 1016 HA PHE 128 HA PHE 128 109.144 -3.436 -9.044 1017 HB2 PHE 128 HB2 PHE 128 110.633 -0.909 -8.195 1018 HB3 PHE 128 HB3 PHE 128 109.195 -1.003 -9.234 1019 HD1 PHE 128 HD1 PHE 128 108.250 -3.420 -7.227 1020 HD2 PHE 128 HD2 PHE 128 109.213 0.738 -6.846 1021 HE1 PHE 128 HE1 PHE 128 106.780 -3.267 -5.238 1022 HE2 PHE 128 HE2 PHE 128 107.750 0.898 -4.850 1023 HZ PHE 128 HZ PHE 128 106.529 -1.105 -4.046 1024 H LYS 129 H LYS 129 109.770 -2.143 -11.129 1025 HA LYS 129 HA LYS 129 112.642 -2.116 -11.805 1026 HB2 LYS 129 HB2 LYS 129 112.153 -4.548 -11.972 1027 HB3 LYS 129 HB3 LYS 129 110.816 -4.196 -13.094 1028 HG2 LYS 129 HG2 LYS 129 112.300 -3.393 -14.779 1029 HG3 LYS 129 HG3 LYS 129 113.654 -3.251 -13.633 1030 HD2 LYS 129 HD3 LYS 129 113.614 -5.744 -13.347 1031 HD3 LYS 129 HD2 LYS 129 112.348 -5.835 -14.594 1032 HE2 LYS 129 HE2 LYS 129 113.908 -4.686 -16.193 1033 HE3 LYS 129 HE3 LYS 129 115.178 -4.753 -14.947 1034 HZ1 LYS 129 HZ1 LYS 129 115.318 -6.615 -16.463 1035 HZ2 LYS 129 HZ2 LYS 129 114.956 -7.147 -14.944 1036 HZ3 LYS 129 HZ3 LYS 129 113.780 -7.084 -16.098 1037 H LYS 130 H LYS 130 112.950 -1.353 -14.073 1038 HA LYS 130 HA LYS 130 111.341 0.859 -14.736 1039 HB2 LYS 130 HB2 LYS 130 113.136 -0.955 -16.344 1040 HB3 LYS 130 HB3 LYS 130 112.163 0.268 -17.196 1041 HG2 LYS 130 HG2 LYS 130 113.719 1.093 -14.748 1042 HG3 LYS 130 HG3 LYS 130 114.592 0.866 -16.282 1043 HD2 LYS 130 HD3 LYS 130 112.040 2.475 -16.277 1044 HD3 LYS 130 HD2 LYS 130 113.536 3.228 -15.673 1045 HE2 LYS 130 HE2 LYS 130 114.652 2.938 -17.758 1046 HE3 LYS 130 HE3 LYS 130 113.440 1.771 -18.338 1047 HZ1 LYS 130 HZ1 LYS 130 113.114 3.948 -19.307 1048 HZ2 LYS 130 HZ2 LYS 130 111.827 3.554 -18.354 1049 HZ3 LYS 130 HZ3 LYS 130 112.950 4.636 -17.817 1050 H ASP 131 H ASP 131 109.360 1.147 -15.663 1051 HA ASP 131 HA ASP 131 107.527 -1.034 -15.949 1052 HB2 ASP 131 HB2 ASP 131 106.098 0.593 -17.181 1053 HB3 ASP 131 HB3 ASP 131 106.797 1.312 -15.711 Start of MODEL 5 1 H1 ALA 1 H1 ALA 1 119.103 5.684 -10.383 2 H2 ALA 1 H2 ALA 1 118.638 7.266 -10.366 3 H3 ALA 1 H3 ALA 1 119.908 6.770 -9.438 4 HA ALA 1 HA ALA 1 118.466 5.404 -8.080 5 HB1 ALA 1 HB1 ALA 1 117.239 7.263 -6.989 6 HB2 ALA 1 HB2 ALA 1 117.527 8.289 -8.415 7 HB3 ALA 1 HB3 ALA 1 118.897 7.754 -7.413 8 H PHE 2 H PHE 2 116.000 5.412 -7.408 9 HA PHE 2 HA PHE 2 114.544 4.408 -9.756 10 HB2 PHE 2 HB3 PHE 2 114.374 4.115 -6.937 11 HB3 PHE 2 HB2 PHE 2 112.844 4.872 -7.441 12 HD1 PHE 2 HD1 PHE 2 115.157 2.356 -9.034 13 HD2 PHE 2 HD2 PHE 2 111.178 3.277 -7.703 14 HE1 PHE 2 HE1 PHE 2 114.354 0.182 -9.923 15 HE2 PHE 2 HE2 PHE 2 110.381 1.103 -8.584 16 HZ PHE 2 HZ PHE 2 111.969 -0.444 -9.695 17 H ASP 3 H ASP 3 115.362 7.287 -9.643 18 HA ASP 3 HA ASP 3 112.934 8.867 -9.241 19 HB2 ASP 3 HB2 ASP 3 115.280 9.789 -9.217 20 HB3 ASP 3 HB3 ASP 3 115.358 9.518 -10.975 21 H SER 4 H SER 4 111.379 7.528 -10.460 22 HA SER 4 HA SER 4 110.713 8.586 -13.002 23 HB2 SER 4 HB3 SER 4 111.444 6.096 -14.080 24 HB3 SER 4 HB2 SER 4 112.227 7.660 -14.411 25 HG SER 4 HG SER 4 113.465 5.706 -13.414 26 H THR 5 H THR 5 109.702 6.210 -14.289 27 HA THR 5 HA THR 5 107.542 5.572 -12.306 28 HB THR 5 HB THR 5 107.785 5.058 -15.304 29 HG1 THR 5 HG1 THR 5 106.143 6.696 -15.331 30 HG21 THR 5 HG21 THR 5 105.241 4.622 -14.964 31 HG22 THR 5 HG22 THR 5 106.375 3.333 -14.495 32 HG23 THR 5 HG23 THR 5 105.657 4.383 -13.250 33 H TRP 6 H TRP 6 107.079 3.460 -11.651 34 HA TRP 6 HA TRP 6 108.720 1.230 -12.774 35 HB2 TRP 6 HB3 TRP 6 108.782 1.844 -9.796 36 HB3 TRP 6 HB2 TRP 6 109.734 0.627 -10.679 37 HD1 TRP 6 HD1 TRP 6 109.344 4.466 -10.421 38 HE1 TRP 6 HE1 TRP 6 111.588 5.579 -11.032 39 HE3 TRP 6 HE3 TRP 6 111.958 0.312 -11.805 40 HZ2 TRP 6 HZ2 TRP 6 114.177 4.749 -12.006 41 HZ3 TRP 6 HZ3 TRP 6 114.305 0.492 -12.566 42 HH2 TRP 6 HH2 TRP 6 115.421 2.705 -12.669 43 H LYS 7 H LYS 7 108.020 -0.904 -11.672 44 HA LYS 7 HA LYS 7 105.361 -0.746 -10.340 45 HB2 LYS 7 HB3 LYS 7 104.137 -1.930 -12.019 46 HB3 LYS 7 HB2 LYS 7 104.997 -0.634 -12.885 47 HG2 LYS 7 HG2 LYS 7 106.860 -2.331 -13.322 48 HG3 LYS 7 HG3 LYS 7 105.748 -3.580 -12.713 49 HD2 LYS 7 HD2 LYS 7 104.064 -2.849 -14.426 50 HD3 LYS 7 HD3 LYS 7 105.268 -1.712 -15.077 51 HE2 LYS 7 HE3 LYS 7 106.114 -4.571 -14.732 52 HE3 LYS 7 HE2 LYS 7 104.983 -4.206 -16.057 53 HZ1 LYS 7 HZ1 LYS 7 107.274 -3.993 -16.758 54 HZ2 LYS 7 HZ2 LYS 7 107.572 -2.864 -15.594 55 HZ3 LYS 7 HZ3 LYS 7 106.524 -2.526 -16.822 56 H VAL 8 H VAL 8 105.197 -2.399 -8.893 57 HA VAL 8 HA VAL 8 107.265 -4.107 -8.197 58 HB VAL 8 HB VAL 8 105.445 -4.200 -6.739 59 HG11 VAL 8 HG11 VAL 8 103.726 -3.247 -8.112 60 HG12 VAL 8 HG12 VAL 8 103.113 -4.836 -7.595 61 HG13 VAL 8 HG13 VAL 8 103.765 -4.624 -9.238 62 HG21 VAL 8 HG21 VAL 8 104.860 -6.484 -6.551 63 HG22 VAL 8 HG22 VAL 8 104.835 -6.716 -8.316 64 HG23 VAL 8 HG23 VAL 8 106.386 -6.522 -7.466 65 H ASP 9 H ASP 9 108.483 -5.206 -9.627 66 HA ASP 9 HA ASP 9 107.123 -6.752 -11.804 67 HB2 ASP 9 HB2 ASP 9 109.117 -5.491 -12.450 68 HB3 ASP 9 HB3 ASP 9 110.061 -6.248 -11.145 69 H ARG 10 H ARG 10 108.834 -7.130 -8.745 70 HA ARG 10 HA ARG 10 107.961 -9.994 -8.741 71 HB2 ARG 10 HB2 ARG 10 110.841 -9.250 -8.097 72 HB3 ARG 10 HB3 ARG 10 110.137 -10.881 -8.206 73 HG2 ARG 10 HG3 ARG 10 109.592 -10.370 -10.639 74 HG3 ARG 10 HG2 ARG 10 110.563 -8.888 -10.469 75 HD2 ARG 10 HD2 ARG 10 111.519 -11.757 -10.073 76 HD3 ARG 10 HD3 ARG 10 111.980 -10.650 -11.388 77 HE ARG 10 HE ARG 10 112.716 -9.241 -9.100 78 HH11 ARG 10 HH11 ARG 10 114.743 -9.480 -8.129 79 HH12 ARG 10 HH12 ARG 10 115.643 -10.965 -8.339 80 HH21 ARG 10 HH21 ARG 10 113.212 -12.458 -10.335 81 HH22 ARG 10 HH22 ARG 10 114.781 -12.645 -9.583 82 H SER 11 H SER 11 108.269 -10.976 -6.526 83 HA SER 11 HA SER 11 108.799 -9.192 -4.258 84 HB2 SER 11 HB2 SER 11 106.698 -8.536 -3.637 85 HB3 SER 11 HB3 SER 11 106.314 -8.786 -5.357 86 HG SER 11 HG SER 11 105.851 -11.041 -4.701 87 H GLU 12 H GLU 12 107.833 -10.401 -2.153 88 HA GLU 12 HA GLU 12 107.676 -13.344 -2.588 89 HB2 GLU 12 HB3 GLU 12 109.710 -13.947 -1.714 90 HB3 GLU 12 HB2 GLU 12 110.189 -12.347 -2.327 91 HG2 GLU 12 HG2 GLU 12 109.507 -11.411 -0.041 92 HG3 GLU 12 HG3 GLU 12 109.402 -13.099 0.515 93 H ASN 13 H ASN 13 106.897 -14.470 -0.746 94 HA ASN 13 HA ASN 13 105.576 -14.674 1.192 95 HB2 ASN 13 HB3 ASN 13 107.546 -14.001 2.417 96 HB3 ASN 13 HB2 ASN 13 107.300 -12.292 1.984 97 HD21 ASN 13 HD21 ASN 13 107.143 -11.699 4.291 98 HD22 ASN 13 HD22 ASN 13 105.700 -12.087 5.201 99 H TYR 14 H TYR 14 105.554 -11.414 2.198 100 HA TYR 14 HA TYR 14 103.941 -9.698 1.945 101 HB2 TYR 14 HB2 TYR 14 104.043 -10.741 -0.580 102 HB3 TYR 14 HB3 TYR 14 102.355 -11.101 -0.150 103 HD1 TYR 14 HD1 TYR 14 104.493 -8.230 0.959 104 HD2 TYR 14 HD2 TYR 14 101.115 -9.505 -1.368 105 HE1 TYR 14 HE1 TYR 14 103.886 -5.862 0.542 106 HE2 TYR 14 HE2 TYR 14 100.505 -7.138 -1.781 107 HH TYR 14 HH TYR 14 102.207 -4.738 -1.702 108 H ASP 15 H ASP 15 102.461 -12.942 1.360 109 HA ASP 15 HA ASP 15 99.996 -12.312 2.691 110 HB2 ASP 15 HB2 ASP 15 101.505 -14.922 2.302 111 HB3 ASP 15 HB3 ASP 15 99.925 -14.853 3.119 112 H LYS 16 H LYS 16 102.940 -13.931 3.981 113 HA LYS 16 HA LYS 16 102.012 -14.066 6.693 114 HB2 LYS 16 HB2 LYS 16 104.887 -13.548 5.823 115 HB3 LYS 16 HB3 LYS 16 104.336 -14.339 7.319 116 HG2 LYS 16 HG2 LYS 16 103.559 -16.265 6.139 117 HG3 LYS 16 HG3 LYS 16 103.639 -15.431 4.569 118 HD2 LYS 16 HD2 LYS 16 105.544 -17.076 5.061 119 HD3 LYS 16 HD3 LYS 16 106.039 -15.434 4.584 120 HE2 LYS 16 HE2 LYS 16 107.247 -16.442 6.622 121 HE3 LYS 16 HE3 LYS 16 106.542 -14.823 6.845 122 HZ1 LYS 16 HZ1 LYS 16 106.083 -16.674 8.559 123 HZ2 LYS 16 HZ2 LYS 16 104.949 -17.189 7.478 124 HZ3 LYS 16 HZ3 LYS 16 104.856 -15.668 8.111 125 H PHE 17 H PHE 17 103.446 -11.430 4.808 126 HA PHE 17 HA PHE 17 103.837 -9.671 7.114 127 HB2 PHE 17 HB2 PHE 17 105.061 -9.259 5.064 128 HB3 PHE 17 HB3 PHE 17 103.555 -9.172 4.122 129 HD1 PHE 17 HD1 PHE 17 105.667 -7.484 6.620 130 HD2 PHE 17 HD2 PHE 17 102.150 -7.183 4.184 131 HE1 PHE 17 HE1 PHE 17 105.551 -5.056 7.098 132 HE2 PHE 17 HE2 PHE 17 102.024 -4.752 4.665 133 HZ PHE 17 HZ PHE 17 103.728 -3.687 6.122 134 H MET 18 H MET 18 101.478 -9.536 4.416 135 HA MET 18 HA MET 18 99.741 -7.629 5.648 136 HB2 MET 18 HB2 MET 18 99.010 -9.929 3.782 137 HB3 MET 18 HB3 MET 18 98.001 -8.501 4.112 138 HG2 MET 18 HG2 MET 18 100.797 -8.461 2.888 139 HG3 MET 18 HG3 MET 18 99.272 -8.225 2.001 140 HE1 MET 18 HE1 MET 18 100.552 -4.641 1.854 141 HE2 MET 18 HE2 MET 18 99.773 -5.998 1.007 142 HE3 MET 18 HE3 MET 18 101.431 -6.172 1.630 143 H GLU 19 H GLU 19 100.165 -11.070 6.258 144 HA GLU 19 HA GLU 19 97.599 -11.294 7.721 145 HB2 GLU 19 HB2 GLU 19 100.043 -13.119 7.617 146 HB3 GLU 19 HB3 GLU 19 98.494 -13.529 8.392 147 HG2 GLU 19 HG2 GLU 19 98.283 -12.545 5.592 148 HG3 GLU 19 HG3 GLU 19 99.107 -14.112 5.781 149 H LYS 20 H LYS 20 100.955 -10.506 8.428 150 HA LYS 20 HA LYS 20 100.692 -10.889 11.323 151 HB2 LYS 20 HB3 LYS 20 102.828 -10.581 9.681 152 HB3 LYS 20 HB2 LYS 20 102.662 -8.905 10.257 153 HG2 LYS 20 HG2 LYS 20 104.039 -9.827 11.911 154 HG3 LYS 20 HG3 LYS 20 102.426 -10.055 12.629 155 HD2 LYS 20 HD2 LYS 20 102.349 -12.365 11.835 156 HD3 LYS 20 HD3 LYS 20 103.885 -12.152 10.962 157 HE2 LYS 20 HE2 LYS 20 104.958 -11.587 13.200 158 HE3 LYS 20 HE3 LYS 20 103.439 -12.095 13.976 159 HZ1 LYS 20 HZ1 LYS 20 105.024 -13.899 13.857 160 HZ2 LYS 20 HZ2 LYS 20 105.110 -13.773 12.214 161 HZ3 LYS 20 HZ3 LYS 20 103.702 -14.245 12.932 162 H MET 21 H MET 21 100.226 -8.166 9.074 163 HA MET 21 HA MET 21 99.858 -6.210 11.229 164 HB2 MET 21 HB3 MET 21 98.554 -5.853 8.541 165 HB3 MET 21 HB2 MET 21 99.447 -4.677 9.534 166 HG2 MET 21 HG2 MET 21 101.480 -6.345 9.049 167 HG3 MET 21 HG3 MET 21 100.490 -6.759 7.629 168 HE1 MET 21 HE1 MET 21 99.926 -3.554 5.769 169 HE2 MET 21 HE2 MET 21 99.035 -3.562 7.310 170 HE3 MET 21 HE3 MET 21 99.229 -5.071 6.386 171 H GLY 22 H GLY 22 98.040 -8.848 10.197 172 HA2 GLY 22 HA3 GLY 22 95.890 -9.532 10.945 173 HA3 GLY 22 HA2 GLY 22 95.759 -8.009 11.856 174 H VAL 23 H VAL 23 96.476 -8.170 8.386 175 HA VAL 23 HA VAL 23 94.236 -6.360 7.821 176 HB VAL 23 HB VAL 23 95.903 -8.010 5.870 177 HG11 VAL 23 HG11 VAL 23 95.293 -6.197 4.291 178 HG12 VAL 23 HG12 VAL 23 94.320 -5.418 5.561 179 HG13 VAL 23 HG13 VAL 23 93.842 -7.010 4.924 180 HG21 VAL 23 HG21 VAL 23 97.337 -6.648 7.372 181 HG22 VAL 23 HG22 VAL 23 97.336 -5.990 5.718 182 HG23 VAL 23 HG23 VAL 23 96.367 -5.205 6.988 183 H ASN 24 H ASN 24 92.190 -6.861 7.109 184 HA ASN 24 HA ASN 24 90.954 -9.316 7.595 185 HB2 ASN 24 HB2 ASN 24 90.414 -7.330 5.347 186 HB3 ASN 24 HB3 ASN 24 89.327 -8.684 5.740 187 HD21 ASN 24 HD21 ASN 24 88.606 -8.764 8.146 188 HD22 ASN 24 HD22 ASN 24 88.319 -7.225 8.927 189 H ILE 25 H ILE 25 90.288 -11.101 6.143 190 HA ILE 25 HA ILE 25 92.596 -11.971 4.507 191 HB ILE 25 HB ILE 25 90.002 -13.185 5.436 192 HG12 ILE 25 HG12 ILE 25 92.353 -13.236 6.588 193 HG13 ILE 25 HG13 ILE 25 91.424 -14.750 6.477 194 HG21 ILE 25 HG21 ILE 25 90.550 -15.203 3.999 195 HG22 ILE 25 HG22 ILE 25 91.702 -14.177 3.110 196 HG23 ILE 25 HG23 ILE 25 89.965 -13.788 3.092 197 HD11 ILE 25 HD11 ILE 25 93.955 -14.759 5.775 198 HD12 ILE 25 HD12 ILE 25 93.368 -13.985 4.283 199 HD13 ILE 25 HD13 ILE 25 92.774 -15.599 4.742 200 H VAL 26 H VAL 26 90.039 -9.981 3.983 201 HA VAL 26 HA VAL 26 89.438 -10.849 1.204 202 HB VAL 26 HB VAL 26 88.665 -8.316 2.722 203 HG11 VAL 26 HG11 VAL 26 88.567 -8.075 0.256 204 HG12 VAL 26 HG12 VAL 26 87.588 -9.557 0.150 205 HG13 VAL 26 HG13 VAL 26 86.933 -8.113 0.959 206 HG21 VAL 26 HG21 VAL 26 87.800 -10.392 3.770 207 HG22 VAL 26 HG22 VAL 26 87.140 -10.909 2.200 208 HG23 VAL 26 HG23 VAL 26 86.485 -9.465 3.009 209 H LYS 27 H LYS 27 90.737 -7.834 2.680 210 HA LYS 27 HA LYS 27 91.802 -6.826 0.193 211 HB2 LYS 27 HB2 LYS 27 92.860 -6.350 3.018 212 HB3 LYS 27 HB3 LYS 27 93.135 -5.315 1.596 213 HG2 LYS 27 HG2 LYS 27 90.300 -5.962 2.399 214 HG3 LYS 27 HG3 LYS 27 91.199 -4.741 3.332 215 HD2 LYS 27 HD3 LYS 27 91.718 -3.541 1.199 216 HD3 LYS 27 HD2 LYS 27 90.732 -4.731 0.316 217 HE2 LYS 27 HE2 LYS 27 89.375 -2.745 0.776 218 HE3 LYS 27 HE3 LYS 27 88.771 -4.105 1.754 219 HZ1 LYS 27 HZ1 LYS 27 88.999 -2.100 3.062 220 HZ2 LYS 27 HZ2 LYS 27 90.604 -1.993 2.699 221 HZ3 LYS 27 HZ3 LYS 27 90.046 -3.252 3.606 222 H ARG 28 H ARG 28 92.973 -9.142 2.566 223 HA ARG 28 HA ARG 28 95.739 -9.188 1.650 224 HB2 ARG 28 HB2 ARG 28 94.907 -10.129 3.841 225 HB3 ARG 28 HB3 ARG 28 94.130 -11.444 2.928 226 HG2 ARG 28 HG3 ARG 28 96.634 -11.571 1.871 227 HG3 ARG 28 HG2 ARG 28 97.026 -10.958 3.495 228 HD2 ARG 28 HD2 ARG 28 97.052 -13.300 3.792 229 HD3 ARG 28 HD3 ARG 28 95.420 -12.845 4.338 230 HE ARG 28 HE ARG 28 94.947 -13.384 1.689 231 HH11 ARG 28 HH11 ARG 28 94.613 -15.449 0.834 232 HH12 ARG 28 HH12 ARG 28 95.303 -16.847 1.628 233 HH21 ARG 28 HH21 ARG 28 96.789 -14.989 4.171 234 HH22 ARG 28 HH22 ARG 28 96.529 -16.588 3.509 235 H LYS 29 H LYS 29 92.906 -11.311 0.959 236 HA LYS 29 HA LYS 29 94.212 -13.015 -0.920 237 HB2 LYS 29 HB3 LYS 29 91.529 -12.482 -0.074 238 HB3 LYS 29 HB2 LYS 29 91.541 -12.423 -1.853 239 HG2 LYS 29 HG2 LYS 29 92.784 -14.680 -0.222 240 HG3 LYS 29 HG3 LYS 29 91.138 -14.735 -0.896 241 HD2 LYS 29 HD2 LYS 29 92.362 -14.081 -3.153 242 HD3 LYS 29 HD3 LYS 29 93.795 -14.746 -2.333 243 HE2 LYS 29 HE2 LYS 29 91.252 -16.136 -3.173 244 HE3 LYS 29 HE3 LYS 29 92.942 -16.666 -3.353 245 HZ1 LYS 29 HZ1 LYS 29 92.115 -17.947 -1.634 246 HZ2 LYS 29 HZ2 LYS 29 91.260 -16.715 -0.950 247 HZ3 LYS 29 HZ3 LYS 29 92.904 -16.745 -0.826 248 H LEU 30 H LEU 30 92.851 -9.754 -1.318 249 HA LEU 30 HA LEU 30 93.420 -9.817 -4.238 250 HB2 LEU 30 HB2 LEU 30 92.560 -7.455 -2.522 251 HB3 LEU 30 HB3 LEU 30 92.457 -7.596 -4.293 252 HG LEU 30 HG LEU 30 90.926 -9.225 -2.221 253 HD11 LEU 30 HD11 LEU 30 90.036 -6.962 -2.705 254 HD12 LEU 30 HD12 LEU 30 88.961 -8.224 -3.353 255 HD13 LEU 30 HD13 LEU 30 90.046 -7.330 -4.446 256 HD21 LEU 30 HD21 LEU 30 89.843 -10.051 -4.512 257 HD22 LEU 30 HD22 LEU 30 91.299 -10.841 -3.860 258 HD23 LEU 30 HD23 LEU 30 91.447 -9.636 -5.162 259 H ALA 31 H ALA 31 95.058 -9.163 -1.376 260 HA ALA 31 HA ALA 31 96.852 -7.071 -2.407 261 HB1 ALA 31 HB1 ALA 31 98.261 -8.039 -0.353 262 HB2 ALA 31 HB2 ALA 31 96.708 -8.812 0.044 263 HB3 ALA 31 HB3 ALA 31 96.814 -7.040 -0.083 264 H ALA 32 H ALA 32 97.144 -10.613 -1.847 265 HA ALA 32 HA ALA 32 99.788 -11.067 -2.580 266 HB1 ALA 32 HB1 ALA 32 99.051 -13.222 -3.560 267 HB2 ALA 32 HB2 ALA 32 97.375 -12.624 -3.614 268 HB3 ALA 32 HB3 ALA 32 98.180 -12.876 -2.047 269 H HIS 33 H HIS 33 97.295 -9.707 -4.587 270 HA HIS 33 HA HIS 33 98.538 -10.349 -7.158 271 HB2 HIS 33 HB2 HIS 33 96.444 -8.403 -6.187 272 HB3 HIS 33 HB3 HIS 33 97.133 -8.197 -7.815 273 HD2 HIS 33 HD2 HIS 33 96.874 -10.710 -9.428 274 HE1 HIS 33 HE1 HIS 33 93.471 -11.960 -7.262 275 HE2 HIS 33 HE2 HIS 33 94.834 -12.362 -9.384 276 H ASP 34 H ASP 34 100.587 -9.554 -5.468 277 HA ASP 34 HA ASP 34 101.290 -6.808 -5.423 278 HB2 ASP 34 HB2 ASP 34 103.667 -8.278 -6.030 279 HB3 ASP 34 HB3 ASP 34 103.088 -7.748 -4.432 280 H ASN 35 H ASN 35 100.349 -6.022 -7.478 281 HA ASN 35 HA ASN 35 102.445 -6.048 -9.613 282 HB2 ASN 35 HB3 ASN 35 100.972 -6.712 -11.372 283 HB3 ASN 35 HB2 ASN 35 100.700 -7.894 -10.070 284 HD21 ASN 35 HD21 ASN 35 98.705 -7.689 -8.778 285 HD22 ASN 35 HD22 ASN 35 97.352 -6.765 -9.393 286 H LEU 36 H LEU 36 101.767 -3.990 -7.790 287 HA LEU 36 HA LEU 36 99.929 -2.185 -9.317 288 HB2 LEU 36 HB2 LEU 36 100.021 -0.729 -7.379 289 HB3 LEU 36 HB3 LEU 36 99.764 -2.394 -6.810 290 HG LEU 36 HG LEU 36 102.608 -1.493 -7.076 291 HD11 LEU 36 HD11 LEU 36 101.513 0.495 -6.074 292 HD12 LEU 36 HD12 LEU 36 100.760 -0.543 -4.840 293 HD13 LEU 36 HD13 LEU 36 102.529 -0.346 -4.879 294 HD21 LEU 36 HD21 LEU 36 101.983 -2.637 -4.544 295 HD22 LEU 36 HD22 LEU 36 102.802 -3.423 -5.915 296 HD23 LEU 36 HD23 LEU 36 101.033 -3.539 -5.749 297 H LYS 37 H LYS 37 100.651 0.148 -9.525 298 HA LYS 37 HA LYS 37 103.490 0.166 -10.556 299 HB2 LYS 37 HB2 LYS 37 101.054 1.876 -11.226 300 HB3 LYS 37 HB3 LYS 37 102.690 2.193 -11.850 301 HG2 LYS 37 HG2 LYS 37 102.453 -0.459 -12.450 302 HG3 LYS 37 HG3 LYS 37 100.750 0.042 -12.575 303 HD2 LYS 37 HD2 LYS 37 103.062 1.474 -13.955 304 HD3 LYS 37 HD3 LYS 37 102.034 0.252 -14.740 305 HE2 LYS 37 HE2 LYS 37 100.725 2.581 -13.341 306 HE3 LYS 37 HE3 LYS 37 101.447 2.836 -14.948 307 HZ1 LYS 37 HZ1 LYS 37 99.141 2.172 -15.103 308 HZ2 LYS 37 HZ2 LYS 37 100.110 1.013 -15.765 309 HZ3 LYS 37 HZ3 LYS 37 99.441 0.777 -14.276 310 H LEU 38 H LEU 38 104.901 1.834 -9.904 311 HA LEU 38 HA LEU 38 103.807 3.771 -7.872 312 HB2 LEU 38 HB2 LEU 38 106.417 2.270 -7.444 313 HB3 LEU 38 HB3 LEU 38 105.532 3.285 -6.282 314 HG LEU 38 HG LEU 38 103.586 1.499 -6.796 315 HD11 LEU 38 HD11 LEU 38 104.946 0.245 -8.451 316 HD12 LEU 38 HD12 LEU 38 104.559 -0.766 -7.039 317 HD13 LEU 38 HD13 LEU 38 106.182 -0.055 -7.206 318 HD21 LEU 38 HD21 LEU 38 104.236 1.798 -4.553 319 HD22 LEU 38 HD22 LEU 38 105.933 1.377 -4.887 320 HD23 LEU 38 HD23 LEU 38 104.690 0.104 -4.859 321 H THR 39 H THR 39 104.451 5.793 -8.385 322 HA THR 39 HA THR 39 106.827 6.069 -10.227 323 HB THR 39 HB THR 39 104.767 8.187 -9.476 324 HG1 THR 39 HG1 THR 39 103.809 7.582 -11.499 325 HG21 THR 39 HG21 THR 39 105.569 9.240 -11.573 326 HG22 THR 39 HG22 THR 39 106.714 7.897 -11.809 327 HG23 THR 39 HG23 THR 39 106.908 9.000 -10.425 328 H ILE 40 H ILE 40 108.701 6.461 -9.135 329 HA ILE 40 HA ILE 40 108.482 7.946 -6.521 330 HB ILE 40 HB ILE 40 110.749 6.276 -7.694 331 HG12 ILE 40 HG13 ILE 40 110.089 4.840 -5.641 332 HG13 ILE 40 HG12 ILE 40 108.584 5.788 -5.619 333 HG21 ILE 40 HG21 ILE 40 111.562 8.106 -6.230 334 HG22 ILE 40 HG22 ILE 40 110.419 7.598 -4.962 335 HG23 ILE 40 HG23 ILE 40 111.755 6.523 -5.439 336 HD11 ILE 40 HD11 ILE 40 108.959 3.491 -7.095 337 HD12 ILE 40 HD12 ILE 40 109.341 4.751 -8.294 338 HD13 ILE 40 HD13 ILE 40 107.760 4.750 -7.477 339 H THR 41 H THR 41 109.050 10.026 -6.464 340 HA THR 41 HA THR 41 110.972 11.025 -8.578 341 HB THR 41 HB THR 41 109.092 12.874 -7.126 342 HG1 THR 41 HG1 THR 41 107.648 11.333 -7.801 343 HG21 THR 41 HG21 THR 41 109.164 14.032 -9.317 344 HG22 THR 41 HG22 THR 41 110.805 13.737 -8.695 345 HG23 THR 41 HG23 THR 41 110.143 12.705 -9.986 346 H GLN 42 H GLN 42 112.545 12.602 -7.826 347 HA GLN 42 HA GLN 42 112.751 12.732 -4.810 348 HB2 GLN 42 HB3 GLN 42 115.148 12.315 -4.947 349 HB3 GLN 42 HB2 GLN 42 114.294 10.992 -5.776 350 HG2 GLN 42 HG2 GLN 42 114.602 12.422 -7.930 351 HG3 GLN 42 HG3 GLN 42 115.818 13.319 -6.989 352 HE21 GLN 42 HE21 GLN 42 117.181 12.246 -8.887 353 HE22 GLN 42 HE22 GLN 42 117.868 10.682 -8.510 354 H GLU 43 H GLU 43 113.403 14.716 -3.998 355 HA GLU 43 HA GLU 43 114.391 16.742 -6.006 356 HB2 GLU 43 HB2 GLU 43 112.285 17.338 -3.883 357 HB3 GLU 43 HB3 GLU 43 112.878 18.435 -5.153 358 HG2 GLU 43 HG3 GLU 43 111.516 15.780 -5.761 359 HG3 GLU 43 HG2 GLU 43 110.628 17.317 -5.628 360 H GLY 44 H GLY 44 116.453 16.151 -4.935 361 HA2 GLY 44 HA3 GLY 44 118.151 16.605 -3.359 362 HA3 GLY 44 HA2 GLY 44 117.234 18.080 -2.975 363 H ASN 45 H ASN 45 115.705 18.029 -1.244 364 HA ASN 45 HA ASN 45 116.081 15.647 0.590 365 HB2 ASN 45 HB2 ASN 45 115.896 17.167 2.476 366 HB3 ASN 45 HB3 ASN 45 117.130 17.809 1.367 367 HD21 ASN 45 HD21 ASN 45 116.047 19.344 -0.440 368 HD22 ASN 45 HD22 ASN 45 114.897 20.497 0.199 369 H LYS 46 H LYS 46 113.983 16.123 -1.499 370 HA LYS 46 HA LYS 46 111.681 15.597 0.315 371 HB2 LYS 46 HB3 LYS 46 111.900 17.978 -1.542 372 HB3 LYS 46 HB2 LYS 46 110.317 17.210 -1.273 373 HG2 LYS 46 HG2 LYS 46 110.153 18.482 0.599 374 HG3 LYS 46 HG3 LYS 46 111.408 17.436 1.305 375 HD2 LYS 46 HD2 LYS 46 112.315 19.604 1.556 376 HD3 LYS 46 HD3 LYS 46 113.089 19.014 0.065 377 HE2 LYS 46 HE3 LYS 46 112.206 21.338 -0.186 378 HE3 LYS 46 HE2 LYS 46 111.417 20.196 -1.300 379 HZ1 LYS 46 HZ1 LYS 46 110.033 21.811 0.183 380 HZ2 LYS 46 HZ2 LYS 46 110.216 20.626 1.315 381 HZ3 LYS 46 HZ3 LYS 46 109.494 20.284 -0.128 382 H PHE 47 H PHE 47 111.151 13.677 -0.440 383 HA PHE 47 HA PHE 47 111.302 13.164 -3.400 384 HB2 PHE 47 HB2 PHE 47 111.161 11.383 -0.945 385 HB3 PHE 47 HB3 PHE 47 110.848 10.747 -2.578 386 HD1 PHE 47 HD1 PHE 47 113.336 13.048 -0.923 387 HD2 PHE 47 HD2 PHE 47 112.675 9.783 -3.637 388 HE1 PHE 47 HE1 PHE 47 115.778 12.886 -1.324 389 HE2 PHE 47 HE2 PHE 47 115.117 9.621 -4.036 390 HZ PHE 47 HZ PHE 47 116.669 11.173 -2.880 391 H THR 48 H THR 48 109.470 11.581 -4.143 392 HA THR 48 HA THR 48 106.875 12.100 -2.779 393 HB THR 48 HB THR 48 107.378 12.969 -5.661 394 HG1 THR 48 HG1 THR 48 108.272 14.401 -4.080 395 HG21 THR 48 HG21 THR 48 105.072 13.863 -5.495 396 HG22 THR 48 HG22 THR 48 104.939 13.213 -3.843 397 HG23 THR 48 HG23 THR 48 105.097 12.104 -5.226 398 H VAL 49 H VAL 49 106.427 9.967 -2.580 399 HA VAL 49 HA VAL 49 106.812 8.169 -4.950 400 HB VAL 49 HB VAL 49 105.862 7.517 -2.125 401 HG11 VAL 49 HG11 VAL 49 105.254 5.839 -3.850 402 HG12 VAL 49 HG12 VAL 49 106.504 5.205 -2.753 403 HG13 VAL 49 HG13 VAL 49 106.952 5.770 -4.381 404 HG21 VAL 49 HG21 VAL 49 108.194 6.752 -1.756 405 HG22 VAL 49 HG22 VAL 49 108.139 8.492 -2.127 406 HG23 VAL 49 HG23 VAL 49 108.639 7.330 -3.379 407 H LYS 50 H LYS 50 105.130 8.201 -6.373 408 HA LYS 50 HA LYS 50 102.362 8.588 -5.240 409 HB2 LYS 50 HB3 LYS 50 103.433 9.952 -7.249 410 HB3 LYS 50 HB2 LYS 50 102.970 8.517 -8.194 411 HG2 LYS 50 HG2 LYS 50 100.655 8.804 -6.948 412 HG3 LYS 50 HG3 LYS 50 101.214 10.476 -6.709 413 HD2 LYS 50 HD2 LYS 50 101.498 10.781 -9.112 414 HD3 LYS 50 HD3 LYS 50 101.127 9.066 -9.412 415 HE2 LYS 50 HE2 LYS 50 99.141 10.794 -7.926 416 HE3 LYS 50 HE3 LYS 50 99.229 10.877 -9.702 417 HZ1 LYS 50 HZ1 LYS 50 97.655 9.214 -8.966 418 HZ2 LYS 50 HZ2 LYS 50 98.825 8.418 -8.118 419 HZ3 LYS 50 HZ3 LYS 50 98.907 8.495 -9.764 420 H GLU 51 H GLU 51 101.698 6.544 -4.586 421 HA GLU 51 HA GLU 51 102.315 4.148 -6.164 422 HB2 GLU 51 HB2 GLU 51 100.190 4.608 -4.021 423 HB3 GLU 51 HB3 GLU 51 100.726 3.025 -4.634 424 HG2 GLU 51 HG3 GLU 51 103.008 3.456 -3.828 425 HG3 GLU 51 HG2 GLU 51 102.528 5.080 -3.280 426 H SER 52 H SER 52 100.654 2.821 -7.272 427 HA SER 52 HA SER 52 98.097 4.124 -7.947 428 HB2 SER 52 HB3 SER 52 100.018 3.632 -10.246 429 HB3 SER 52 HB2 SER 52 98.489 4.543 -10.255 430 HG SER 52 HG SER 52 100.501 5.831 -10.154 431 H SER 53 H SER 53 96.931 2.379 -7.570 432 HA SER 53 HA SER 53 97.555 -0.089 -9.183 433 HB2 SER 53 HB3 SER 53 97.814 -1.331 -7.310 434 HB3 SER 53 HB2 SER 53 97.687 0.151 -6.332 435 HG SER 53 HG SER 53 96.052 -1.413 -5.807 436 H ALA 54 H ALA 54 95.685 -1.113 -9.998 437 HA ALA 54 HA ALA 54 93.387 0.537 -10.441 438 HB1 ALA 54 HB1 ALA 54 92.285 -1.543 -11.222 439 HB2 ALA 54 HB2 ALA 54 93.576 -2.509 -10.467 440 HB3 ALA 54 HB3 ALA 54 93.952 -1.434 -11.834 441 H PHE 55 H PHE 55 94.353 -0.415 -7.497 442 HA PHE 55 HA PHE 55 91.541 -1.021 -6.570 443 HB2 PHE 55 HB2 PHE 55 94.065 -1.508 -4.962 444 HB3 PHE 55 HB3 PHE 55 92.454 -2.236 -4.751 445 HD1 PHE 55 HD1 PHE 55 95.605 -3.095 -5.688 446 HD2 PHE 55 HD2 PHE 55 91.624 -3.171 -7.299 447 HE1 PHE 55 HE1 PHE 55 96.251 -4.956 -7.195 448 HE2 PHE 55 HE2 PHE 55 92.270 -5.032 -8.807 449 HZ PHE 55 HZ PHE 55 94.583 -5.926 -8.753 450 H ARG 56 H ARG 56 94.242 1.244 -6.273 451 HA ARG 56 HA ARG 56 92.719 3.330 -5.166 452 HB2 ARG 56 HB3 ARG 56 93.430 3.203 -2.706 453 HB3 ARG 56 HB2 ARG 56 92.161 2.059 -3.204 454 HG2 ARG 56 HG3 ARG 56 94.336 0.534 -3.729 455 HG3 ARG 56 HG2 ARG 56 95.007 1.540 -2.422 456 HD2 ARG 56 HD2 ARG 56 92.369 0.019 -2.246 457 HD3 ARG 56 HD3 ARG 56 93.916 -0.571 -1.592 458 HE ARG 56 HE ARG 56 93.747 1.885 -0.381 459 HH11 ARG 56 HH11 ARG 56 92.559 2.324 1.491 460 HH12 ARG 56 HH12 ARG 56 91.161 1.350 1.887 461 HH21 ARG 56 HH21 ARG 56 91.460 -0.682 -0.924 462 HH22 ARG 56 HH22 ARG 56 90.541 -0.345 0.526 463 H ASN 57 H ASN 57 94.290 4.315 -6.555 464 HA ASN 57 HA ASN 57 97.138 4.126 -6.116 465 HB2 ASN 57 HB2 ASN 57 97.282 6.174 -7.464 466 HB3 ASN 57 HB3 ASN 57 96.066 5.083 -8.170 467 HD21 ASN 57 HD21 ASN 57 96.504 8.276 -7.706 468 HD22 ASN 57 HD22 ASN 57 94.869 8.773 -7.329 469 H ILE 58 H ILE 58 98.561 5.499 -4.945 470 HA ILE 58 HA ILE 58 97.238 7.426 -3.049 471 HB ILE 58 HB ILE 58 99.427 5.628 -2.039 472 HG12 ILE 58 HG12 ILE 58 96.500 4.913 -2.401 473 HG13 ILE 58 HG13 ILE 58 97.938 3.957 -2.837 474 HG21 ILE 58 HG21 ILE 58 98.309 7.734 -0.892 475 HG22 ILE 58 HG22 ILE 58 98.624 6.269 0.068 476 HG23 ILE 58 HG23 ILE 58 96.985 6.596 -0.543 477 HD11 ILE 58 HD11 ILE 58 97.276 2.937 -0.831 478 HD12 ILE 58 HD12 ILE 58 98.479 4.119 -0.262 479 HD13 ILE 58 HD13 ILE 58 96.742 4.475 -0.111 480 H GLU 59 H GLU 59 99.029 8.596 -1.771 481 HA GLU 59 HA GLU 59 101.569 8.899 -3.310 482 HB2 GLU 59 HB3 GLU 59 101.269 11.139 -3.936 483 HB3 GLU 59 HB2 GLU 59 99.648 10.462 -4.224 484 HG2 GLU 59 HG2 GLU 59 99.171 11.159 -1.749 485 HG3 GLU 59 HG3 GLU 59 100.605 12.198 -1.931 486 H CYS 60 H CYS 60 103.238 9.606 -1.992 487 HA CYS 60 HA CYS 60 102.562 10.790 0.665 488 HB2 CYS 60 HB2 CYS 60 104.171 8.208 0.467 489 HB3 CYS 60 HB3 CYS 60 103.705 9.073 1.951 490 HG CYS 60 HG CYS 60 100.878 8.646 0.413 491 H VAL 61 H VAL 61 104.057 12.334 1.092 492 HA VAL 61 HA VAL 61 106.422 12.574 -0.645 493 HB VAL 61 HB VAL 61 106.187 14.138 1.909 494 HG11 VAL 61 HG11 VAL 61 106.845 15.973 0.372 495 HG12 VAL 61 HG12 VAL 61 106.736 14.853 -1.007 496 HG13 VAL 61 HG13 VAL 61 107.968 14.598 0.252 497 HG21 VAL 61 HG21 VAL 61 104.511 15.636 0.618 498 HG22 VAL 61 HG22 VAL 61 104.214 14.206 -0.400 499 HG23 VAL 61 HG23 VAL 61 103.873 14.142 1.345 500 H PHE 62 H PHE 62 108.634 12.412 0.041 501 HA PHE 62 HA PHE 62 109.011 10.992 2.677 502 HB2 PHE 62 HB3 PHE 62 109.316 9.118 1.388 503 HB3 PHE 62 HB2 PHE 62 109.669 10.059 -0.079 504 HD1 PHE 62 HD1 PHE 62 111.319 10.205 3.289 505 HD2 PHE 62 HD2 PHE 62 111.709 9.194 -0.868 506 HE1 PHE 62 HE1 PHE 62 113.745 9.808 3.612 507 HE2 PHE 62 HE2 PHE 62 114.135 8.797 -0.543 508 HZ PHE 62 HZ PHE 62 115.153 9.105 1.698 509 H GLU 63 H GLU 63 110.314 12.226 3.883 510 HA GLU 63 HA GLU 63 112.569 13.679 2.479 511 HB2 GLU 63 HB2 GLU 63 110.872 15.312 3.152 512 HB3 GLU 63 HB3 GLU 63 110.831 14.635 4.798 513 HG2 GLU 63 HG3 GLU 63 112.974 15.462 5.327 514 HG3 GLU 63 HG2 GLU 63 113.435 15.631 3.616 515 H LEU 64 H LEU 64 114.349 14.259 4.142 516 HA LEU 64 HA LEU 64 114.740 11.809 5.853 517 HB2 LEU 64 HB3 LEU 64 116.760 13.903 4.938 518 HB3 LEU 64 HB2 LEU 64 117.126 12.379 5.782 519 HG LEU 64 HG LEU 64 115.545 12.312 3.210 520 HD11 LEU 64 HD11 LEU 64 117.673 12.124 1.952 521 HD12 LEU 64 HD12 LEU 64 118.583 12.469 3.442 522 HD13 LEU 64 HD13 LEU 64 117.531 13.717 2.733 523 HD21 LEU 64 HD21 LEU 64 116.669 10.107 3.037 524 HD22 LEU 64 HD22 LEU 64 115.811 10.268 4.588 525 HD23 LEU 64 HD23 LEU 64 117.580 10.456 4.527 526 H GLY 65 H GLY 65 114.695 11.973 8.030 527 HA2 GLY 65 HA2 GLY 65 114.915 12.969 10.175 528 HA3 GLY 65 HA3 GLY 65 115.592 14.419 9.400 529 H VAL 66 H VAL 66 112.494 13.116 8.349 530 HA VAL 66 HA VAL 66 111.055 15.145 10.031 531 HB VAL 66 HB VAL 66 111.030 15.046 6.985 532 HG11 VAL 66 HG11 VAL 66 108.721 15.219 7.870 533 HG12 VAL 66 HG12 VAL 66 109.219 16.580 8.903 534 HG13 VAL 66 HG13 VAL 66 109.240 16.754 7.132 535 HG21 VAL 66 HG21 VAL 66 112.832 16.391 8.033 536 HG22 VAL 66 HG22 VAL 66 111.639 17.437 7.227 537 HG23 VAL 66 HG23 VAL 66 111.618 17.264 8.998 538 H THR 67 H THR 67 109.779 13.659 11.094 539 HA THR 67 HA THR 67 108.782 11.224 9.949 540 HB THR 67 HB THR 67 107.109 12.678 11.968 541 HG1 THR 67 HG1 THR 67 109.130 13.250 12.694 542 HG21 THR 67 HG21 THR 67 107.150 10.439 13.031 543 HG22 THR 67 HG22 THR 67 106.642 10.332 11.328 544 HG23 THR 67 HG23 THR 67 108.298 9.873 11.794 545 H PHE 68 H PHE 68 106.982 10.706 8.865 546 HA PHE 68 HA PHE 68 104.869 12.764 8.411 547 HB2 PHE 68 HB3 PHE 68 105.060 11.879 5.860 548 HB3 PHE 68 HB2 PHE 68 105.894 13.343 6.431 549 HD1 PHE 68 HD1 PHE 68 106.387 9.618 6.256 550 HD2 PHE 68 HD2 PHE 68 108.184 13.515 6.103 551 HE1 PHE 68 HE1 PHE 68 108.577 8.588 5.705 552 HE2 PHE 68 HE2 PHE 68 110.372 12.486 5.556 553 HZ PHE 68 HZ PHE 68 110.565 10.024 5.356 554 H ASN 69 H ASN 69 103.319 11.389 6.582 555 HA ASN 69 HA ASN 69 103.203 8.599 7.700 556 HB2 ASN 69 HB2 ASN 69 100.776 8.824 8.106 557 HB3 ASN 69 HB3 ASN 69 101.697 9.995 9.080 558 HD21 ASN 69 HD21 ASN 69 100.424 11.863 9.159 559 HD22 ASN 69 HD22 ASN 69 99.703 12.619 7.756 560 H CYS 70 H CYS 70 102.193 7.089 6.378 561 HA CYS 70 HA CYS 70 101.192 8.052 3.710 562 HB2 CYS 70 HB2 CYS 70 103.617 7.402 3.481 563 HB3 CYS 70 HB3 CYS 70 103.198 5.779 4.082 564 HG CYS 70 HG CYS 70 102.411 4.839 1.753 565 H ASN 71 H ASN 71 100.113 6.040 2.572 566 HA ASN 71 HA ASN 71 98.926 4.324 4.765 567 HB2 ASN 71 HB2 ASN 71 97.519 5.661 2.418 568 HB3 ASN 71 HB3 ASN 71 96.774 4.405 3.435 569 HD21 ASN 71 HD21 ASN 71 95.189 5.810 4.418 570 HD22 ASN 71 HD22 ASN 71 95.651 7.100 5.506 571 H LEU 72 H LEU 72 98.626 2.172 4.294 572 HA LEU 72 HA LEU 72 99.939 1.238 1.765 573 HB2 LEU 72 HB2 LEU 72 98.960 -0.264 4.236 574 HB3 LEU 72 HB3 LEU 72 99.793 -1.013 2.852 575 HG LEU 72 HG LEU 72 100.950 1.255 4.532 576 HD11 LEU 72 HD11 LEU 72 100.701 -0.826 5.858 577 HD12 LEU 72 HD12 LEU 72 101.534 -1.740 4.579 578 HD13 LEU 72 HD13 LEU 72 102.413 -0.497 5.501 579 HD21 LEU 72 HD21 LEU 72 101.794 1.112 2.202 580 HD22 LEU 72 HD22 LEU 72 102.173 -0.610 2.446 581 HD23 LEU 72 HD23 LEU 72 103.051 0.633 3.368 582 H ALA 73 H ALA 73 98.866 -0.089 0.251 583 HA ALA 73 HA ALA 73 96.228 0.488 -0.457 584 HB1 ALA 73 HB1 ALA 73 96.200 -1.667 -1.683 585 HB2 ALA 73 HB2 ALA 73 97.771 -0.849 -1.860 586 HB3 ALA 73 HB3 ALA 73 97.604 -2.221 -0.738 587 H ASP 74 H ASP 74 97.320 -1.696 2.086 588 HA ASP 74 HA ASP 74 94.748 -3.045 2.420 589 HB2 ASP 74 HB3 ASP 74 97.035 -2.591 4.391 590 HB3 ASP 74 HB2 ASP 74 95.676 -3.714 4.636 591 H GLY 75 H GLY 75 94.975 0.048 2.354 592 HA2 GLY 75 HA2 GLY 75 93.801 1.814 3.399 593 HA3 GLY 75 HA3 GLY 75 92.786 0.566 4.162 594 H THR 76 H THR 76 96.290 0.666 4.564 595 HA THR 76 HA THR 76 95.821 1.169 7.491 596 HB THR 76 HB THR 76 98.560 0.526 6.600 597 HG1 THR 76 HG1 THR 76 97.457 -0.699 5.058 598 HG21 THR 76 HG21 THR 76 96.764 -1.090 8.427 599 HG22 THR 76 HG22 THR 76 98.527 -0.860 8.508 600 HG23 THR 76 HG23 THR 76 97.435 0.471 8.958 601 H GLU 77 H GLU 77 97.419 2.572 8.603 602 HA GLU 77 HA GLU 77 98.558 4.690 6.775 603 HB2 GLU 77 HB2 GLU 77 96.368 5.422 7.807 604 HB3 GLU 77 HB3 GLU 77 97.122 5.236 9.409 605 HG2 GLU 77 HG2 GLU 77 98.726 6.953 8.966 606 HG3 GLU 77 HG3 GLU 77 98.362 6.949 7.224 607 H LEU 78 H LEU 78 100.739 4.651 7.113 608 HA LEU 78 HA LEU 78 101.659 4.121 9.954 609 HB2 LEU 78 HB3 LEU 78 103.736 3.702 7.956 610 HB3 LEU 78 HB2 LEU 78 103.098 2.569 9.169 611 HG LEU 78 HG LEU 78 102.750 1.669 6.914 612 HD11 LEU 78 HD11 LEU 78 100.824 0.793 7.684 613 HD12 LEU 78 HD12 LEU 78 100.709 2.119 8.865 614 HD13 LEU 78 HD13 LEU 78 99.956 2.288 7.261 615 HD21 LEU 78 HD21 LEU 78 102.280 3.025 5.179 616 HD22 LEU 78 HD22 LEU 78 102.187 4.407 6.297 617 HD23 LEU 78 HD23 LEU 78 100.725 3.463 5.926 618 H ARG 79 H ARG 79 103.441 5.366 10.739 619 HA ARG 79 HA ARG 79 104.277 7.666 8.974 620 HB2 ARG 79 HB2 ARG 79 103.949 9.258 10.788 621 HB3 ARG 79 HB3 ARG 79 102.419 8.392 10.511 622 HG2 ARG 79 HG3 ARG 79 103.037 6.815 12.370 623 HG3 ARG 79 HG2 ARG 79 104.474 7.815 12.690 624 HD2 ARG 79 HD2 ARG 79 101.771 9.145 12.566 625 HD3 ARG 79 HD3 ARG 79 102.216 8.234 14.029 626 HE ARG 79 HE ARG 79 104.444 9.809 13.688 627 HH11 ARG 79 HH11 ARG 79 104.620 11.945 14.404 628 HH12 ARG 79 HH12 ARG 79 103.185 12.931 14.576 629 HH21 ARG 79 HH21 ARG 79 101.019 10.413 13.530 630 HH22 ARG 79 HH22 ARG 79 101.154 12.067 14.083 631 H GLY 80 H GLY 80 106.415 8.338 9.283 632 HA2 GLY 80 HA2 GLY 80 108.030 7.889 11.564 633 HA3 GLY 80 HA3 GLY 80 108.200 6.434 10.548 634 H THR 81 H THR 81 109.867 6.552 9.127 635 HA THR 81 HA THR 81 110.212 8.641 7.222 636 HB THR 81 HB THR 81 112.535 9.282 8.734 637 HG1 THR 81 HG1 THR 81 111.051 10.276 10.523 638 HG21 THR 81 HG21 THR 81 111.367 11.552 8.845 639 HG22 THR 81 HG22 THR 81 111.517 10.844 7.219 640 HG23 THR 81 HG23 THR 81 109.962 10.769 8.083 641 H TRP 82 H TRP 82 112.151 8.393 5.945 642 HA TRP 82 HA TRP 82 113.435 5.703 6.413 643 HB2 TRP 82 HB2 TRP 82 113.700 7.368 3.891 644 HB3 TRP 82 HB3 TRP 82 113.871 5.607 4.087 645 HD1 TRP 82 HD1 TRP 82 111.124 8.298 4.502 646 HE1 TRP 82 HE1 TRP 82 108.858 7.299 3.795 647 HE3 TRP 82 HE3 TRP 82 112.646 3.548 3.448 648 HZ2 TRP 82 HZ2 TRP 82 107.856 4.744 2.879 649 HZ3 TRP 82 HZ3 TRP 82 111.025 1.850 2.658 650 HH2 TRP 82 HH2 TRP 82 108.632 2.441 2.372 651 H SER 83 H SER 83 115.682 5.513 6.542 652 HA SER 83 HA SER 83 117.272 8.059 6.319 653 HB2 SER 83 HB3 SER 83 116.823 8.019 8.673 654 HB3 SER 83 HB2 SER 83 117.068 6.258 8.763 655 HG SER 83 HG SER 83 118.890 7.677 9.457 656 H LEU 84 H LEU 84 119.617 7.588 6.052 657 HA LEU 84 HA LEU 84 119.913 4.927 4.735 658 HB2 LEU 84 HB2 LEU 84 121.120 6.262 3.353 659 HB3 LEU 84 HB3 LEU 84 121.207 7.565 4.561 660 HG LEU 84 HG LEU 84 123.004 6.250 5.746 661 HD11 LEU 84 HD11 LEU 84 123.739 4.655 3.414 662 HD12 LEU 84 HD12 LEU 84 123.528 4.144 5.106 663 HD13 LEU 84 HD13 LEU 84 122.126 4.198 4.011 664 HD21 LEU 84 HD21 LEU 84 124.769 6.806 4.092 665 HD22 LEU 84 HD22 LEU 84 123.547 8.096 4.188 666 HD23 LEU 84 HD23 LEU 84 123.530 6.954 2.823 667 H GLU 85 H GLU 85 120.963 3.235 5.673 668 HA GLU 85 HA GLU 85 122.663 3.809 8.090 669 HB2 GLU 85 HB3 GLU 85 120.969 2.976 9.373 670 HB3 GLU 85 HB2 GLU 85 120.109 2.320 7.960 671 HG2 GLU 85 HG2 GLU 85 121.478 0.340 7.938 672 HG3 GLU 85 HG3 GLU 85 122.609 1.032 9.125 673 H GLY 86 H GLY 86 124.617 2.844 7.810 674 HA2 GLY 86 HA2 GLY 86 126.238 1.363 6.924 675 HA3 GLY 86 HA3 GLY 86 124.936 0.151 6.824 676 H ASN 87 H ASN 87 124.283 -0.442 4.800 677 HA ASN 87 HA ASN 87 124.933 1.482 2.555 678 HB2 ASN 87 HB3 ASN 87 124.919 -1.519 2.175 679 HB3 ASN 87 HB2 ASN 87 125.736 -0.267 1.208 680 HD21 ASN 87 HD21 ASN 87 127.724 0.703 2.092 681 HD22 ASN 87 HD22 ASN 87 128.607 -0.105 3.367 682 H LYS 88 H LYS 88 122.362 1.207 4.011 683 HA LYS 88 HA LYS 88 120.726 0.573 1.588 684 HB2 LYS 88 HB2 LYS 88 119.131 -0.757 3.131 685 HB3 LYS 88 HB3 LYS 88 120.626 -1.568 2.607 686 HG2 LYS 88 HG2 LYS 88 120.820 0.038 5.118 687 HG3 LYS 88 HG3 LYS 88 119.829 -1.436 5.212 688 HD2 LYS 88 HD3 LYS 88 121.786 -2.677 4.130 689 HD3 LYS 88 HD2 LYS 88 122.752 -1.205 4.384 690 HE2 LYS 88 HE2 LYS 88 123.206 -2.026 6.451 691 HE3 LYS 88 HE3 LYS 88 121.522 -1.621 6.863 692 HZ1 LYS 88 HZ1 LYS 88 122.020 -3.930 7.319 693 HZ2 LYS 88 HZ2 LYS 88 120.883 -3.820 6.129 694 HZ3 LYS 88 HZ3 LYS 88 122.443 -4.195 5.747 695 H LEU 89 H LEU 89 118.453 1.310 1.847 696 HA LEU 89 HA LEU 89 118.395 3.749 3.607 697 HB2 LEU 89 HB2 LEU 89 117.030 2.885 1.075 698 HB3 LEU 89 HB3 LEU 89 116.131 3.969 2.163 699 HG LEU 89 HG LEU 89 119.007 4.597 1.488 700 HD11 LEU 89 HD11 LEU 89 117.899 4.166 -0.688 701 HD12 LEU 89 HD12 LEU 89 116.579 5.270 -0.234 702 HD13 LEU 89 HD13 LEU 89 118.227 5.902 -0.470 703 HD21 LEU 89 HD21 LEU 89 117.798 5.892 3.226 704 HD22 LEU 89 HD22 LEU 89 116.520 6.278 2.048 705 HD23 LEU 89 HD23 LEU 89 118.168 6.909 1.812 706 H ILE 90 H ILE 90 117.509 3.406 5.587 707 HA ILE 90 HA ILE 90 115.664 1.129 5.979 708 HB ILE 90 HB ILE 90 115.512 2.381 8.340 709 HG12 ILE 90 HG12 ILE 90 118.192 3.277 7.218 710 HG13 ILE 90 HG13 ILE 90 116.788 4.352 7.443 711 HG21 ILE 90 HG21 ILE 90 116.442 0.125 7.904 712 HG22 ILE 90 HG22 ILE 90 117.470 1.040 9.032 713 HG23 ILE 90 HG23 ILE 90 117.956 0.864 7.329 714 HD11 ILE 90 HD11 ILE 90 118.309 4.456 9.390 715 HD12 ILE 90 HD12 ILE 90 116.728 3.775 9.842 716 HD13 ILE 90 HD13 ILE 90 118.130 2.700 9.620 717 H GLY 91 H GLY 91 113.610 1.440 7.138 718 HA2 GLY 91 HA2 GLY 91 112.222 4.037 6.604 719 HA3 GLY 91 HA3 GLY 91 111.569 2.583 5.808 720 H LYS 92 H LYS 92 111.917 4.305 8.814 721 HA LYS 92 HA LYS 92 110.756 2.028 10.365 722 HB2 LYS 92 HB2 LYS 92 111.095 3.422 12.317 723 HB3 LYS 92 HB3 LYS 92 112.557 3.552 11.311 724 HG2 LYS 92 HG3 LYS 92 111.214 5.600 10.243 725 HG3 LYS 92 HG2 LYS 92 110.395 5.582 11.823 726 HD2 LYS 92 HD2 LYS 92 112.604 5.693 12.958 727 HD3 LYS 92 HD3 LYS 92 113.411 5.736 11.373 728 HE2 LYS 92 HE2 LYS 92 111.243 7.747 11.800 729 HE3 LYS 92 HE3 LYS 92 112.726 7.978 12.757 730 HZ1 LYS 92 HZ1 LYS 92 113.051 7.349 9.947 731 HZ2 LYS 92 HZ2 LYS 92 113.932 8.358 10.909 732 HZ3 LYS 92 HZ3 LYS 92 112.483 8.857 10.300 733 H PHE 93 H PHE 93 108.617 1.740 9.977 734 HA PHE 93 HA PHE 93 106.906 4.233 9.901 735 HB2 PHE 93 HB2 PHE 93 106.849 1.650 8.370 736 HB3 PHE 93 HB3 PHE 93 105.291 2.411 8.764 737 HD1 PHE 93 HD1 PHE 93 107.615 5.024 8.655 738 HD2 PHE 93 HD2 PHE 93 105.524 2.326 6.046 739 HE1 PHE 93 HE1 PHE 93 107.925 6.605 6.773 740 HE2 PHE 93 HE2 PHE 93 105.831 3.911 4.165 741 HZ PHE 93 HZ PHE 93 107.034 6.049 4.527 742 H LYS 94 H LYS 94 104.964 4.223 11.033 743 HA LYS 94 HA LYS 94 104.544 1.873 12.874 744 HB2 LYS 94 HB2 LYS 94 105.020 4.747 13.570 745 HB3 LYS 94 HB3 LYS 94 103.785 3.872 14.506 746 HG2 LYS 94 HG3 LYS 94 105.332 2.341 15.366 747 HG3 LYS 94 HG2 LYS 94 106.474 2.584 14.022 748 HD2 LYS 94 HD2 LYS 94 107.145 4.729 14.859 749 HD3 LYS 94 HD3 LYS 94 105.798 4.773 16.021 750 HE2 LYS 94 HE3 LYS 94 107.940 2.615 16.096 751 HE3 LYS 94 HE2 LYS 94 108.109 4.156 16.972 752 HZ1 LYS 94 HZ1 LYS 94 107.121 2.451 18.352 753 HZ2 LYS 94 HZ2 LYS 94 105.883 2.242 17.283 754 HZ3 LYS 94 HZ3 LYS 94 106.039 3.669 18.095 755 H ARG 95 H ARG 95 102.569 1.111 12.467 756 HA ARG 95 HA ARG 95 100.541 2.408 10.963 757 HB2 ARG 95 HB2 ARG 95 100.344 0.329 13.183 758 HB3 ARG 95 HB3 ARG 95 98.949 0.836 12.201 759 HG2 ARG 95 HG3 ARG 95 100.516 0.300 10.161 760 HG3 ARG 95 HG2 ARG 95 101.446 -0.648 11.346 761 HD2 ARG 95 HD2 ARG 95 99.703 -2.004 10.142 762 HD3 ARG 95 HD3 ARG 95 99.471 -1.973 11.907 763 HE ARG 95 HE ARG 95 97.971 0.172 10.588 764 HH11 ARG 95 HH11 ARG 95 95.729 -0.102 10.528 765 HH12 ARG 95 HH12 ARG 95 95.031 -1.675 10.839 766 HH21 ARG 95 HH21 ARG 95 98.107 -3.225 11.341 767 HH22 ARG 95 HH22 ARG 95 96.371 -3.436 11.298 768 H THR 96 H THR 96 99.584 4.327 11.409 769 HA THR 96 HA THR 96 99.625 5.450 14.111 770 HB THR 96 HB THR 96 97.791 6.973 12.810 771 HG1 THR 96 HG1 THR 96 99.445 6.027 10.711 772 HG21 THR 96 HG21 THR 96 99.705 8.351 12.055 773 HG22 THR 96 HG22 THR 96 99.984 7.714 13.693 774 HG23 THR 96 HG23 THR 96 100.798 6.967 12.297 775 H ASP 97 H ASP 97 97.706 3.237 12.519 776 HA ASP 97 HA ASP 97 95.227 3.832 14.063 777 HB2 ASP 97 HB2 ASP 97 95.391 2.923 11.615 778 HB3 ASP 97 HB3 ASP 97 95.710 1.353 12.391 779 H ASN 98 H ASN 98 97.863 1.421 13.985 780 HA ASN 98 HA ASN 98 96.857 0.488 16.677 781 HB2 ASN 98 HB2 ASN 98 96.361 -1.106 14.695 782 HB3 ASN 98 HB3 ASN 98 98.117 -1.392 14.655 783 HD21 ASN 98 HD21 ASN 98 96.604 -3.610 15.263 784 HD22 ASN 98 HD22 ASN 98 96.698 -3.968 16.972 785 H GLY 99 H GLY 99 99.281 2.065 15.149 786 HA2 GLY 99 HA2 GLY 99 101.632 2.217 15.518 787 HA3 GLY 99 HA3 GLY 99 101.149 2.022 17.220 788 H ASN 100 H ASN 100 100.713 -0.444 14.693 789 HA ASN 100 HA ASN 100 102.107 -2.415 16.379 790 HB2 ASN 100 HB2 ASN 100 100.709 -2.411 13.721 791 HB3 ASN 100 HB3 ASN 100 101.842 -3.739 14.067 792 HD21 ASN 100 HD21 ASN 100 101.507 -4.576 16.543 793 HD22 ASN 100 HD22 ASN 100 99.833 -4.873 16.956 794 H GLU 101 H GLU 101 103.500 0.013 15.175 795 HA GLU 101 HA GLU 101 105.544 0.518 14.118 796 HB2 GLU 101 HB2 GLU 101 107.417 -0.762 14.935 797 HB3 GLU 101 HB3 GLU 101 106.209 -0.685 16.237 798 HG2 GLU 101 HG3 GLU 101 105.522 -2.936 15.883 799 HG3 GLU 101 HG2 GLU 101 106.302 -3.009 14.284 800 H LEU 102 H LEU 102 107.242 -0.206 12.565 801 HA LEU 102 HA LEU 102 106.704 -2.586 10.911 802 HB2 LEU 102 HB3 LEU 102 104.983 -1.257 9.901 803 HB3 LEU 102 HB2 LEU 102 105.980 0.214 9.960 804 HG LEU 102 HG LEU 102 107.561 -0.815 8.328 805 HD11 LEU 102 HD11 LEU 102 107.120 -3.187 8.905 806 HD12 LEU 102 HD12 LEU 102 106.890 -2.898 7.164 807 HD13 LEU 102 HD13 LEU 102 105.476 -3.044 8.237 808 HD21 LEU 102 HD21 LEU 102 105.222 -1.201 6.693 809 HD22 LEU 102 HD22 LEU 102 104.876 0.097 7.862 810 HD23 LEU 102 HD23 LEU 102 106.285 0.225 6.781 811 H ASN 103 H ASN 103 108.772 -3.221 10.404 812 HA ASN 103 HA ASN 103 110.824 -1.003 10.169 813 HB2 ASN 103 HB2 ASN 103 110.831 -3.230 11.848 814 HB3 ASN 103 HB3 ASN 103 111.863 -3.744 10.493 815 HD21 ASN 103 HD21 ASN 103 112.962 -1.173 9.775 816 HD22 ASN 103 HD22 ASN 103 113.977 -0.641 11.097 817 H THR 104 H THR 104 111.310 -0.603 8.062 818 HA THR 104 HA THR 104 111.476 -3.021 6.253 819 HB THR 104 HB THR 104 109.426 -1.889 5.679 820 HG1 THR 104 HG1 THR 104 110.182 -2.206 3.719 821 HG21 THR 104 HG21 THR 104 109.716 0.638 4.976 822 HG22 THR 104 HG22 THR 104 109.548 0.225 6.699 823 HG23 THR 104 HG23 THR 104 111.156 0.569 6.020 824 H VAL 105 H VAL 105 112.576 -2.309 4.100 825 HA VAL 105 HA VAL 105 114.722 -0.267 4.540 826 HB VAL 105 HB VAL 105 115.304 -3.174 3.809 827 HG11 VAL 105 HG11 VAL 105 117.709 -2.153 4.315 828 HG12 VAL 105 HG12 VAL 105 116.909 -0.624 3.879 829 HG13 VAL 105 HG13 VAL 105 116.965 -1.964 2.709 830 HG21 VAL 105 HG21 VAL 105 116.502 -3.209 5.992 831 HG22 VAL 105 HG22 VAL 105 115.924 -1.559 6.324 832 HG23 VAL 105 HG23 VAL 105 114.762 -2.901 6.205 833 H ARG 106 H ARG 106 115.815 0.266 2.457 834 HA ARG 106 HA ARG 106 114.220 -0.697 0.075 835 HB2 ARG 106 HB2 ARG 106 113.299 1.462 0.529 836 HB3 ARG 106 HB3 ARG 106 114.901 2.157 0.873 837 HG2 ARG 106 HG3 ARG 106 115.553 2.025 -1.437 838 HG3 ARG 106 HG2 ARG 106 114.152 1.005 -1.844 839 HD2 ARG 106 HD2 ARG 106 114.004 3.521 -2.449 840 HD3 ARG 106 HD3 ARG 106 112.622 2.809 -1.583 841 HE ARG 106 HE ARG 106 114.696 4.034 0.162 842 HH11 ARG 106 HH11 ARG 106 113.942 5.792 1.364 843 HH12 ARG 106 HH12 ARG 106 112.397 6.516 0.979 844 HH21 ARG 106 HH21 ARG 106 111.739 4.330 -1.651 845 HH22 ARG 106 HH22 ARG 106 111.155 5.692 -0.721 846 H GLU 107 H GLU 107 115.425 -1.139 -1.723 847 HA GLU 107 HA GLU 107 118.267 -0.152 -1.804 848 HB2 GLU 107 HB2 GLU 107 117.326 -3.031 -1.803 849 HB3 GLU 107 HB3 GLU 107 118.823 -2.570 -2.650 850 HG2 GLU 107 HG2 GLU 107 119.741 -1.618 -0.588 851 HG3 GLU 107 HG3 GLU 107 118.217 -1.941 0.273 852 H ILE 108 H ILE 108 119.182 -0.315 -4.020 853 HA ILE 108 HA ILE 108 116.993 -0.517 -6.094 854 HB ILE 108 HB ILE 108 119.396 1.347 -6.180 855 HG12 ILE 108 HG12 ILE 108 116.736 1.594 -4.844 856 HG13 ILE 108 HG13 ILE 108 118.267 2.428 -4.491 857 HG21 ILE 108 HG21 ILE 108 118.187 0.560 -8.297 858 HG22 ILE 108 HG22 ILE 108 116.762 1.438 -7.690 859 HG23 ILE 108 HG23 ILE 108 118.265 2.321 -8.051 860 HD11 ILE 108 HD11 ILE 108 116.792 4.116 -5.331 861 HD12 ILE 108 HD12 ILE 108 116.235 3.071 -6.660 862 HD13 ILE 108 HD13 ILE 108 117.890 3.728 -6.678 863 H ILE 109 H ILE 109 117.705 -2.741 -6.362 864 HA ILE 109 HA ILE 109 120.438 -3.433 -6.973 865 HB ILE 109 HB ILE 109 117.771 -4.704 -7.691 866 HG12 ILE 109 HG12 ILE 109 120.044 -5.577 -5.853 867 HG13 ILE 109 HG13 ILE 109 118.590 -4.709 -5.306 868 HG21 ILE 109 HG21 ILE 109 119.075 -6.667 -8.467 869 HG22 ILE 109 HG22 ILE 109 120.586 -5.757 -8.231 870 HG23 ILE 109 HG23 ILE 109 119.418 -5.237 -9.470 871 HD11 ILE 109 HD11 ILE 109 118.849 -7.523 -6.377 872 HD12 ILE 109 HD12 ILE 109 117.965 -6.938 -4.948 873 HD13 ILE 109 HD13 ILE 109 117.313 -6.646 -6.578 874 H GLY 110 H GLY 110 121.296 -1.905 -8.409 875 HA2 GLY 110 HA3 GLY 110 121.771 -0.998 -10.537 876 HA3 GLY 110 HA2 GLY 110 121.121 -2.518 -11.191 877 H ASP 111 H ASP 111 118.734 -2.640 -11.507 878 HA ASP 111 HA ASP 111 117.523 0.110 -11.830 879 HB2 ASP 111 HB3 ASP 111 117.711 -2.155 -13.832 880 HB3 ASP 111 HB2 ASP 111 116.402 -0.953 -13.930 881 H GLU 112 H GLU 112 117.192 -2.004 -9.745 882 HA GLU 112 HA GLU 112 114.207 -2.310 -10.090 883 HB2 GLU 112 HB3 GLU 112 115.740 -4.441 -8.621 884 HB3 GLU 112 HB2 GLU 112 114.223 -4.566 -9.544 885 HG2 GLU 112 HG3 GLU 112 115.533 -4.217 -11.657 886 HG3 GLU 112 HG2 GLU 112 117.029 -4.231 -10.693 887 H LEU 113 H LEU 113 113.046 -1.787 -8.208 888 HA LEU 113 HA LEU 113 114.786 -0.837 -5.934 889 HB2 LEU 113 HB2 LEU 113 112.997 0.666 -7.014 890 HB3 LEU 113 HB3 LEU 113 111.795 -0.390 -6.233 891 HG LEU 113 HG LEU 113 113.340 0.060 -4.087 892 HD11 LEU 113 HD11 LEU 113 114.999 1.410 -5.347 893 HD12 LEU 113 HD12 LEU 113 114.180 2.395 -4.112 894 HD13 LEU 113 HD13 LEU 113 113.713 2.545 -5.823 895 HD21 LEU 113 HD21 LEU 113 111.803 1.921 -3.505 896 HD22 LEU 113 HD22 LEU 113 111.337 2.070 -5.217 897 HD23 LEU 113 HD23 LEU 113 110.926 0.596 -4.308 898 H VAL 114 H VAL 114 115.114 -2.324 -4.378 899 HA VAL 114 HA VAL 114 112.947 -4.354 -3.904 900 HB VAL 114 HB VAL 114 115.767 -4.236 -2.747 901 HG11 VAL 114 HG11 VAL 114 114.139 -5.603 -1.470 902 HG12 VAL 114 HG12 VAL 114 115.345 -6.633 -2.278 903 HG13 VAL 114 HG13 VAL 114 113.707 -6.478 -2.959 904 HG21 VAL 114 HG21 VAL 114 115.812 -4.404 -5.224 905 HG22 VAL 114 HG22 VAL 114 114.684 -5.779 -5.150 906 HG23 VAL 114 HG23 VAL 114 116.321 -5.934 -4.469 907 H GLN 115 H GLN 115 111.461 -3.678 -2.447 908 HA GLN 115 HA GLN 115 112.489 -2.132 -0.056 909 HB2 GLN 115 HB2 GLN 115 109.959 -2.004 -1.680 910 HB3 GLN 115 HB3 GLN 115 109.842 -1.681 0.066 911 HG2 GLN 115 HG2 GLN 115 111.612 0.041 -0.131 912 HG3 GLN 115 HG3 GLN 115 111.736 -0.284 -1.877 913 HE21 GLN 115 HE21 GLN 115 108.502 -0.713 -0.972 914 HE22 GLN 115 HE22 GLN 115 107.911 0.884 -1.374 915 H THR 116 H THR 116 112.812 -3.638 1.535 916 HA THR 116 HA THR 116 110.752 -5.827 1.774 917 HB THR 116 HB THR 116 113.245 -5.758 3.453 918 HG1 THR 116 HG1 THR 116 114.127 -5.320 1.467 919 HG21 THR 116 HG21 THR 116 113.097 -8.195 3.089 920 HG22 THR 116 HG22 THR 116 111.748 -7.952 1.954 921 HG23 THR 116 HG23 THR 116 111.544 -7.556 3.677 922 H TYR 117 H TYR 117 109.641 -6.148 3.694 923 HA TYR 117 HA TYR 117 110.057 -4.000 5.780 924 HB2 TYR 117 HB3 TYR 117 107.332 -5.211 5.327 925 HB3 TYR 117 HB2 TYR 117 107.766 -3.640 6.040 926 HD1 TYR 117 HD1 TYR 117 108.227 -5.504 2.837 927 HD2 TYR 117 HD2 TYR 117 107.378 -1.757 4.736 928 HE1 TYR 117 HE1 TYR 117 107.923 -4.453 0.614 929 HE2 TYR 117 HE2 TYR 117 107.073 -0.693 2.517 930 HH TYR 117 HH TYR 117 106.942 -2.558 -0.430 931 H VAL 118 H VAL 118 109.471 -4.594 7.898 932 HA VAL 118 HA VAL 118 109.367 -7.585 8.346 933 HB VAL 118 HB VAL 118 110.654 -5.592 10.243 934 HG11 VAL 118 HG11 VAL 118 111.329 -7.457 11.446 935 HG12 VAL 118 HG12 VAL 118 111.361 -8.505 10.008 936 HG13 VAL 118 HG13 VAL 118 109.807 -8.078 10.764 937 HG21 VAL 118 HG21 VAL 118 112.840 -6.331 9.343 938 HG22 VAL 118 HG22 VAL 118 111.872 -5.515 8.092 939 HG23 VAL 118 HG23 VAL 118 112.002 -7.290 8.099 940 H TYR 119 H TYR 119 108.072 -8.245 10.069 941 HA TYR 119 HA TYR 119 106.539 -6.074 11.457 942 HB2 TYR 119 HB3 TYR 119 105.470 -7.201 9.220 943 HB3 TYR 119 HB2 TYR 119 104.890 -8.343 10.455 944 HD1 TYR 119 HD1 TYR 119 103.689 -7.427 12.486 945 HD2 TYR 119 HD2 TYR 119 104.493 -5.045 9.008 946 HE1 TYR 119 HE1 TYR 119 101.937 -5.819 13.185 947 HE2 TYR 119 HE2 TYR 119 102.749 -3.427 9.710 948 HH TYR 119 HH TYR 119 100.731 -3.368 11.113 949 H GLU 120 H GLU 120 106.947 -6.516 13.505 950 HA GLU 120 HA GLU 120 107.233 -7.729 15.503 951 HB2 GLU 120 HB3 GLU 120 104.914 -9.219 14.213 952 HB3 GLU 120 HB2 GLU 120 105.422 -9.440 15.904 953 HG2 GLU 120 HG2 GLU 120 104.888 -6.658 14.849 954 HG3 GLU 120 HG3 GLU 120 103.526 -7.696 15.336 955 H GLY 121 H GLY 121 108.602 -8.777 12.932 956 HA2 GLY 121 HA3 GLY 121 110.444 -10.443 13.281 957 HA3 GLY 121 HA2 GLY 121 109.273 -11.464 14.152 958 H VAL 122 H VAL 122 108.361 -9.700 11.269 959 HA VAL 122 HA VAL 122 108.436 -12.309 9.755 960 HB VAL 122 HB VAL 122 106.118 -11.136 10.507 961 HG11 VAL 122 HG11 VAL 122 106.512 -10.014 7.722 962 HG12 VAL 122 HG12 VAL 122 105.262 -9.613 8.923 963 HG13 VAL 122 HG13 VAL 122 106.935 -9.053 9.159 964 HG21 VAL 122 HG21 VAL 122 105.090 -12.280 8.566 965 HG22 VAL 122 HG22 VAL 122 106.377 -13.270 9.296 966 HG23 VAL 122 HG23 VAL 122 106.686 -12.381 7.785 967 H GLU 123 H GLU 123 108.181 -11.659 7.274 968 HA GLU 123 HA GLU 123 109.515 -9.063 6.744 969 HB2 GLU 123 HB3 GLU 123 111.092 -11.401 7.168 970 HB3 GLU 123 HB2 GLU 123 111.130 -11.062 5.422 971 HG2 GLU 123 HG2 GLU 123 111.632 -8.625 6.037 972 HG3 GLU 123 HG3 GLU 123 111.888 -9.194 7.704 973 H ALA 124 H ALA 124 108.658 -8.279 4.929 974 HA ALA 124 HA ALA 124 107.763 -10.263 2.822 975 HB1 ALA 124 HB1 ALA 124 106.477 -7.795 2.341 976 HB2 ALA 124 HB2 ALA 124 106.377 -8.032 4.102 977 HB3 ALA 124 HB3 ALA 124 105.734 -9.273 3.000 978 H LYS 125 H LYS 125 108.194 -9.607 0.582 979 HA LYS 125 HA LYS 125 110.200 -7.347 0.433 980 HB2 LYS 125 HB2 LYS 125 111.088 -9.823 0.327 981 HB3 LYS 125 HB3 LYS 125 110.445 -9.784 -1.332 982 HG2 LYS 125 HG2 LYS 125 111.749 -7.413 -1.328 983 HG3 LYS 125 HG3 LYS 125 112.742 -8.277 -0.131 984 HD2 LYS 125 HD3 LYS 125 112.030 -9.411 -2.870 985 HD3 LYS 125 HD2 LYS 125 113.534 -8.524 -2.530 986 HE2 LYS 125 HE3 LYS 125 114.475 -10.334 -1.544 987 HE3 LYS 125 HE2 LYS 125 113.037 -10.610 -0.533 988 HZ1 LYS 125 HZ1 LYS 125 113.256 -11.392 -3.370 989 HZ2 LYS 125 HZ2 LYS 125 113.490 -12.419 -2.101 990 HZ3 LYS 125 HZ3 LYS 125 112.008 -11.739 -2.349 991 H ARG 126 H ARG 126 110.044 -6.004 -1.306 992 HA ARG 126 HA ARG 126 108.073 -6.757 -3.469 993 HB2 ARG 126 HB2 ARG 126 108.057 -4.406 -1.618 994 HB3 ARG 126 HB3 ARG 126 107.724 -4.060 -3.332 995 HG2 ARG 126 HG3 ARG 126 105.816 -5.451 -3.370 996 HG3 ARG 126 HG2 ARG 126 106.324 -6.346 -1.918 997 HD2 ARG 126 HD2 ARG 126 104.474 -4.795 -1.384 998 HD3 ARG 126 HD3 ARG 126 105.965 -4.305 -0.545 999 HE ARG 126 HE ARG 126 105.653 -2.977 -3.154 1000 HH11 ARG 126 HH11 ARG 126 105.227 -0.758 -3.045 1001 HH12 ARG 126 HH12 ARG 126 104.703 -0.041 -1.537 1002 HH21 ARG 126 HH21 ARG 126 104.784 -3.047 0.217 1003 HH22 ARG 126 HH22 ARG 126 104.454 -1.331 0.301 1004 H ILE 127 H ILE 127 109.288 -6.826 -5.316 1005 HA ILE 127 HA ILE 127 111.605 -4.889 -5.491 1006 HB ILE 127 HB ILE 127 111.174 -7.355 -7.213 1007 HG12 ILE 127 HG13 ILE 127 113.074 -7.397 -4.888 1008 HG13 ILE 127 HG12 ILE 127 111.341 -7.604 -4.535 1009 HG21 ILE 127 HG21 ILE 127 112.923 -6.305 -8.237 1010 HG22 ILE 127 HG22 ILE 127 113.872 -6.957 -6.880 1011 HG23 ILE 127 HG23 ILE 127 113.266 -5.285 -6.819 1012 HD11 ILE 127 HD11 ILE 127 112.437 -9.794 -4.935 1013 HD12 ILE 127 HD12 ILE 127 111.225 -9.447 -6.191 1014 HD13 ILE 127 HD13 ILE 127 112.957 -9.239 -6.544 1015 H PHE 128 H PHE 128 111.377 -3.223 -6.858 1016 HA PHE 128 HA PHE 128 109.234 -3.406 -8.969 1017 HB2 PHE 128 HB3 PHE 128 110.834 -0.974 -8.040 1018 HB3 PHE 128 HB2 PHE 128 109.401 -0.968 -9.091 1019 HD1 PHE 128 HD1 PHE 128 108.332 -3.410 -7.199 1020 HD2 PHE 128 HD2 PHE 128 109.473 0.678 -6.626 1021 HE1 PHE 128 HE1 PHE 128 106.848 -3.281 -5.221 1022 HE2 PHE 128 HE2 PHE 128 107.995 0.815 -4.637 1023 HZ PHE 128 HZ PHE 128 106.677 -1.166 -3.936 1024 H LYS 129 H LYS 129 109.877 -2.070 -11.019 1025 HA LYS 129 HA LYS 129 112.732 -2.108 -11.747 1026 HB2 LYS 129 HB2 LYS 129 112.246 -4.511 -11.989 1027 HB3 LYS 129 HB3 LYS 129 110.831 -4.140 -13.003 1028 HG2 LYS 129 HG3 LYS 129 112.135 -3.472 -14.818 1029 HG3 LYS 129 HG2 LYS 129 113.516 -3.017 -13.791 1030 HD2 LYS 129 HD3 LYS 129 114.065 -5.347 -13.385 1031 HD3 LYS 129 HD2 LYS 129 112.577 -5.888 -14.198 1032 HE2 LYS 129 HE3 LYS 129 114.799 -4.300 -15.556 1033 HE3 LYS 129 HE2 LYS 129 114.629 -6.070 -15.647 1034 HZ1 LYS 129 HZ1 LYS 129 113.589 -4.978 -17.520 1035 HZ2 LYS 129 HZ2 LYS 129 112.449 -5.746 -16.607 1036 HZ3 LYS 129 HZ3 LYS 129 112.606 -4.106 -16.523 1037 H LYS 130 H LYS 130 113.061 -1.131 -13.861 1038 HA LYS 130 HA LYS 130 111.390 1.053 -14.453 1039 HB2 LYS 130 HB2 LYS 130 112.356 0.761 -16.873 1040 HB3 LYS 130 HB3 LYS 130 113.486 1.061 -15.531 1041 HG2 LYS 130 HG2 LYS 130 114.009 -1.307 -15.362 1042 HG3 LYS 130 HG3 LYS 130 112.741 -1.718 -16.541 1043 HD2 LYS 130 HD3 LYS 130 113.936 -0.690 -18.338 1044 HD3 LYS 130 HD2 LYS 130 115.041 0.150 -17.224 1045 HE2 LYS 130 HE2 LYS 130 115.918 -2.079 -16.480 1046 HE3 LYS 130 HE3 LYS 130 114.883 -2.859 -17.700 1047 HZ1 LYS 130 HZ1 LYS 130 117.111 -2.489 -18.528 1048 HZ2 LYS 130 HZ2 LYS 130 116.989 -0.866 -18.258 1049 HZ3 LYS 130 HZ3 LYS 130 116.030 -1.588 -19.389 1050 H ASP 131 H ASP 131 109.495 1.371 -15.553 1051 HA ASP 131 HA ASP 131 107.650 -0.737 -15.964 1052 HB2 ASP 131 HB2 ASP 131 106.658 0.942 -17.742 1053 HB3 ASP 131 HB3 ASP 131 106.699 1.405 -16.024 Start of MODEL 6 1 H1 ALA 1 H1 ALA 1 118.088 7.929 -8.693 2 H2 ALA 1 H2 ALA 1 118.962 8.335 -7.356 3 H3 ALA 1 H3 ALA 1 117.384 8.798 -7.481 4 HA ALA 1 HA ALA 1 118.342 6.013 -7.262 5 HB1 ALA 1 HB1 ALA 1 117.257 6.085 -5.034 6 HB2 ALA 1 HB2 ALA 1 116.849 7.799 -5.288 7 HB3 ALA 1 HB3 ALA 1 118.552 7.301 -5.153 8 H PHE 2 H PHE 2 116.991 4.778 -8.468 9 HA PHE 2 HA PHE 2 114.995 4.180 -9.625 10 HB2 PHE 2 HB3 PHE 2 114.736 3.917 -6.862 11 HB3 PHE 2 HB2 PHE 2 113.273 4.823 -7.315 12 HD1 PHE 2 HD1 PHE 2 115.300 2.048 -8.887 13 HD2 PHE 2 HD2 PHE 2 111.437 3.460 -7.650 14 HE1 PHE 2 HE1 PHE 2 114.261 -0.038 -9.743 15 HE2 PHE 2 HE2 PHE 2 110.401 1.375 -8.503 16 HZ PHE 2 HZ PHE 2 111.816 -0.374 -9.546 17 H ASP 3 H ASP 3 115.744 7.022 -9.833 18 HA ASP 3 HA ASP 3 113.301 8.619 -9.528 19 HB2 ASP 3 HB2 ASP 3 115.984 8.997 -10.866 20 HB3 ASP 3 HB3 ASP 3 114.660 10.137 -11.208 21 H SER 4 H SER 4 111.579 7.682 -10.645 22 HA SER 4 HA SER 4 111.007 8.333 -13.270 23 HB2 SER 4 HB3 SER 4 112.699 7.264 -14.419 24 HB3 SER 4 HB2 SER 4 112.912 6.023 -13.161 25 HG SER 4 HG SER 4 110.773 6.191 -15.046 26 H THR 5 H THR 5 109.667 6.214 -14.377 27 HA THR 5 HA THR 5 107.629 5.694 -12.267 28 HB THR 5 HB THR 5 107.709 4.943 -15.225 29 HG1 THR 5 HG1 THR 5 106.237 6.731 -15.349 30 HG21 THR 5 HG21 THR 5 105.133 4.845 -14.710 31 HG22 THR 5 HG22 THR 5 106.157 3.457 -14.271 32 HG23 THR 5 HG23 THR 5 105.658 4.625 -13.024 33 H TRP 6 H TRP 6 106.953 3.566 -11.642 34 HA TRP 6 HA TRP 6 108.603 1.275 -12.615 35 HB2 TRP 6 HB3 TRP 6 108.486 1.875 -9.641 36 HB3 TRP 6 HB2 TRP 6 109.515 0.697 -10.489 37 HD1 TRP 6 HD1 TRP 6 109.069 4.501 -10.050 38 HE1 TRP 6 HE1 TRP 6 111.312 5.674 -10.546 39 HE3 TRP 6 HE3 TRP 6 111.749 0.470 -11.647 40 HZ2 TRP 6 HZ2 TRP 6 113.932 4.928 -11.521 41 HZ3 TRP 6 HZ3 TRP 6 114.109 0.716 -12.346 42 HH2 TRP 6 HH2 TRP 6 115.207 2.938 -12.284 43 H LYS 7 H LYS 7 107.814 -0.815 -11.536 44 HA LYS 7 HA LYS 7 105.080 -0.628 -10.371 45 HB2 LYS 7 HB2 LYS 7 103.943 -1.788 -12.108 46 HB3 LYS 7 HB3 LYS 7 104.912 -0.561 -12.958 47 HG2 LYS 7 HG2 LYS 7 106.738 -2.380 -13.145 48 HG3 LYS 7 HG3 LYS 7 105.472 -3.535 -12.665 49 HD2 LYS 7 HD2 LYS 7 104.051 -2.549 -14.563 50 HD3 LYS 7 HD3 LYS 7 105.534 -1.734 -15.117 51 HE2 LYS 7 HE3 LYS 7 105.335 -3.840 -16.321 52 HE3 LYS 7 HE2 LYS 7 106.670 -3.995 -15.154 53 HZ1 LYS 7 HZ1 LYS 7 105.202 -5.900 -15.086 54 HZ2 LYS 7 HZ2 LYS 7 105.143 -5.088 -13.652 55 HZ3 LYS 7 HZ3 LYS 7 103.905 -4.943 -14.732 56 H VAL 8 H VAL 8 104.955 -2.184 -8.825 57 HA VAL 8 HA VAL 8 106.941 -3.937 -8.063 58 HB VAL 8 HB VAL 8 105.129 -4.030 -6.626 59 HG11 VAL 8 HG11 VAL 8 102.757 -4.504 -7.566 60 HG12 VAL 8 HG12 VAL 8 103.467 -4.164 -9.162 61 HG13 VAL 8 HG13 VAL 8 103.470 -2.908 -7.901 62 HG21 VAL 8 HG21 VAL 8 104.331 -6.271 -6.545 63 HG22 VAL 8 HG22 VAL 8 105.892 -6.388 -7.392 64 HG23 VAL 8 HG23 VAL 8 104.372 -6.438 -8.316 65 H ASP 9 H ASP 9 108.174 -5.110 -9.422 66 HA ASP 9 HA ASP 9 106.794 -6.718 -11.559 67 HB2 ASP 9 HB2 ASP 9 109.596 -5.690 -11.117 68 HB3 ASP 9 HB3 ASP 9 109.371 -7.161 -12.094 69 H ARG 10 H ARG 10 108.641 -6.942 -8.564 70 HA ARG 10 HA ARG 10 108.034 -9.884 -8.575 71 HB2 ARG 10 HB3 ARG 10 110.761 -8.611 -8.430 72 HB3 ARG 10 HB2 ARG 10 110.448 -10.094 -7.496 73 HG2 ARG 10 HG2 ARG 10 109.550 -11.136 -9.622 74 HG3 ARG 10 HG3 ARG 10 110.124 -9.697 -10.497 75 HD2 ARG 10 HD3 ARG 10 112.415 -10.196 -9.333 76 HD3 ARG 10 HD2 ARG 10 111.736 -11.818 -9.055 77 HE ARG 10 HE ARG 10 111.493 -10.898 -11.856 78 HH11 ARG 10 HH11 ARG 10 112.729 -12.083 -13.332 79 HH12 ARG 10 HH12 ARG 10 113.986 -13.155 -12.758 80 HH21 ARG 10 HH21 ARG 10 113.419 -12.435 -9.398 81 HH22 ARG 10 HH22 ARG 10 114.376 -13.353 -10.539 82 H SER 11 H SER 11 108.685 -10.805 -6.301 83 HA SER 11 HA SER 11 108.808 -9.044 -4.019 84 HB2 SER 11 HB2 SER 11 106.605 -8.257 -4.530 85 HB3 SER 11 HB3 SER 11 106.033 -9.895 -4.930 86 HG SER 11 HG SER 11 105.545 -8.956 -2.722 87 H GLU 12 H GLU 12 107.884 -10.393 -1.972 88 HA GLU 12 HA GLU 12 107.957 -13.318 -2.451 89 HB2 GLU 12 HB3 GLU 12 110.151 -13.657 -2.054 90 HB3 GLU 12 HB2 GLU 12 110.395 -11.900 -1.936 91 HG2 GLU 12 HG2 GLU 12 109.784 -11.975 0.469 92 HG3 GLU 12 HG3 GLU 12 109.546 -13.735 0.352 93 H ASN 13 H ASN 13 107.440 -14.534 -0.517 94 HA ASN 13 HA ASN 13 106.189 -14.832 1.459 95 HB2 ASN 13 HB2 ASN 13 107.866 -12.389 2.063 96 HB3 ASN 13 HB3 ASN 13 106.650 -12.948 3.237 97 HD21 ASN 13 HD21 ASN 13 108.768 -13.342 4.554 98 HD22 ASN 13 HD22 ASN 13 109.540 -14.896 4.331 99 H TYR 14 H TYR 14 105.847 -11.607 2.458 100 HA TYR 14 HA TYR 14 104.057 -10.069 2.272 101 HB2 TYR 14 HB2 TYR 14 104.257 -11.046 -0.287 102 HB3 TYR 14 HB3 TYR 14 102.596 -11.526 0.136 103 HD1 TYR 14 HD1 TYR 14 104.635 -8.543 1.178 104 HD2 TYR 14 HD2 TYR 14 101.162 -9.989 -0.897 105 HE1 TYR 14 HE1 TYR 14 103.870 -6.210 0.834 106 HE2 TYR 14 HE2 TYR 14 100.398 -7.655 -1.244 107 HH TYR 14 HH TYR 14 100.699 -5.465 -0.472 108 H ASP 15 H ASP 15 102.932 -13.444 1.613 109 HA ASP 15 HA ASP 15 100.403 -13.106 2.924 110 HB2 ASP 15 HB2 ASP 15 102.171 -15.590 2.772 111 HB3 ASP 15 HB3 ASP 15 100.452 -15.582 3.234 112 H LYS 16 H LYS 16 103.543 -14.261 4.235 113 HA LYS 16 HA LYS 16 102.611 -14.513 6.954 114 HB2 LYS 16 HB2 LYS 16 105.396 -13.688 6.013 115 HB3 LYS 16 HB3 LYS 16 104.976 -14.415 7.583 116 HG2 LYS 16 HG3 LYS 16 103.937 -16.051 5.411 117 HG3 LYS 16 HG2 LYS 16 105.680 -15.775 5.189 118 HD2 LYS 16 HD2 LYS 16 104.530 -16.602 7.876 119 HD3 LYS 16 HD3 LYS 16 104.976 -17.804 6.641 120 HE2 LYS 16 HE3 LYS 16 106.734 -16.929 8.488 121 HE3 LYS 16 HE2 LYS 16 107.237 -17.372 6.839 122 HZ1 LYS 16 HZ1 LYS 16 108.102 -15.235 7.383 123 HZ2 LYS 16 HZ2 LYS 16 106.621 -14.659 7.822 124 HZ3 LYS 16 HZ3 LYS 16 106.929 -15.024 6.243 125 H PHE 17 H PHE 17 103.770 -11.781 5.027 126 HA PHE 17 HA PHE 17 103.922 -9.887 7.236 127 HB2 PHE 17 HB2 PHE 17 104.943 -9.661 4.917 128 HB3 PHE 17 HB3 PHE 17 103.304 -9.342 4.303 129 HD1 PHE 17 HD1 PHE 17 105.821 -8.187 6.788 130 HD2 PHE 17 HD2 PHE 17 102.378 -7.173 4.444 131 HE1 PHE 17 HE1 PHE 17 106.070 -5.816 7.459 132 HE2 PHE 17 HE2 PHE 17 102.614 -4.797 5.118 133 HZ PHE 17 HZ PHE 17 104.463 -4.117 6.626 134 H MET 18 H MET 18 101.575 -10.098 4.550 135 HA MET 18 HA MET 18 99.599 -8.420 5.756 136 HB2 MET 18 HB2 MET 18 99.348 -10.733 3.791 137 HB3 MET 18 HB3 MET 18 97.980 -9.689 4.243 138 HG2 MET 18 HG2 MET 18 100.611 -8.567 3.211 139 HG3 MET 18 HG3 MET 18 99.277 -9.018 2.123 140 HE1 MET 18 HE1 MET 18 99.572 -5.013 2.685 141 HE2 MET 18 HE2 MET 18 99.919 -6.338 1.548 142 HE3 MET 18 HE3 MET 18 100.880 -6.168 3.037 143 H GLU 19 H GLU 19 100.531 -11.703 6.474 144 HA GLU 19 HA GLU 19 97.981 -12.377 7.807 145 HB2 GLU 19 HB3 GLU 19 99.413 -14.158 6.886 146 HB3 GLU 19 HB2 GLU 19 100.745 -13.663 7.958 147 HG2 GLU 19 HG2 GLU 19 99.397 -14.207 9.937 148 HG3 GLU 19 HG3 GLU 19 98.006 -14.617 8.904 149 H LYS 20 H LYS 20 101.157 -11.085 8.735 150 HA LYS 20 HA LYS 20 100.711 -11.289 11.603 151 HB2 LYS 20 HB3 LYS 20 102.478 -9.478 9.908 152 HB3 LYS 20 HB2 LYS 20 102.489 -9.459 11.687 153 HG2 LYS 20 HG2 LYS 20 102.771 -12.095 10.247 154 HG3 LYS 20 HG3 LYS 20 104.181 -11.014 10.357 155 HD2 LYS 20 HD2 LYS 20 103.866 -10.907 12.835 156 HD3 LYS 20 HD3 LYS 20 102.518 -12.060 12.693 157 HE2 LYS 20 HE2 LYS 20 103.917 -13.841 12.391 158 HE3 LYS 20 HE3 LYS 20 105.019 -12.918 11.342 159 HZ1 LYS 20 HZ1 LYS 20 106.057 -13.496 13.433 160 HZ2 LYS 20 HZ2 LYS 20 104.880 -12.714 14.284 161 HZ3 LYS 20 HZ3 LYS 20 105.902 -11.859 13.311 162 H MET 21 H MET 21 100.155 -8.676 9.211 163 HA MET 21 HA MET 21 99.174 -6.758 11.140 164 HB2 MET 21 HB3 MET 21 99.347 -7.009 8.243 165 HB3 MET 21 HB2 MET 21 97.761 -6.352 8.710 166 HG2 MET 21 HG2 MET 21 99.000 -4.709 10.212 167 HG3 MET 21 HG3 MET 21 100.510 -5.270 9.454 168 HE1 MET 21 HE1 MET 21 100.775 -3.688 6.175 169 HE2 MET 21 HE2 MET 21 101.543 -3.987 7.752 170 HE3 MET 21 HE3 MET 21 100.850 -5.342 6.829 171 H GLY 22 H GLY 22 97.910 -9.754 10.165 172 HA2 GLY 22 HA2 GLY 22 95.883 -10.762 10.919 173 HA3 GLY 22 HA3 GLY 22 95.403 -9.206 11.639 174 H VAL 23 H VAL 23 96.432 -9.579 8.273 175 HA VAL 23 HA VAL 23 93.929 -8.320 7.365 176 HB VAL 23 HB VAL 23 96.064 -9.681 5.672 177 HG11 VAL 23 HG11 VAL 23 93.961 -9.051 4.520 178 HG12 VAL 23 HG12 VAL 23 94.119 -7.391 5.142 179 HG13 VAL 23 HG13 VAL 23 95.315 -8.026 3.987 180 HG21 VAL 23 HG21 VAL 23 96.074 -6.725 6.222 181 HG22 VAL 23 HG22 VAL 23 96.718 -7.807 7.480 182 HG23 VAL 23 HG23 VAL 23 97.431 -7.815 5.850 183 H ASN 24 H ASN 24 92.115 -9.323 6.592 184 HA ASN 24 HA ASN 24 91.504 -12.016 7.122 185 HB2 ASN 24 HB2 ASN 24 89.963 -10.132 6.252 186 HB3 ASN 24 HB3 ASN 24 90.496 -10.610 4.622 187 HD21 ASN 24 HD21 ASN 24 88.662 -11.664 7.496 188 HD22 ASN 24 HD22 ASN 24 87.922 -13.047 6.722 189 H ILE 25 H ILE 25 90.983 -13.703 5.263 190 HA ILE 25 HA ILE 25 93.605 -14.213 3.954 191 HB ILE 25 HB ILE 25 91.077 -15.773 4.445 192 HG12 ILE 25 HG12 ILE 25 93.257 -15.657 5.897 193 HG13 ILE 25 HG13 ILE 25 92.526 -17.246 5.573 194 HG21 ILE 25 HG21 ILE 25 92.051 -17.600 2.971 195 HG22 ILE 25 HG22 ILE 25 91.405 -16.196 2.089 196 HG23 ILE 25 HG23 ILE 25 93.162 -16.377 2.308 197 HD11 ILE 25 HD11 ILE 25 95.108 -16.943 5.214 198 HD12 ILE 25 HD12 ILE 25 94.632 -16.121 3.709 199 HD13 ILE 25 HD13 ILE 25 94.168 -17.818 3.981 200 H VAL 26 H VAL 26 90.936 -12.462 3.231 201 HA VAL 26 HA VAL 26 90.697 -13.185 0.370 202 HB VAL 26 HB VAL 26 89.653 -10.774 1.924 203 HG11 VAL 26 HG11 VAL 26 89.813 -10.381 -0.519 204 HG12 VAL 26 HG12 VAL 26 88.921 -11.892 -0.820 205 HG13 VAL 26 HG13 VAL 26 88.116 -10.529 -0.005 206 HG21 VAL 26 HG21 VAL 26 87.760 -12.830 0.983 207 HG22 VAL 26 HG22 VAL 26 88.937 -13.458 2.161 208 HG23 VAL 26 HG23 VAL 26 87.907 -12.070 2.586 209 H LYS 27 H LYS 27 91.712 -10.193 2.097 210 HA LYS 27 HA LYS 27 93.000 -9.087 -0.263 211 HB2 LYS 27 HB2 LYS 27 92.963 -8.489 2.682 212 HB3 LYS 27 HB3 LYS 27 94.296 -7.806 1.722 213 HG2 LYS 27 HG2 LYS 27 92.415 -6.222 1.786 214 HG3 LYS 27 HG3 LYS 27 92.622 -6.848 0.132 215 HD2 LYS 27 HD2 LYS 27 90.751 -8.305 0.330 216 HD3 LYS 27 HD3 LYS 27 90.715 -8.154 2.103 217 HE2 LYS 27 HE2 LYS 27 90.280 -5.768 0.270 218 HE3 LYS 27 HE3 LYS 27 88.940 -6.817 0.793 219 HZ1 LYS 27 HZ1 LYS 27 89.233 -4.943 2.271 220 HZ2 LYS 27 HZ2 LYS 27 89.550 -6.349 3.071 221 HZ3 LYS 27 HZ3 LYS 27 90.792 -5.378 2.586 222 H ARG 28 H ARG 28 93.913 -11.442 2.132 223 HA ARG 28 HA ARG 28 96.809 -11.209 1.713 224 HB2 ARG 28 HB2 ARG 28 95.517 -12.302 3.699 225 HB3 ARG 28 HB3 ARG 28 95.374 -13.719 2.632 226 HG2 ARG 28 HG2 ARG 28 97.957 -13.414 2.291 227 HG3 ARG 28 HG3 ARG 28 97.869 -12.441 3.779 228 HD2 ARG 28 HD3 ARG 28 96.969 -15.337 3.443 229 HD3 ARG 28 HD2 ARG 28 98.380 -14.764 4.365 230 HE ARG 28 HE ARG 28 95.806 -13.583 5.238 231 HH11 ARG 28 HH11 ARG 28 95.192 -14.165 7.335 232 HH12 ARG 28 HH12 ARG 28 96.000 -15.488 8.146 233 HH21 ARG 28 HH21 ARG 28 98.131 -16.163 5.478 234 HH22 ARG 28 HH22 ARG 28 97.656 -16.614 7.101 235 H LYS 29 H LYS 29 94.204 -13.304 0.412 236 HA LYS 29 HA LYS 29 96.063 -14.852 -1.246 237 HB2 LYS 29 HB2 LYS 29 93.868 -15.757 -0.574 238 HB3 LYS 29 HB3 LYS 29 93.045 -14.455 -1.465 239 HG2 LYS 29 HG3 LYS 29 93.996 -15.253 -3.580 240 HG3 LYS 29 HG2 LYS 29 94.936 -16.495 -2.719 241 HD2 LYS 29 HD3 LYS 29 92.740 -17.426 -1.851 242 HD3 LYS 29 HD2 LYS 29 91.904 -16.298 -2.945 243 HE2 LYS 29 HE2 LYS 29 92.225 -18.603 -3.921 244 HE3 LYS 29 HE3 LYS 29 92.967 -17.308 -4.890 245 HZ1 LYS 29 HZ1 LYS 29 94.305 -19.425 -4.252 246 HZ2 LYS 29 HZ2 LYS 29 94.571 -18.618 -2.839 247 HZ3 LYS 29 HZ3 LYS 29 95.044 -17.951 -4.272 248 H LEU 30 H LEU 30 94.101 -11.929 -1.693 249 HA LEU 30 HA LEU 30 94.797 -11.833 -4.586 250 HB2 LEU 30 HB2 LEU 30 93.323 -9.854 -2.795 251 HB3 LEU 30 HB3 LEU 30 93.519 -9.691 -4.557 252 HG LEU 30 HG LEU 30 92.388 -12.256 -3.437 253 HD11 LEU 30 HD11 LEU 30 91.104 -10.446 -2.327 254 HD12 LEU 30 HD12 LEU 30 90.113 -11.276 -3.550 255 HD13 LEU 30 HD13 LEU 30 90.817 -9.680 -3.908 256 HD21 LEU 30 HD21 LEU 30 92.938 -12.045 -5.847 257 HD22 LEU 30 HD22 LEU 30 91.888 -10.613 -5.961 258 HD23 LEU 30 HD23 LEU 30 91.182 -12.208 -5.604 259 H ALA 31 H ALA 31 96.146 -10.931 -1.646 260 HA ALA 31 HA ALA 31 97.530 -8.499 -2.517 261 HB1 ALA 31 HB1 ALA 31 99.066 -9.311 -0.478 262 HB2 ALA 31 HB2 ALA 31 97.676 -10.380 -0.174 263 HB3 ALA 31 HB3 ALA 31 97.452 -8.614 -0.200 264 H ALA 32 H ALA 32 98.619 -11.903 -2.017 265 HA ALA 32 HA ALA 32 101.280 -11.705 -2.816 266 HB1 ALA 32 HB1 ALA 32 101.068 -13.989 -3.757 267 HB2 ALA 32 HB2 ALA 32 100.179 -13.844 -2.221 268 HB3 ALA 32 HB3 ALA 32 99.296 -13.820 -3.767 269 H HIS 33 H HIS 33 98.466 -11.059 -4.768 270 HA HIS 33 HA HIS 33 100.065 -11.188 -7.296 271 HB2 HIS 33 HB3 HIS 33 97.516 -11.832 -6.928 272 HB3 HIS 33 HB2 HIS 33 97.261 -10.082 -7.125 273 HD2 HIS 33 HD2 HIS 33 96.090 -11.531 -9.654 274 HE1 HIS 33 HE1 HIS 33 99.826 -11.048 -11.565 275 HE2 HIS 33 HE2 HIS 33 97.355 -11.560 -11.955 276 H ASP 34 H ASP 34 101.137 -9.342 -5.506 277 HA ASP 34 HA ASP 34 100.063 -6.674 -5.768 278 HB2 ASP 34 HB3 ASP 34 102.854 -7.752 -5.242 279 HB3 ASP 34 HB2 ASP 34 102.516 -6.006 -5.314 280 H ASN 35 H ASN 35 99.870 -5.469 -7.566 281 HA ASN 35 HA ASN 35 102.060 -5.557 -9.606 282 HB2 ASN 35 HB2 ASN 35 99.154 -6.288 -10.124 283 HB3 ASN 35 HB3 ASN 35 100.219 -5.688 -11.418 284 HD21 ASN 35 HD21 ASN 35 99.037 -8.528 -10.271 285 HD22 ASN 35 HD22 ASN 35 100.404 -9.576 -10.577 286 H LEU 36 H LEU 36 101.441 -3.530 -7.734 287 HA LEU 36 HA LEU 36 99.714 -1.569 -9.163 288 HB2 LEU 36 HB2 LEU 36 99.944 -0.183 -7.224 289 HB3 LEU 36 HB3 LEU 36 99.762 -1.847 -6.626 290 HG LEU 36 HG LEU 36 102.564 -0.965 -7.154 291 HD11 LEU 36 HD11 LEU 36 101.585 1.089 -6.165 292 HD12 LEU 36 HD12 LEU 36 100.928 0.127 -4.820 293 HD13 LEU 36 HD13 LEU 36 102.689 0.291 -5.019 294 HD21 LEU 36 HD21 LEU 36 101.551 -2.102 -4.563 295 HD22 LEU 36 HD22 LEU 36 103.035 -2.484 -5.468 296 HD23 LEU 36 HD23 LEU 36 101.471 -3.137 -6.009 297 H LYS 37 H LYS 37 100.487 0.636 -9.550 298 HA LYS 37 HA LYS 37 103.362 0.628 -10.500 299 HB2 LYS 37 HB2 LYS 37 100.830 1.355 -11.777 300 HB3 LYS 37 HB3 LYS 37 101.959 2.730 -11.766 301 HG2 LYS 37 HG2 LYS 37 103.711 1.320 -12.780 302 HG3 LYS 37 HG3 LYS 37 102.615 -0.083 -12.752 303 HD2 LYS 37 HD2 LYS 37 102.275 0.670 -14.931 304 HD3 LYS 37 HD3 LYS 37 101.003 1.576 -14.078 305 HE2 LYS 37 HE2 LYS 37 102.128 3.201 -15.419 306 HE3 LYS 37 HE3 LYS 37 102.766 3.439 -13.775 307 HZ1 LYS 37 HZ1 LYS 37 104.096 1.672 -15.712 308 HZ2 LYS 37 HZ2 LYS 37 104.718 2.334 -14.335 309 HZ3 LYS 37 HZ3 LYS 37 104.427 3.287 -15.650 310 H LEU 38 H LEU 38 104.649 2.409 -9.913 311 HA LEU 38 HA LEU 38 103.312 4.678 -8.502 312 HB2 LEU 38 HB2 LEU 38 104.624 4.449 -6.471 313 HB3 LEU 38 HB3 LEU 38 103.771 2.913 -6.755 314 HG LEU 38 HG LEU 38 106.661 3.488 -7.549 315 HD11 LEU 38 HD11 LEU 38 105.835 3.164 -5.004 316 HD12 LEU 38 HD12 LEU 38 105.891 1.452 -5.484 317 HD13 LEU 38 HD13 LEU 38 107.356 2.457 -5.600 318 HD21 LEU 38 HD21 LEU 38 106.468 0.822 -7.632 319 HD22 LEU 38 HD22 LEU 38 106.007 1.821 -9.031 320 HD23 LEU 38 HD23 LEU 38 104.754 1.191 -7.935 321 H THR 39 H THR 39 104.510 6.570 -8.588 322 HA THR 39 HA THR 39 107.031 6.379 -10.238 323 HB THR 39 HB THR 39 105.541 8.943 -9.608 324 HG1 THR 39 HG1 THR 39 104.326 8.505 -11.533 325 HG21 THR 39 HG21 THR 39 106.472 9.583 -11.815 326 HG22 THR 39 HG22 THR 39 107.176 7.958 -11.989 327 HG23 THR 39 HG23 THR 39 107.759 9.049 -10.708 328 H ILE 40 H ILE 40 108.960 7.309 -9.448 329 HA ILE 40 HA ILE 40 108.772 8.443 -6.652 330 HB ILE 40 HB ILE 40 110.538 6.202 -7.677 331 HG12 ILE 40 HG12 ILE 40 109.303 6.383 -4.940 332 HG13 ILE 40 HG13 ILE 40 108.219 6.099 -6.323 333 HG21 ILE 40 HG21 ILE 40 111.668 6.561 -5.328 334 HG22 ILE 40 HG22 ILE 40 111.074 8.230 -5.494 335 HG23 ILE 40 HG23 ILE 40 112.196 7.561 -6.703 336 HD11 ILE 40 HD11 ILE 40 109.002 3.958 -5.351 337 HD12 ILE 40 HD12 ILE 40 109.606 4.165 -7.012 338 HD13 ILE 40 HD13 ILE 40 110.690 4.449 -5.629 339 H THR 41 H THR 41 109.836 10.317 -6.430 340 HA THR 41 HA THR 41 112.055 10.917 -8.387 341 HB THR 41 HB THR 41 110.212 13.087 -7.386 342 HG1 THR 41 HG1 THR 41 108.741 11.714 -8.298 343 HG21 THR 41 HG21 THR 41 110.865 14.109 -9.547 344 HG22 THR 41 HG22 THR 41 111.786 12.643 -9.961 345 HG23 THR 41 HG23 THR 41 112.298 13.659 -8.592 346 H GLN 42 H GLN 42 113.689 12.336 -7.523 347 HA GLN 42 HA GLN 42 113.473 12.776 -4.540 348 HB2 GLN 42 HB3 GLN 42 114.876 10.776 -4.959 349 HB3 GLN 42 HB2 GLN 42 115.898 11.722 -6.068 350 HG2 GLN 42 HG3 GLN 42 116.379 13.301 -4.144 351 HG3 GLN 42 HG2 GLN 42 115.525 12.163 -3.075 352 HE21 GLN 42 HE21 GLN 42 117.741 11.470 -5.855 353 HE22 GLN 42 HE22 GLN 42 118.895 10.572 -4.895 354 H GLU 43 H GLU 43 114.141 14.794 -3.895 355 HA GLU 43 HA GLU 43 115.665 16.425 -5.937 356 HB2 GLU 43 HB2 GLU 43 113.145 17.092 -4.406 357 HB3 GLU 43 HB3 GLU 43 114.279 18.392 -4.845 358 HG2 GLU 43 HG2 GLU 43 113.316 16.369 -6.894 359 HG3 GLU 43 HG3 GLU 43 112.381 17.839 -6.529 360 H GLY 44 H GLY 44 117.521 15.712 -4.597 361 HA2 GLY 44 HA2 GLY 44 119.091 16.094 -2.879 362 HA3 GLY 44 HA3 GLY 44 118.407 17.734 -2.806 363 H ASN 45 H ASN 45 116.449 18.027 -1.437 364 HA ASN 45 HA ASN 45 116.394 16.000 0.813 365 HB2 ASN 45 HB2 ASN 45 115.680 18.760 1.566 366 HB3 ASN 45 HB3 ASN 45 116.788 17.616 2.359 367 HD21 ASN 45 HD21 ASN 45 119.052 17.657 1.753 368 HD22 ASN 45 HD22 ASN 45 119.707 18.939 0.759 369 H LYS 46 H LYS 46 114.646 16.307 -1.588 370 HA LYS 46 HA LYS 46 112.082 16.432 -0.054 371 HB2 LYS 46 HB3 LYS 46 112.829 18.159 -2.432 372 HB3 LYS 46 HB2 LYS 46 111.136 17.689 -2.153 373 HG2 LYS 46 HG3 LYS 46 110.977 19.403 -0.683 374 HG3 LYS 46 HG2 LYS 46 112.116 18.531 0.371 375 HD2 LYS 46 HD2 LYS 46 114.021 19.596 -0.806 376 HD3 LYS 46 HD3 LYS 46 112.883 20.465 -1.863 377 HE2 LYS 46 HE2 LYS 46 112.119 21.844 -0.127 378 HE3 LYS 46 HE3 LYS 46 112.615 20.695 1.139 379 HZ1 LYS 46 HZ1 LYS 46 114.101 22.583 1.019 380 HZ2 LYS 46 HZ2 LYS 46 114.445 22.267 -0.563 381 HZ3 LYS 46 HZ3 LYS 46 114.905 21.202 0.609 382 H PHE 47 H PHE 47 111.391 14.446 -0.369 383 HA PHE 47 HA PHE 47 111.906 13.070 -2.985 384 HB2 PHE 47 HB3 PHE 47 111.048 12.210 -0.216 385 HB3 PHE 47 HB2 PHE 47 110.673 11.170 -1.609 386 HD1 PHE 47 HD1 PHE 47 113.552 13.141 -0.195 387 HD2 PHE 47 HD2 PHE 47 112.262 9.601 -2.256 388 HE1 PHE 47 HE1 PHE 47 115.879 12.284 -0.177 389 HE2 PHE 47 HE2 PHE 47 114.589 8.744 -2.242 390 HZ PHE 47 HZ PHE 47 116.398 10.086 -1.202 391 H THR 48 H THR 48 110.068 11.965 -4.058 392 HA THR 48 HA THR 48 107.360 12.920 -3.268 393 HB THR 48 HB THR 48 108.529 13.525 -6.022 394 HG1 THR 48 HG1 THR 48 109.229 15.273 -5.076 395 HG21 THR 48 HG21 THR 48 106.411 14.777 -6.331 396 HG22 THR 48 HG22 THR 48 106.096 13.056 -6.002 397 HG23 THR 48 HG23 THR 48 105.872 14.263 -4.714 398 H VAL 49 H VAL 49 106.569 10.872 -3.112 399 HA VAL 49 HA VAL 49 107.024 9.039 -5.470 400 HB VAL 49 HB VAL 49 107.835 7.916 -3.560 401 HG11 VAL 49 HG11 VAL 49 106.287 7.864 -1.440 402 HG12 VAL 49 HG12 VAL 49 105.536 9.305 -2.166 403 HG13 VAL 49 HG13 VAL 49 107.268 9.315 -1.756 404 HG21 VAL 49 HG21 VAL 49 106.406 6.057 -3.336 405 HG22 VAL 49 HG22 VAL 49 104.936 7.058 -3.392 406 HG23 VAL 49 HG23 VAL 49 105.873 6.770 -4.877 407 H LYS 50 H LYS 50 105.287 8.488 -6.693 408 HA LYS 50 HA LYS 50 102.561 9.202 -5.580 409 HB2 LYS 50 HB2 LYS 50 103.054 10.715 -7.392 410 HB3 LYS 50 HB3 LYS 50 103.667 9.392 -8.412 411 HG2 LYS 50 HG2 LYS 50 101.487 8.469 -8.709 412 HG3 LYS 50 HG3 LYS 50 100.812 9.427 -7.369 413 HD2 LYS 50 HD3 LYS 50 100.968 11.466 -8.623 414 HD3 LYS 50 HD2 LYS 50 101.990 10.706 -9.866 415 HE2 LYS 50 HE2 LYS 50 99.112 9.893 -9.268 416 HE3 LYS 50 HE3 LYS 50 99.595 10.988 -10.585 417 HZ1 LYS 50 HZ1 LYS 50 101.219 8.853 -10.882 418 HZ2 LYS 50 HZ2 LYS 50 99.845 9.133 -11.751 419 HZ3 LYS 50 HZ3 LYS 50 99.798 8.148 -10.429 420 H GLU 51 H GLU 51 101.876 7.186 -4.877 421 HA GLU 51 HA GLU 51 102.416 4.753 -6.448 422 HB2 GLU 51 HB2 GLU 51 100.439 5.269 -4.178 423 HB3 GLU 51 HB3 GLU 51 100.896 3.668 -4.809 424 HG2 GLU 51 HG2 GLU 51 103.130 3.870 -4.021 425 HG3 GLU 51 HG3 GLU 51 102.982 5.630 -3.798 426 H SER 52 H SER 52 100.749 3.452 -7.511 427 HA SER 52 HA SER 52 98.125 4.712 -8.017 428 HB2 SER 52 HB3 SER 52 99.901 4.222 -10.429 429 HB3 SER 52 HB2 SER 52 98.374 5.134 -10.340 430 HG SER 52 HG SER 52 100.966 5.906 -9.624 431 H SER 53 H SER 53 97.012 2.951 -7.558 432 HA SER 53 HA SER 53 97.594 0.472 -9.171 433 HB2 SER 53 HB3 SER 53 97.788 -0.834 -7.318 434 HB3 SER 53 HB2 SER 53 98.049 0.683 -6.424 435 HG SER 53 HG SER 53 96.325 -0.269 -5.431 436 H ALA 54 H ALA 54 95.705 -0.601 -9.867 437 HA ALA 54 HA ALA 54 93.340 0.994 -10.177 438 HB1 ALA 54 HB1 ALA 54 92.250 -1.117 -10.892 439 HB2 ALA 54 HB2 ALA 54 93.610 -2.047 -10.218 440 HB3 ALA 54 HB3 ALA 54 93.874 -0.963 -11.605 441 H PHE 55 H PHE 55 94.521 0.067 -7.305 442 HA PHE 55 HA PHE 55 91.793 -0.605 -6.195 443 HB2 PHE 55 HB2 PHE 55 94.597 -1.284 -5.253 444 HB3 PHE 55 HB3 PHE 55 93.183 -1.414 -4.180 445 HD1 PHE 55 HD1 PHE 55 94.937 -2.833 -7.068 446 HD2 PHE 55 HD2 PHE 55 91.333 -2.981 -4.733 447 HE1 PHE 55 HE1 PHE 55 94.367 -5.023 -8.084 448 HE2 PHE 55 HE2 PHE 55 90.765 -5.170 -5.749 449 HZ PHE 55 HZ PHE 55 92.282 -6.192 -7.423 450 H ARG 56 H ARG 56 94.369 1.787 -6.168 451 HA ARG 56 HA ARG 56 92.920 3.814 -4.925 452 HB2 ARG 56 HB2 ARG 56 93.687 1.744 -2.961 453 HB3 ARG 56 HB3 ARG 56 94.236 3.375 -2.510 454 HG2 ARG 56 HG3 ARG 56 91.415 3.017 -3.517 455 HG3 ARG 56 HG2 ARG 56 91.799 2.538 -1.846 456 HD2 ARG 56 HD3 ARG 56 92.654 4.772 -1.351 457 HD3 ARG 56 HD2 ARG 56 92.448 5.265 -3.049 458 HE ARG 56 HE ARG 56 89.881 4.512 -2.383 459 HH11 ARG 56 HH11 ARG 56 88.395 5.858 -1.341 460 HH12 ARG 56 HH12 ARG 56 88.960 7.156 -0.314 461 HH21 ARG 56 HH21 ARG 56 92.329 6.443 -0.832 462 HH22 ARG 56 HH22 ARG 56 91.178 7.486 -0.027 463 H ASN 57 H ASN 57 94.392 4.841 -6.385 464 HA ASN 57 HA ASN 57 97.267 4.693 -6.111 465 HB2 ASN 57 HB2 ASN 57 97.302 6.742 -7.464 466 HB3 ASN 57 HB3 ASN 57 96.068 5.629 -8.101 467 HD21 ASN 57 HD21 ASN 57 93.902 6.024 -6.398 468 HD22 ASN 57 HD22 ASN 57 93.383 7.693 -6.472 469 H ILE 58 H ILE 58 98.733 6.057 -5.009 470 HA ILE 58 HA ILE 58 97.496 7.962 -3.026 471 HB ILE 58 HB ILE 58 99.835 6.259 -2.208 472 HG12 ILE 58 HG12 ILE 58 96.929 5.409 -2.377 473 HG13 ILE 58 HG13 ILE 58 98.385 4.510 -2.873 474 HG21 ILE 58 HG21 ILE 58 98.733 8.306 -0.960 475 HG22 ILE 58 HG22 ILE 58 99.162 6.846 -0.036 476 HG23 ILE 58 HG23 ILE 58 97.474 7.125 -0.527 477 HD11 ILE 58 HD11 ILE 58 97.853 3.494 -0.822 478 HD12 ILE 58 HD12 ILE 58 97.313 5.026 -0.093 479 HD13 ILE 58 HD13 ILE 58 99.050 4.719 -0.336 480 H GLU 59 H GLU 59 99.347 9.212 -1.906 481 HA GLU 59 HA GLU 59 101.740 9.606 -3.637 482 HB2 GLU 59 HB2 GLU 59 101.293 11.848 -4.256 483 HB3 GLU 59 HB3 GLU 59 99.742 11.022 -4.535 484 HG2 GLU 59 HG2 GLU 59 99.304 11.703 -1.997 485 HG3 GLU 59 HG3 GLU 59 100.520 12.952 -2.354 486 H CYS 60 H CYS 60 103.436 10.618 -2.510 487 HA CYS 60 HA CYS 60 102.851 11.763 0.184 488 HB2 CYS 60 HB2 CYS 60 104.229 9.119 -0.286 489 HB3 CYS 60 HB3 CYS 60 104.784 10.157 1.048 490 HG CYS 60 HG CYS 60 101.400 9.758 0.836 491 H VAL 61 H VAL 61 103.933 13.664 -0.037 492 HA VAL 61 HA VAL 61 106.684 13.558 -1.293 493 HB VAL 61 HB VAL 61 105.357 16.177 -0.774 494 HG11 VAL 61 HG11 VAL 61 106.213 16.555 -3.125 495 HG12 VAL 61 HG12 VAL 61 106.850 14.894 -3.099 496 HG13 VAL 61 HG13 VAL 61 107.475 16.105 -1.953 497 HG21 VAL 61 HG21 VAL 61 104.016 15.862 -2.943 498 HG22 VAL 61 HG22 VAL 61 103.382 15.040 -1.498 499 HG23 VAL 61 HG23 VAL 61 104.276 14.114 -2.728 500 H PHE 62 H PHE 62 108.439 14.307 -0.065 501 HA PHE 62 HA PHE 62 108.214 16.031 2.207 502 HB2 PHE 62 HB2 PHE 62 107.441 13.231 2.718 503 HB3 PHE 62 HB3 PHE 62 108.724 13.814 3.805 504 HD1 PHE 62 HD1 PHE 62 105.303 13.481 3.588 505 HD2 PHE 62 HD2 PHE 62 108.254 16.481 4.447 506 HE1 PHE 62 HE1 PHE 62 103.622 14.762 4.885 507 HE2 PHE 62 HE2 PHE 62 106.572 17.764 5.743 508 HZ PHE 62 HZ PHE 62 104.257 16.904 5.962 509 H GLU 63 H GLU 63 110.178 16.006 3.601 510 HA GLU 63 HA GLU 63 112.554 15.268 1.946 511 HB2 GLU 63 HB2 GLU 63 112.502 17.492 2.995 512 HB3 GLU 63 HB3 GLU 63 112.260 16.758 4.598 513 HG2 GLU 63 HG3 GLU 63 114.451 15.870 4.656 514 HG3 GLU 63 HG2 GLU 63 114.654 16.013 2.893 515 H LEU 64 H LEU 64 114.467 14.255 3.231 516 HA LEU 64 HA LEU 64 113.343 11.869 4.632 517 HB2 LEU 64 HB2 LEU 64 115.510 10.878 4.352 518 HB3 LEU 64 HB3 LEU 64 115.161 11.743 2.837 519 HG LEU 64 HG LEU 64 116.381 13.738 4.219 520 HD11 LEU 64 HD11 LEU 64 116.797 12.293 6.196 521 HD12 LEU 64 HD12 LEU 64 118.326 12.783 5.429 522 HD13 LEU 64 HD13 LEU 64 117.685 11.143 5.168 523 HD21 LEU 64 HD21 LEU 64 116.978 12.896 1.960 524 HD22 LEU 64 HD22 LEU 64 118.432 13.135 2.959 525 HD23 LEU 64 HD23 LEU 64 117.791 11.495 2.698 526 H GLY 65 H GLY 65 113.404 11.580 6.813 527 HA2 GLY 65 HA3 GLY 65 114.737 11.838 8.929 528 HA3 GLY 65 HA2 GLY 65 115.158 13.480 8.389 529 H VAL 66 H VAL 66 112.337 13.892 7.363 530 HA VAL 66 HA VAL 66 111.213 14.672 10.031 531 HB VAL 66 HB VAL 66 110.162 15.331 7.247 532 HG11 VAL 66 HG11 VAL 66 108.574 15.650 9.126 533 HG12 VAL 66 HG12 VAL 66 109.091 17.215 8.454 534 HG13 VAL 66 HG13 VAL 66 109.787 16.630 9.984 535 HG21 VAL 66 HG21 VAL 66 112.509 16.092 7.504 536 HG22 VAL 66 HG22 VAL 66 112.083 16.887 9.038 537 HG23 VAL 66 HG23 VAL 66 111.387 17.473 7.508 538 H THR 67 H THR 67 109.817 13.294 10.998 539 HA THR 67 HA THR 67 108.715 10.960 9.800 540 HB THR 67 HB THR 67 107.124 12.423 11.891 541 HG1 THR 67 HG1 THR 67 109.175 12.849 12.612 542 HG21 THR 67 HG21 THR 67 106.772 10.237 12.748 543 HG22 THR 67 HG22 THR 67 106.734 10.023 10.982 544 HG23 THR 67 HG23 THR 67 108.194 9.583 11.901 545 H PHE 68 H PHE 68 106.818 10.482 8.816 546 HA PHE 68 HA PHE 68 104.768 12.596 8.402 547 HB2 PHE 68 HB2 PHE 68 104.898 11.780 5.831 548 HB3 PHE 68 HB3 PHE 68 105.791 13.200 6.422 549 HD1 PHE 68 HD1 PHE 68 106.181 9.457 6.207 550 HD2 PHE 68 HD2 PHE 68 108.059 13.313 5.980 551 HE1 PHE 68 HE1 PHE 68 108.328 8.379 5.573 552 HE2 PHE 68 HE2 PHE 68 110.199 12.234 5.356 553 HZ PHE 68 HZ PHE 68 110.331 9.770 5.149 554 H ASN 69 H ASN 69 103.163 11.297 6.572 555 HA ASN 69 HA ASN 69 103.048 8.460 7.540 556 HB2 ASN 69 HB2 ASN 69 100.785 8.627 8.308 557 HB3 ASN 69 HB3 ASN 69 101.661 9.984 9.056 558 HD21 ASN 69 HD21 ASN 69 100.716 12.013 8.789 559 HD22 ASN 69 HD22 ASN 69 99.551 12.405 7.545 560 H CYS 70 H CYS 70 101.835 7.072 6.208 561 HA CYS 70 HA CYS 70 100.637 8.236 3.725 562 HB2 CYS 70 HB2 CYS 70 102.896 6.182 3.738 563 HB3 CYS 70 HB3 CYS 70 101.928 6.617 2.309 564 HG CYS 70 HG CYS 70 104.414 8.384 3.834 565 H ASN 71 H ASN 71 98.758 7.145 3.315 566 HA ASN 71 HA ASN 71 98.194 4.766 5.008 567 HB2 ASN 71 HB2 ASN 71 96.237 5.642 2.928 568 HB3 ASN 71 HB3 ASN 71 95.975 5.227 4.639 569 HD21 ASN 71 HD21 ASN 71 96.209 7.842 2.427 570 HD22 ASN 71 HD22 ASN 71 96.393 9.124 3.603 571 H LEU 72 H LEU 72 97.830 2.678 4.261 572 HA LEU 72 HA LEU 72 98.895 2.155 1.501 573 HB2 LEU 72 HB3 LEU 72 98.243 0.247 3.792 574 HB3 LEU 72 HB2 LEU 72 99.016 -0.203 2.254 575 HG LEU 72 HG LEU 72 100.129 1.783 4.286 576 HD11 LEU 72 HD11 LEU 72 100.783 -1.106 3.593 577 HD12 LEU 72 HD12 LEU 72 101.942 -0.039 4.422 578 HD13 LEU 72 HD13 LEU 72 100.381 -0.422 5.186 579 HD21 LEU 72 HD21 LEU 72 102.202 1.234 2.670 580 HD22 LEU 72 HD22 LEU 72 101.049 2.538 2.296 581 HD23 LEU 72 HD23 LEU 72 100.891 0.954 1.499 582 H ALA 73 H ALA 73 97.695 0.994 -0.049 583 HA ALA 73 HA ALA 73 94.977 1.528 -0.373 584 HB1 ALA 73 HB1 ALA 73 94.873 -0.454 -1.861 585 HB2 ALA 73 HB2 ALA 73 96.386 0.451 -2.104 586 HB3 ALA 73 HB3 ALA 73 96.393 -1.058 -1.160 587 H ASP 74 H ASP 74 96.422 -0.951 1.688 588 HA ASP 74 HA ASP 74 93.957 -2.437 2.141 589 HB2 ASP 74 HB2 ASP 74 96.571 -2.145 3.654 590 HB3 ASP 74 HB3 ASP 74 95.222 -3.097 4.319 591 H GLY 75 H GLY 75 94.088 0.660 2.455 592 HA2 GLY 75 HA2 GLY 75 92.975 2.224 3.836 593 HA3 GLY 75 HA3 GLY 75 92.080 0.846 4.520 594 H THR 76 H THR 76 95.594 0.975 4.589 595 HA THR 76 HA THR 76 95.417 1.113 7.586 596 HB THR 76 HB THR 76 98.049 0.628 6.322 597 HG1 THR 76 HG1 THR 76 96.789 -0.482 4.825 598 HG21 THR 76 HG21 THR 76 98.068 -1.206 7.989 599 HG22 THR 76 HG22 THR 76 96.357 -0.884 8.361 600 HG23 THR 76 HG23 THR 76 97.596 0.338 8.737 601 H GLU 77 H GLU 77 97.105 2.376 8.700 602 HA GLU 77 HA GLU 77 98.004 4.765 7.080 603 HB2 GLU 77 HB2 GLU 77 95.955 5.035 8.737 604 HB3 GLU 77 HB3 GLU 77 97.221 5.013 9.989 605 HG2 GLU 77 HG3 GLU 77 98.398 6.861 8.835 606 HG3 GLU 77 HG2 GLU 77 97.138 6.880 7.578 607 H LEU 78 H LEU 78 100.213 4.857 7.143 608 HA LEU 78 HA LEU 78 101.532 3.834 9.676 609 HB2 LEU 78 HB2 LEU 78 102.210 3.367 6.761 610 HB3 LEU 78 HB3 LEU 78 103.479 3.283 8.008 611 HG LEU 78 HG LEU 78 100.944 1.820 8.614 612 HD11 LEU 78 HD11 LEU 78 101.251 1.317 6.206 613 HD12 LEU 78 HD12 LEU 78 102.936 0.840 6.522 614 HD13 LEU 78 HD13 LEU 78 101.598 -0.111 7.210 615 HD21 LEU 78 HD21 LEU 78 103.753 0.714 8.715 616 HD22 LEU 78 HD22 LEU 78 102.382 0.417 9.811 617 HD23 LEU 78 HD23 LEU 78 103.266 1.960 9.889 618 H ARG 79 H ARG 79 103.215 5.080 10.500 619 HA ARG 79 HA ARG 79 104.069 7.455 8.852 620 HB2 ARG 79 HB2 ARG 79 103.274 9.000 10.322 621 HB3 ARG 79 HB3 ARG 79 102.214 7.692 10.894 622 HG2 ARG 79 HG2 ARG 79 104.055 7.040 12.521 623 HG3 ARG 79 HG3 ARG 79 104.913 8.524 12.043 624 HD2 ARG 79 HD3 ARG 79 102.467 8.185 13.714 625 HD3 ARG 79 HD2 ARG 79 103.722 9.446 13.772 626 HE ARG 79 HE ARG 79 101.957 9.581 11.390 627 HH11 ARG 79 HH11 ARG 79 100.700 11.456 11.292 628 HH12 ARG 79 HH12 ARG 79 100.557 12.487 12.699 629 HH21 ARG 79 HH21 ARG 79 102.603 10.491 14.687 630 HH22 ARG 79 HH22 ARG 79 101.630 11.942 14.613 631 H GLY 80 H GLY 80 106.201 8.146 9.246 632 HA2 GLY 80 HA2 GLY 80 107.845 7.528 11.445 633 HA3 GLY 80 HA3 GLY 80 107.986 6.129 10.348 634 H THR 81 H THR 81 109.680 6.332 8.962 635 HA THR 81 HA THR 81 109.949 8.488 7.120 636 HB THR 81 HB THR 81 112.268 9.066 8.741 637 HG1 THR 81 HG1 THR 81 111.433 9.340 10.660 638 HG21 THR 81 HG21 THR 81 111.314 11.378 8.593 639 HG22 THR 81 HG22 THR 81 109.828 10.685 7.902 640 HG23 THR 81 HG23 THR 81 111.368 10.547 7.020 641 H TRP 82 H TRP 82 111.942 8.428 5.882 642 HA TRP 82 HA TRP 82 113.270 5.730 6.126 643 HB2 TRP 82 HB2 TRP 82 113.507 7.673 3.798 644 HB3 TRP 82 HB3 TRP 82 113.837 5.924 3.811 645 HD1 TRP 82 HD1 TRP 82 110.996 8.454 3.716 646 HE1 TRP 82 HE1 TRP 82 108.796 7.273 3.086 647 HE3 TRP 82 HE3 TRP 82 112.619 3.621 3.863 648 HZ2 TRP 82 HZ2 TRP 82 107.884 4.557 2.674 649 HZ3 TRP 82 HZ3 TRP 82 111.075 1.756 3.338 650 HH2 TRP 82 HH2 TRP 82 108.711 2.217 2.745 651 H SER 83 H SER 83 115.495 5.571 6.399 652 HA SER 83 HA SER 83 117.043 8.158 6.428 653 HB2 SER 83 HB2 SER 83 116.879 8.039 8.721 654 HB3 SER 83 HB3 SER 83 116.515 6.297 8.706 655 HG SER 83 HG SER 83 118.620 6.712 9.540 656 H LEU 84 H LEU 84 119.404 7.759 6.169 657 HA LEU 84 HA LEU 84 119.785 5.174 4.689 658 HB2 LEU 84 HB2 LEU 84 120.744 6.646 3.244 659 HB3 LEU 84 HB3 LEU 84 120.858 7.918 4.482 660 HG LEU 84 HG LEU 84 122.834 6.678 5.458 661 HD11 LEU 84 HD11 LEU 84 123.436 5.238 2.986 662 HD12 LEU 84 HD12 LEU 84 121.931 4.644 3.728 663 HD13 LEU 84 HD13 LEU 84 123.444 4.648 4.666 664 HD21 LEU 84 HD21 LEU 84 124.404 7.416 3.685 665 HD22 LEU 84 HD22 LEU 84 123.051 7.527 2.534 666 HD23 LEU 84 HD23 LEU 84 123.116 8.617 3.940 667 H GLU 85 H GLU 85 120.961 3.558 5.585 668 HA GLU 85 HA GLU 85 122.824 4.266 7.850 669 HB2 GLU 85 HB2 GLU 85 120.532 2.299 7.824 670 HB3 GLU 85 HB3 GLU 85 121.985 1.930 8.785 671 HG2 GLU 85 HG3 GLU 85 120.619 4.632 8.979 672 HG3 GLU 85 HG2 GLU 85 120.058 3.245 9.944 673 H GLY 86 H GLY 86 124.817 3.480 7.374 674 HA2 GLY 86 HA2 GLY 86 126.462 2.100 6.376 675 HA3 GLY 86 HA3 GLY 86 125.249 0.795 6.393 676 H ASN 87 H ASN 87 124.475 0.131 4.434 677 HA ASN 87 HA ASN 87 124.784 2.077 2.135 678 HB2 ASN 87 HB2 ASN 87 125.003 -0.928 1.812 679 HB3 ASN 87 HB3 ASN 87 125.568 0.356 0.717 680 HD21 ASN 87 HD21 ASN 87 126.550 -1.791 3.210 681 HD22 ASN 87 HD22 ASN 87 128.073 -1.020 3.592 682 H LYS 88 H LYS 88 122.358 1.610 3.791 683 HA LYS 88 HA LYS 88 120.616 0.749 1.503 684 HB2 LYS 88 HB2 LYS 88 119.243 -0.451 3.482 685 HB3 LYS 88 HB3 LYS 88 120.503 -1.302 2.556 686 HG2 LYS 88 HG3 LYS 88 122.061 -1.160 4.285 687 HG3 LYS 88 HG2 LYS 88 121.306 0.292 4.986 688 HD2 LYS 88 HD3 LYS 88 119.443 -1.015 5.839 689 HD3 LYS 88 HD2 LYS 88 120.015 -2.469 4.988 690 HE2 LYS 88 HE2 LYS 88 122.234 -2.047 6.364 691 HE3 LYS 88 HE3 LYS 88 121.161 -1.108 7.430 692 HZ1 LYS 88 HZ1 LYS 88 121.291 -3.412 8.106 693 HZ2 LYS 88 HZ2 LYS 88 120.752 -3.921 6.633 694 HZ3 LYS 88 HZ3 LYS 88 119.757 -3.051 7.620 695 H LEU 89 H LEU 89 118.377 1.465 1.754 696 HA LEU 89 HA LEU 89 118.244 3.939 3.461 697 HB2 LEU 89 HB2 LEU 89 117.000 3.017 0.913 698 HB3 LEU 89 HB3 LEU 89 115.926 3.934 1.996 699 HG LEU 89 HG LEU 89 118.721 4.946 1.446 700 HD11 LEU 89 HD11 LEU 89 117.722 4.483 -0.775 701 HD12 LEU 89 HD12 LEU 89 116.266 5.394 -0.309 702 HD13 LEU 89 HD13 LEU 89 117.826 6.234 -0.474 703 HD21 LEU 89 HD21 LEU 89 117.326 5.999 3.206 704 HD22 LEU 89 HD22 LEU 89 116.035 6.279 2.013 705 HD23 LEU 89 HD23 LEU 89 117.595 7.119 1.848 706 H ILE 90 H ILE 90 117.447 3.534 5.469 707 HA ILE 90 HA ILE 90 115.680 1.215 5.918 708 HB ILE 90 HB ILE 90 115.521 2.478 8.264 709 HG12 ILE 90 HG13 ILE 90 118.132 3.510 7.100 710 HG13 ILE 90 HG12 ILE 90 116.668 4.510 7.283 711 HG21 ILE 90 HG21 ILE 90 116.582 0.278 7.826 712 HG22 ILE 90 HG22 ILE 90 118.032 1.103 7.206 713 HG23 ILE 90 HG23 ILE 90 117.579 1.267 8.919 714 HD11 ILE 90 HD11 ILE 90 116.633 4.035 9.699 715 HD12 ILE 90 HD12 ILE 90 118.069 2.998 9.526 716 HD13 ILE 90 HD13 ILE 90 118.194 4.749 9.229 717 H GLY 91 H GLY 91 113.625 1.466 7.106 718 HA2 GLY 91 HA2 GLY 91 112.139 4.000 6.532 719 HA3 GLY 91 HA3 GLY 91 111.531 2.508 5.772 720 H LYS 92 H LYS 92 111.894 4.280 8.766 721 HA LYS 92 HA LYS 92 110.832 2.012 10.380 722 HB2 LYS 92 HB3 LYS 92 111.830 4.799 10.921 723 HB3 LYS 92 HB2 LYS 92 110.710 4.070 12.097 724 HG2 LYS 92 HG3 LYS 92 112.180 2.150 12.390 725 HG3 LYS 92 HG2 LYS 92 113.247 2.716 11.083 726 HD2 LYS 92 HD2 LYS 92 114.029 4.555 12.361 727 HD3 LYS 92 HD3 LYS 92 112.675 4.445 13.510 728 HE2 LYS 92 HE3 LYS 92 114.923 3.550 14.354 729 HE3 LYS 92 HE2 LYS 92 113.549 2.427 14.483 730 HZ1 LYS 92 HZ1 LYS 92 115.762 1.653 13.433 731 HZ2 LYS 92 HZ2 LYS 92 114.333 1.174 12.762 732 HZ3 LYS 92 HZ3 LYS 92 115.198 2.398 12.074 733 H PHE 93 H PHE 93 108.720 1.576 9.844 734 HA PHE 93 HA PHE 93 106.834 3.943 9.840 735 HB2 PHE 93 HB2 PHE 93 106.916 1.385 8.236 736 HB3 PHE 93 HB3 PHE 93 105.347 2.150 8.571 737 HD1 PHE 93 HD1 PHE 93 107.461 4.852 8.627 738 HD2 PHE 93 HD2 PHE 93 105.915 1.985 5.829 739 HE1 PHE 93 HE1 PHE 93 107.851 6.451 6.773 740 HE2 PHE 93 HE2 PHE 93 106.305 3.584 3.975 741 HZ PHE 93 HZ PHE 93 107.271 5.818 4.447 742 H LYS 94 H LYS 94 104.866 3.718 10.921 743 HA LYS 94 HA LYS 94 104.484 1.207 12.516 744 HB2 LYS 94 HB2 LYS 94 104.355 2.319 14.615 745 HB3 LYS 94 HB3 LYS 94 105.816 2.980 13.844 746 HG2 LYS 94 HG2 LYS 94 104.285 4.849 12.933 747 HG3 LYS 94 HG3 LYS 94 103.076 4.267 14.103 748 HD2 LYS 94 HD2 LYS 94 104.172 5.869 15.391 749 HD3 LYS 94 HD3 LYS 94 105.126 4.422 15.795 750 HE2 LYS 94 HE3 LYS 94 106.559 5.131 13.690 751 HE3 LYS 94 HE2 LYS 94 105.831 6.730 13.976 752 HZ1 LYS 94 HZ1 LYS 94 107.899 6.467 15.177 753 HZ2 LYS 94 HZ2 LYS 94 106.645 6.624 16.237 754 HZ3 LYS 94 HZ3 LYS 94 107.320 5.143 15.972 755 H ARG 95 H ARG 95 102.400 0.594 12.320 756 HA ARG 95 HA ARG 95 100.437 1.991 10.858 757 HB2 ARG 95 HB2 ARG 95 100.370 -0.138 12.971 758 HB3 ARG 95 HB3 ARG 95 98.833 0.678 12.598 759 HG2 ARG 95 HG2 ARG 95 99.296 0.211 10.139 760 HG3 ARG 95 HG3 ARG 95 100.664 -0.801 10.660 761 HD2 ARG 95 HD3 ARG 95 98.567 -2.125 10.277 762 HD3 ARG 95 HD2 ARG 95 99.158 -2.239 11.952 763 HE ARG 95 HE ARG 95 97.210 -0.062 11.595 764 HH11 ARG 95 HH11 ARG 95 95.213 -0.400 12.599 765 HH12 ARG 95 HH12 ARG 95 94.765 -2.003 13.139 766 HH21 ARG 95 HH21 ARG 95 97.729 -3.474 12.059 767 HH22 ARG 95 HH22 ARG 95 96.183 -3.736 12.834 768 H THR 96 H THR 96 99.668 4.011 11.214 769 HA THR 96 HA THR 96 99.878 5.291 13.834 770 HB THR 96 HB THR 96 97.975 6.699 12.295 771 HG1 THR 96 HG1 THR 96 100.062 5.627 10.665 772 HG21 THR 96 HG21 THR 96 99.880 8.228 11.900 773 HG22 THR 96 HG22 THR 96 99.871 7.637 13.579 774 HG23 THR 96 HG23 THR 96 101.011 6.947 12.398 775 H ASP 97 H ASP 97 97.835 3.037 12.577 776 HA ASP 97 HA ASP 97 95.402 3.936 14.050 777 HB2 ASP 97 HB2 ASP 97 96.026 1.490 12.341 778 HB3 ASP 97 HB3 ASP 97 94.459 1.766 13.141 779 H ASN 98 H ASN 98 97.865 1.342 14.185 780 HA ASN 98 HA ASN 98 96.971 0.871 17.032 781 HB2 ASN 98 HB2 ASN 98 97.373 -1.117 14.798 782 HB3 ASN 98 HB3 ASN 98 97.754 -1.600 16.468 783 HD21 ASN 98 HD21 ASN 98 95.841 -3.128 16.191 784 HD22 ASN 98 HD22 ASN 98 94.235 -2.484 16.454 785 H GLY 99 H GLY 99 99.360 2.095 15.238 786 HA2 GLY 99 HA3 GLY 99 101.725 2.183 15.458 787 HA3 GLY 99 HA2 GLY 99 101.372 2.043 17.197 788 H ASN 100 H ASN 100 100.826 -0.355 14.589 789 HA ASN 100 HA ASN 100 102.050 -2.451 16.256 790 HB2 ASN 100 HB3 ASN 100 100.919 -2.326 13.450 791 HB3 ASN 100 HB2 ASN 100 101.780 -3.773 14.026 792 HD21 ASN 100 HD21 ASN 100 100.962 -4.543 16.334 793 HD22 ASN 100 HD22 ASN 100 99.228 -4.502 16.558 794 H GLU 101 H GLU 101 103.566 -0.029 15.132 795 HA GLU 101 HA GLU 101 105.634 0.419 14.065 796 HB2 GLU 101 HB2 GLU 101 107.438 -0.617 15.206 797 HB3 GLU 101 HB3 GLU 101 106.092 -0.640 16.368 798 HG2 GLU 101 HG2 GLU 101 105.586 -2.974 15.765 799 HG3 GLU 101 HG3 GLU 101 106.885 -2.956 14.548 800 H LEU 102 H LEU 102 107.195 -0.171 12.483 801 HA LEU 102 HA LEU 102 106.985 -2.841 11.188 802 HB2 LEU 102 HB2 LEU 102 105.215 -1.837 9.945 803 HB3 LEU 102 HB3 LEU 102 106.038 -0.261 9.882 804 HG LEU 102 HG LEU 102 107.817 -1.286 8.444 805 HD11 LEU 102 HD11 LEU 102 106.618 -3.707 9.353 806 HD12 LEU 102 HD12 LEU 102 107.982 -3.528 8.224 807 HD13 LEU 102 HD13 LEU 102 106.317 -3.620 7.601 808 HD21 LEU 102 HD21 LEU 102 106.409 -1.490 6.409 809 HD22 LEU 102 HD22 LEU 102 104.960 -1.656 7.430 810 HD23 LEU 102 HD23 LEU 102 105.875 -0.129 7.425 811 H ASN 103 H ASN 103 109.038 -3.381 10.525 812 HA ASN 103 HA ASN 103 110.988 -1.070 10.291 813 HB2 ASN 103 HB2 ASN 103 112.031 -3.834 10.702 814 HB3 ASN 103 HB3 ASN 103 112.565 -2.295 11.419 815 HD21 ASN 103 HD21 ASN 103 109.853 -1.517 12.360 816 HD22 ASN 103 HD22 ASN 103 109.491 -2.576 13.704 817 H THR 104 H THR 104 111.286 -0.660 8.138 818 HA THR 104 HA THR 104 111.628 -3.095 6.371 819 HB THR 104 HB THR 104 109.545 -2.009 5.796 820 HG1 THR 104 HG1 THR 104 110.286 -2.369 3.840 821 HG21 THR 104 HG21 THR 104 109.829 0.503 4.996 822 HG22 THR 104 HG22 THR 104 109.606 0.135 6.723 823 HG23 THR 104 HG23 THR 104 111.234 0.474 6.089 824 H VAL 105 H VAL 105 112.697 -2.401 4.223 825 HA VAL 105 HA VAL 105 114.811 -0.315 4.621 826 HB VAL 105 HB VAL 105 115.431 -3.206 3.861 827 HG11 VAL 105 HG11 VAL 105 117.818 -2.148 4.398 828 HG12 VAL 105 HG12 VAL 105 117.081 -1.960 2.789 829 HG13 VAL 105 HG13 VAL 105 116.991 -0.631 3.970 830 HG21 VAL 105 HG21 VAL 105 116.608 -3.282 6.043 831 HG22 VAL 105 HG22 VAL 105 116.044 -1.633 6.404 832 HG23 VAL 105 HG23 VAL 105 114.870 -2.963 6.264 833 H ARG 106 H ARG 106 115.840 0.259 2.537 834 HA ARG 106 HA ARG 106 114.186 -0.678 0.179 835 HB2 ARG 106 HB3 ARG 106 113.375 1.503 0.514 836 HB3 ARG 106 HB2 ARG 106 114.954 2.110 1.066 837 HG2 ARG 106 HG2 ARG 106 115.852 2.061 -1.167 838 HG3 ARG 106 HG3 ARG 106 114.454 1.143 -1.778 839 HD2 ARG 106 HD3 ARG 106 114.063 3.850 -0.477 840 HD3 ARG 106 HD2 ARG 106 114.541 3.733 -2.187 841 HE ARG 106 HE ARG 106 112.374 1.998 -2.044 842 HH11 ARG 106 HH11 ARG 106 110.236 2.682 -2.301 843 HH12 ARG 106 HH12 ARG 106 109.799 4.339 -1.948 844 HH21 ARG 106 HH21 ARG 106 113.028 5.265 -1.031 845 HH22 ARG 106 HH22 ARG 106 111.373 5.795 -1.232 846 H GLU 107 H GLU 107 115.344 -1.243 -1.623 847 HA GLU 107 HA GLU 107 118.244 -0.426 -1.737 848 HB2 GLU 107 HB2 GLU 107 117.106 -3.223 -1.672 849 HB3 GLU 107 HB3 GLU 107 118.570 -2.898 -2.630 850 HG2 GLU 107 HG2 GLU 107 119.575 -1.820 -0.567 851 HG3 GLU 107 HG3 GLU 107 118.166 -2.404 0.350 852 H ILE 108 H ILE 108 119.135 -0.635 -3.951 853 HA ILE 108 HA ILE 108 116.932 -0.653 -6.022 854 HB ILE 108 HB ILE 108 119.522 0.946 -6.105 855 HG12 ILE 108 HG12 ILE 108 117.497 1.433 -4.316 856 HG13 ILE 108 HG13 ILE 108 118.527 2.701 -5.020 857 HG21 ILE 108 HG21 ILE 108 118.632 0.537 -8.292 858 HG22 ILE 108 HG22 ILE 108 116.968 0.859 -7.749 859 HG23 ILE 108 HG23 ILE 108 118.143 2.192 -7.857 860 HD11 ILE 108 HD11 ILE 108 116.008 3.118 -5.167 861 HD12 ILE 108 HD12 ILE 108 116.891 3.213 -6.709 862 HD13 ILE 108 HD13 ILE 108 115.937 1.762 -6.317 863 H ILE 109 H ILE 109 117.430 -2.951 -6.264 864 HA ILE 109 HA ILE 109 120.093 -3.885 -6.883 865 HB ILE 109 HB ILE 109 117.304 -4.935 -7.438 866 HG12 ILE 109 HG12 ILE 109 119.677 -6.033 -5.863 867 HG13 ILE 109 HG13 ILE 109 118.349 -5.083 -5.154 868 HG21 ILE 109 HG21 ILE 109 119.061 -7.025 -8.026 869 HG22 ILE 109 HG22 ILE 109 118.130 -6.086 -9.217 870 HG23 ILE 109 HG23 ILE 109 119.806 -5.626 -8.836 871 HD11 ILE 109 HD11 ILE 109 118.357 -7.901 -6.175 872 HD12 ILE 109 HD12 ILE 109 117.483 -7.192 -4.797 873 HD13 ILE 109 HD13 ILE 109 116.883 -6.943 -6.454 874 H GLY 110 H GLY 110 121.057 -2.460 -8.352 875 HA2 GLY 110 HA2 GLY 110 121.593 -1.654 -10.506 876 HA3 GLY 110 HA3 GLY 110 120.749 -3.089 -11.133 877 H ASP 111 H ASP 111 118.390 -2.930 -11.447 878 HA ASP 111 HA ASP 111 117.451 -0.065 -11.656 879 HB2 ASP 111 HB3 ASP 111 117.058 -2.269 -13.727 880 HB3 ASP 111 HB2 ASP 111 116.375 -0.628 -13.814 881 H GLU 112 H GLU 112 116.959 -2.228 -9.659 882 HA GLU 112 HA GLU 112 113.955 -2.304 -9.989 883 HB2 GLU 112 HB2 GLU 112 115.402 -4.518 -8.537 884 HB3 GLU 112 HB3 GLU 112 113.836 -4.556 -9.381 885 HG2 GLU 112 HG2 GLU 112 115.037 -4.320 -11.560 886 HG3 GLU 112 HG3 GLU 112 116.588 -4.368 -10.688 887 H LEU 113 H LEU 113 112.813 -1.756 -8.094 888 HA LEU 113 HA LEU 113 114.596 -0.859 -5.833 889 HB2 LEU 113 HB3 LEU 113 112.942 0.764 -6.799 890 HB3 LEU 113 HB2 LEU 113 111.630 -0.320 -6.281 891 HG LEU 113 HG LEU 113 112.789 -0.159 -3.922 892 HD11 LEU 113 HD11 LEU 113 113.778 2.196 -3.661 893 HD12 LEU 113 HD12 LEU 113 113.902 2.236 -5.436 894 HD13 LEU 113 HD13 LEU 113 114.803 1.013 -4.508 895 HD21 LEU 113 HD21 LEU 113 111.418 1.846 -3.415 896 HD22 LEU 113 HD22 LEU 113 110.542 0.726 -4.485 897 HD23 LEU 113 HD23 LEU 113 111.289 2.196 -5.155 898 H VAL 114 H VAL 114 114.907 -2.388 -4.302 899 HA VAL 114 HA VAL 114 112.669 -4.336 -3.808 900 HB VAL 114 HB VAL 114 115.509 -4.378 -2.705 901 HG11 VAL 114 HG11 VAL 114 113.836 -5.743 -1.485 902 HG12 VAL 114 HG12 VAL 114 113.360 -6.523 -3.013 903 HG13 VAL 114 HG13 VAL 114 114.994 -6.777 -2.356 904 HG21 VAL 114 HG21 VAL 114 114.481 -4.925 -5.393 905 HG22 VAL 114 HG22 VAL 114 115.218 -6.374 -4.667 906 HG23 VAL 114 HG23 VAL 114 116.164 -4.873 -4.816 907 H GLN 115 H GLN 115 111.262 -3.650 -2.287 908 HA GLN 115 HA GLN 115 112.415 -2.169 0.086 909 HB2 GLN 115 HB3 GLN 115 110.543 -1.154 -1.484 910 HB3 GLN 115 HB2 GLN 115 109.467 -2.248 -0.582 911 HG2 GLN 115 HG2 GLN 115 110.144 -1.244 1.538 912 HG3 GLN 115 HG3 GLN 115 111.362 -0.240 0.716 913 HE21 GLN 115 HE21 GLN 115 107.997 -0.950 -0.387 914 HE22 GLN 115 HE22 GLN 115 107.472 0.717 -0.333 915 H THR 116 H THR 116 112.799 -3.697 1.641 916 HA THR 116 HA THR 116 110.754 -5.890 1.938 917 HB THR 116 HB THR 116 113.266 -5.844 3.571 918 HG1 THR 116 HG1 THR 116 114.123 -5.279 1.598 919 HG21 THR 116 HG21 THR 116 113.176 -8.273 3.022 920 HG22 THR 116 HG22 THR 116 111.655 -7.696 3.745 921 HG23 THR 116 HG23 THR 116 111.758 -7.971 1.989 922 H TYR 117 H TYR 117 109.648 -6.175 3.863 923 HA TYR 117 HA TYR 117 110.182 -4.079 5.972 924 HB2 TYR 117 HB3 TYR 117 107.390 -5.081 5.762 925 HB3 TYR 117 HB2 TYR 117 107.995 -3.444 6.106 926 HD1 TYR 117 HD1 TYR 117 108.016 -5.928 3.314 927 HD2 TYR 117 HD2 TYR 117 107.615 -1.827 4.494 928 HE1 TYR 117 HE1 TYR 117 107.567 -5.301 0.958 929 HE2 TYR 117 HE2 TYR 117 107.164 -1.186 2.142 930 HH TYR 117 HH TYR 117 106.200 -2.482 0.015 931 H VAL 118 H VAL 118 109.861 -4.695 8.072 932 HA VAL 118 HA VAL 118 109.608 -7.679 8.495 933 HB VAL 118 HB VAL 118 110.815 -5.687 10.445 934 HG11 VAL 118 HG11 VAL 118 111.489 -7.555 11.645 935 HG12 VAL 118 HG12 VAL 118 109.993 -8.189 10.919 936 HG13 VAL 118 HG13 VAL 118 111.571 -8.588 10.198 937 HG21 VAL 118 HG21 VAL 118 112.090 -5.575 8.326 938 HG22 VAL 118 HG22 VAL 118 112.255 -7.347 8.334 939 HG23 VAL 118 HG23 VAL 118 113.034 -6.375 9.605 940 H TYR 119 H TYR 119 108.276 -8.369 10.176 941 HA TYR 119 HA TYR 119 106.694 -6.233 11.554 942 HB2 TYR 119 HB2 TYR 119 105.702 -7.321 9.262 943 HB3 TYR 119 HB3 TYR 119 105.076 -8.476 10.461 944 HD1 TYR 119 HD1 TYR 119 103.792 -7.602 12.439 945 HD2 TYR 119 HD2 TYR 119 104.760 -5.139 9.061 946 HE1 TYR 119 HE1 TYR 119 102.004 -6.011 13.089 947 HE2 TYR 119 HE2 TYR 119 102.988 -3.534 9.721 948 HH TYR 119 HH TYR 119 100.844 -3.581 11.039 949 H GLU 120 H GLU 120 107.034 -6.714 13.604 950 HA GLU 120 HA GLU 120 107.238 -7.957 15.591 951 HB2 GLU 120 HB2 GLU 120 105.045 -9.500 14.153 952 HB3 GLU 120 HB3 GLU 120 105.480 -9.752 15.860 953 HG2 GLU 120 HG2 GLU 120 104.838 -7.531 16.459 954 HG3 GLU 120 HG3 GLU 120 104.787 -7.004 14.759 955 H GLY 121 H GLY 121 108.733 -8.904 13.035 956 HA2 GLY 121 HA2 GLY 121 110.637 -10.494 13.405 957 HA3 GLY 121 HA3 GLY 121 109.497 -11.572 14.246 958 H VAL 122 H VAL 122 108.563 -9.819 11.364 959 HA VAL 122 HA VAL 122 108.748 -12.412 9.831 960 HB VAL 122 HB VAL 122 106.387 -11.315 10.561 961 HG11 VAL 122 HG11 VAL 122 106.754 -10.169 7.785 962 HG12 VAL 122 HG12 VAL 122 105.506 -9.796 8.998 963 HG13 VAL 122 HG13 VAL 122 107.169 -9.202 9.221 964 HG21 VAL 122 HG21 VAL 122 105.417 -12.477 8.601 965 HG22 VAL 122 HG22 VAL 122 107.024 -12.525 7.838 966 HG23 VAL 122 HG23 VAL 122 106.724 -13.433 9.339 967 H GLU 123 H GLU 123 108.486 -11.750 7.355 968 HA GLU 123 HA GLU 123 109.776 -9.123 6.848 969 HB2 GLU 123 HB2 GLU 123 111.288 -11.662 6.933 970 HB3 GLU 123 HB3 GLU 123 111.507 -10.747 5.423 971 HG2 GLU 123 HG2 GLU 123 112.006 -8.700 6.803 972 HG3 GLU 123 HG3 GLU 123 111.925 -9.713 8.264 973 H ALA 124 H ALA 124 108.656 -8.360 5.163 974 HA ALA 124 HA ALA 124 107.836 -10.321 3.009 975 HB1 ALA 124 HB1 ALA 124 106.552 -7.777 2.675 976 HB2 ALA 124 HB2 ALA 124 106.399 -8.235 4.388 977 HB3 ALA 124 HB3 ALA 124 105.807 -9.332 3.118 978 H LYS 125 H LYS 125 108.160 -9.592 0.758 979 HA LYS 125 HA LYS 125 110.115 -7.298 0.573 980 HB2 LYS 125 HB2 LYS 125 111.147 -9.696 0.544 981 HB3 LYS 125 HB3 LYS 125 110.456 -9.801 -1.093 982 HG2 LYS 125 HG3 LYS 125 111.726 -7.899 -1.845 983 HG3 LYS 125 HG2 LYS 125 112.212 -7.485 -0.184 984 HD2 LYS 125 HD2 LYS 125 114.031 -8.643 -1.467 985 HD3 LYS 125 HD3 LYS 125 113.531 -9.544 -0.016 986 HE2 LYS 125 HE2 LYS 125 112.482 -11.214 -1.246 987 HE3 LYS 125 HE3 LYS 125 112.126 -10.131 -2.612 988 HZ1 LYS 125 HZ1 LYS 125 113.878 -11.689 -3.146 989 HZ2 LYS 125 HZ2 LYS 125 114.468 -10.149 -3.153 990 HZ3 LYS 125 HZ3 LYS 125 114.798 -11.153 -1.887 991 H ARG 126 H ARG 126 109.870 -5.987 -1.164 992 HA ARG 126 HA ARG 126 107.968 -6.878 -3.339 993 HB2 ARG 126 HB3 ARG 126 107.750 -4.576 -1.468 994 HB3 ARG 126 HB2 ARG 126 107.522 -4.164 -3.184 995 HG2 ARG 126 HG2 ARG 126 105.827 -5.978 -3.379 996 HG3 ARG 126 HG3 ARG 126 106.036 -6.344 -1.650 997 HD2 ARG 126 HD2 ARG 126 105.278 -3.575 -2.657 998 HD3 ARG 126 HD3 ARG 126 104.064 -4.811 -2.249 999 HE ARG 126 HE ARG 126 106.052 -4.350 -0.107 1000 HH11 ARG 126 HH11 ARG 126 105.194 -3.434 1.774 1001 HH12 ARG 126 HH12 ARG 126 103.595 -2.724 1.750 1002 HH21 ARG 126 HH21 ARG 126 103.052 -3.429 -1.616 1003 HH22 ARG 126 HH22 ARG 126 102.389 -2.721 -0.161 1004 H ILE 127 H ILE 127 109.044 -6.734 -5.282 1005 HA ILE 127 HA ILE 127 111.337 -4.756 -5.386 1006 HB ILE 127 HB ILE 127 110.942 -7.306 -7.002 1007 HG12 ILE 127 HG12 ILE 127 113.185 -7.178 -5.091 1008 HG13 ILE 127 HG13 ILE 127 111.592 -7.106 -4.299 1009 HG21 ILE 127 HG21 ILE 127 113.317 -6.941 -7.620 1010 HG22 ILE 127 HG22 ILE 127 113.326 -5.427 -6.683 1011 HG23 ILE 127 HG23 ILE 127 112.301 -5.572 -8.131 1012 HD11 ILE 127 HD11 ILE 127 112.420 -9.458 -4.623 1013 HD12 ILE 127 HD12 ILE 127 112.396 -9.186 -6.382 1014 HD13 ILE 127 HD13 ILE 127 110.878 -9.143 -5.455 1015 H PHE 128 H PHE 128 111.069 -3.079 -6.730 1016 HA PHE 128 HA PHE 128 108.957 -3.291 -8.868 1017 HB2 PHE 128 HB3 PHE 128 110.527 -0.813 -8.031 1018 HB3 PHE 128 HB2 PHE 128 109.016 -0.878 -8.965 1019 HD1 PHE 128 HD1 PHE 128 108.047 -3.269 -7.065 1020 HD2 PHE 128 HD2 PHE 128 109.364 0.758 -6.437 1021 HE1 PHE 128 HE1 PHE 128 106.712 -3.166 -4.982 1022 HE2 PHE 128 HE2 PHE 128 108.038 0.868 -4.342 1023 HZ PHE 128 HZ PHE 128 106.706 -1.096 -3.616 1024 H LYS 129 H LYS 129 109.642 -1.906 -10.913 1025 HA LYS 129 HA LYS 129 112.494 -1.963 -11.607 1026 HB2 LYS 129 HB3 LYS 129 112.168 -4.342 -11.853 1027 HB3 LYS 129 HB2 LYS 129 110.628 -4.102 -12.713 1028 HG2 LYS 129 HG2 LYS 129 111.680 -3.393 -14.678 1029 HG3 LYS 129 HG3 LYS 129 113.147 -2.860 -13.822 1030 HD2 LYS 129 HD2 LYS 129 113.943 -5.081 -13.562 1031 HD3 LYS 129 HD3 LYS 129 112.344 -5.786 -13.902 1032 HE2 LYS 129 HE3 LYS 129 112.489 -4.965 -16.244 1033 HE3 LYS 129 HE2 LYS 129 114.099 -4.288 -15.900 1034 HZ1 LYS 129 HZ1 LYS 129 114.247 -6.467 -16.905 1035 HZ2 LYS 129 HZ2 LYS 129 113.357 -7.138 -15.689 1036 HZ3 LYS 129 HZ3 LYS 129 114.849 -6.510 -15.370 1037 H LYS 130 H LYS 130 112.825 -1.152 -13.841 1038 HA LYS 130 HA LYS 130 111.211 1.060 -14.491 1039 HB2 LYS 130 HB3 LYS 130 113.348 -0.425 -15.748 1040 HB3 LYS 130 HB2 LYS 130 112.122 -0.030 -16.976 1041 HG2 LYS 130 HG2 LYS 130 113.171 2.039 -15.009 1042 HG3 LYS 130 HG3 LYS 130 113.956 1.735 -16.577 1043 HD2 LYS 130 HD2 LYS 130 111.676 2.107 -17.662 1044 HD3 LYS 130 HD3 LYS 130 111.102 2.674 -16.075 1045 HE2 LYS 130 HE2 LYS 130 113.239 3.889 -17.858 1046 HE3 LYS 130 HE3 LYS 130 111.775 4.659 -17.200 1047 HZ1 LYS 130 HZ1 LYS 130 113.792 3.603 -15.369 1048 HZ2 LYS 130 HZ2 LYS 130 114.054 5.062 -16.092 1049 HZ3 LYS 130 HZ3 LYS 130 112.723 4.839 -15.143 1050 H ASP 131 H ASP 131 109.248 1.353 -15.444 1051 HA ASP 131 HA ASP 131 107.491 -0.915 -15.854 1052 HB2 ASP 131 HB2 ASP 131 106.507 1.219 -15.334 1053 HB3 ASP 131 HB3 ASP 131 107.325 2.004 -16.706 Start of MODEL 7 1 H1 ALA 1 H1 ALA 1 117.599 8.509 -8.397 2 H2 ALA 1 H2 ALA 1 116.888 9.261 -7.113 3 H3 ALA 1 H3 ALA 1 118.494 8.887 -7.065 4 HA ALA 1 HA ALA 1 118.012 6.531 -7.093 5 HB1 ALA 1 HB1 ALA 1 117.087 6.392 -4.830 6 HB2 ALA 1 HB2 ALA 1 116.431 8.041 -4.966 7 HB3 ALA 1 HB3 ALA 1 118.191 7.784 -4.925 8 H PHE 2 H PHE 2 116.684 5.205 -8.202 9 HA PHE 2 HA PHE 2 114.702 4.533 -9.346 10 HB2 PHE 2 HB2 PHE 2 114.499 4.154 -6.631 11 HB3 PHE 2 HB3 PHE 2 113.039 5.121 -6.951 12 HD1 PHE 2 HD1 PHE 2 114.926 2.379 -8.735 13 HD2 PHE 2 HD2 PHE 2 111.145 3.853 -7.328 14 HE1 PHE 2 HE1 PHE 2 113.792 0.392 -9.696 15 HE2 PHE 2 HE2 PHE 2 110.016 1.865 -8.279 16 HZ PHE 2 HZ PHE 2 111.338 0.136 -9.467 17 H ASP 3 H ASP 3 115.323 7.407 -9.545 18 HA ASP 3 HA ASP 3 112.781 8.858 -9.241 19 HB2 ASP 3 HB3 ASP 3 115.426 9.449 -10.608 20 HB3 ASP 3 HB2 ASP 3 114.033 10.547 -10.761 21 H SER 4 H SER 4 111.416 7.248 -10.423 22 HA SER 4 HA SER 4 110.845 8.142 -13.103 23 HB2 SER 4 HB2 SER 4 112.000 6.756 -14.494 24 HB3 SER 4 HB3 SER 4 113.090 6.523 -13.106 25 HG SER 4 HG SER 4 112.460 4.488 -13.606 26 H THR 5 H THR 5 109.654 5.937 -14.242 27 HA THR 5 HA THR 5 107.539 5.340 -12.194 28 HB THR 5 HB THR 5 107.633 4.961 -15.220 29 HG1 THR 5 HG1 THR 5 106.056 6.655 -15.091 30 HG21 THR 5 HG21 THR 5 105.097 4.587 -14.808 31 HG22 THR 5 HG22 THR 5 106.199 3.243 -14.427 32 HG23 THR 5 HG23 THR 5 105.556 4.265 -13.119 33 H TRP 6 H TRP 6 107.025 3.230 -11.564 34 HA TRP 6 HA TRP 6 108.467 0.968 -12.876 35 HB2 TRP 6 HB2 TRP 6 108.739 1.187 -9.885 36 HB3 TRP 6 HB3 TRP 6 109.765 0.323 -11.054 37 HD1 TRP 6 HD1 TRP 6 108.804 4.021 -10.314 38 HE1 TRP 6 HE1 TRP 6 110.900 5.493 -10.631 39 HE3 TRP 6 HE3 TRP 6 112.101 0.421 -11.783 40 HZ2 TRP 6 HZ2 TRP 6 113.658 5.124 -11.412 41 HZ3 TRP 6 HZ3 TRP 6 114.453 0.995 -12.294 42 HH2 TRP 6 HH2 TRP 6 115.238 3.340 -12.110 43 H LYS 7 H LYS 7 107.795 -1.160 -11.781 44 HA LYS 7 HA LYS 7 105.216 -0.975 -10.291 45 HB2 LYS 7 HB2 LYS 7 103.899 -2.138 -11.911 46 HB3 LYS 7 HB3 LYS 7 104.740 -0.866 -12.828 47 HG2 LYS 7 HG3 LYS 7 106.556 -2.601 -13.325 48 HG3 LYS 7 HG2 LYS 7 105.448 -3.823 -12.658 49 HD2 LYS 7 HD2 LYS 7 104.442 -1.917 -14.771 50 HD3 LYS 7 HD3 LYS 7 105.442 -3.306 -15.257 51 HE2 LYS 7 HE2 LYS 7 103.129 -4.013 -15.354 52 HE3 LYS 7 HE3 LYS 7 103.860 -4.787 -13.928 53 HZ1 LYS 7 HZ1 LYS 7 101.614 -3.533 -13.740 54 HZ2 LYS 7 HZ2 LYS 7 102.725 -3.417 -12.527 55 HZ3 LYS 7 HZ3 LYS 7 102.564 -2.191 -13.619 56 H VAL 8 H VAL 8 104.901 -2.782 -9.003 57 HA VAL 8 HA VAL 8 106.910 -4.396 -8.096 58 HB VAL 8 HB VAL 8 104.216 -5.620 -8.790 59 HG11 VAL 8 HG11 VAL 8 104.589 -6.802 -6.643 60 HG12 VAL 8 HG12 VAL 8 106.138 -5.950 -6.443 61 HG13 VAL 8 HG13 VAL 8 105.924 -7.105 -7.780 62 HG21 VAL 8 HG21 VAL 8 103.839 -4.625 -6.301 63 HG22 VAL 8 HG22 VAL 8 104.944 -3.383 -6.937 64 HG23 VAL 8 HG23 VAL 8 103.406 -3.718 -7.770 65 H ASP 9 H ASP 9 108.495 -5.260 -9.343 66 HA ASP 9 HA ASP 9 107.720 -6.772 -11.815 67 HB2 ASP 9 HB2 ASP 9 109.622 -5.390 -12.190 68 HB3 ASP 9 HB3 ASP 9 110.350 -5.822 -10.625 69 H ARG 10 H ARG 10 108.968 -7.172 -8.542 70 HA ARG 10 HA ARG 10 108.313 -10.069 -8.713 71 HB2 ARG 10 HB2 ARG 10 111.142 -9.056 -8.228 72 HB3 ARG 10 HB3 ARG 10 110.601 -10.685 -7.760 73 HG2 ARG 10 HG2 ARG 10 109.754 -10.830 -10.247 74 HG3 ARG 10 HG3 ARG 10 110.895 -9.491 -10.524 75 HD2 ARG 10 HD3 ARG 10 111.613 -12.159 -9.227 76 HD3 ARG 10 HD2 ARG 10 111.938 -11.730 -10.923 77 HE ARG 10 HE ARG 10 113.069 -9.659 -9.310 78 HH11 ARG 10 HH11 ARG 10 115.276 -9.737 -8.829 79 HH12 ARG 10 HH12 ARG 10 116.140 -11.255 -8.929 80 HH21 ARG 10 HH21 ARG 10 113.341 -13.077 -9.910 81 HH22 ARG 10 HH22 ARG 10 115.049 -13.138 -9.538 82 H SER 11 H SER 11 108.839 -11.095 -6.436 83 HA SER 11 HA SER 11 109.044 -9.345 -4.135 84 HB2 SER 11 HB2 SER 11 106.888 -8.453 -4.706 85 HB3 SER 11 HB3 SER 11 106.241 -10.070 -5.074 86 HG SER 11 HG SER 11 105.680 -10.130 -3.039 87 H GLU 12 H GLU 12 108.023 -10.622 -2.108 88 HA GLU 12 HA GLU 12 107.934 -13.553 -2.547 89 HB2 GLU 12 HB3 GLU 12 109.987 -14.151 -1.714 90 HB3 GLU 12 HB2 GLU 12 110.449 -12.543 -2.318 91 HG2 GLU 12 HG2 GLU 12 109.758 -11.650 0.002 92 HG3 GLU 12 HG3 GLU 12 109.743 -13.351 0.526 93 H ASN 13 H ASN 13 107.269 -14.700 -0.633 94 HA ASN 13 HA ASN 13 105.978 -14.894 1.332 95 HB2 ASN 13 HB2 ASN 13 107.810 -12.567 1.946 96 HB3 ASN 13 HB3 ASN 13 106.534 -13.022 3.100 97 HD21 ASN 13 HD21 ASN 13 108.440 -13.625 4.549 98 HD22 ASN 13 HD22 ASN 13 109.168 -15.200 4.324 99 H TYR 14 H TYR 14 105.829 -11.643 2.297 100 HA TYR 14 HA TYR 14 104.160 -9.983 2.028 101 HB2 TYR 14 HB2 TYR 14 104.309 -11.066 -0.499 102 HB3 TYR 14 HB3 TYR 14 102.613 -11.397 -0.074 103 HD1 TYR 14 HD1 TYR 14 104.848 -8.543 0.917 104 HD2 TYR 14 HD2 TYR 14 101.342 -9.795 -1.227 105 HE1 TYR 14 HE1 TYR 14 104.273 -6.173 0.472 106 HE2 TYR 14 HE2 TYR 14 100.767 -7.425 -1.669 107 HH TYR 14 HH TYR 14 101.238 -5.261 -1.124 108 H ASP 15 H ASP 15 102.802 -13.282 1.438 109 HA ASP 15 HA ASP 15 100.300 -12.725 2.738 110 HB2 ASP 15 HB2 ASP 15 100.027 -15.133 2.906 111 HB3 ASP 15 HB3 ASP 15 100.837 -14.778 1.361 112 H LYS 16 H LYS 16 103.364 -14.067 4.036 113 HA LYS 16 HA LYS 16 102.394 -14.289 6.756 114 HB2 LYS 16 HB2 LYS 16 105.244 -13.712 5.823 115 HB3 LYS 16 HB3 LYS 16 104.757 -14.409 7.386 116 HG2 LYS 16 HG2 LYS 16 103.723 -16.337 6.150 117 HG3 LYS 16 HG3 LYS 16 104.357 -15.658 4.631 118 HD2 LYS 16 HD2 LYS 16 106.607 -16.024 5.266 119 HD3 LYS 16 HD3 LYS 16 106.191 -16.179 6.990 120 HE2 LYS 16 HE2 LYS 16 105.048 -18.307 6.556 121 HE3 LYS 16 HE3 LYS 16 105.346 -18.139 4.810 122 HZ1 LYS 16 HZ1 LYS 16 106.979 -19.558 5.858 123 HZ2 LYS 16 HZ2 LYS 16 107.704 -18.198 5.272 124 HZ3 LYS 16 HZ3 LYS 16 107.428 -18.354 6.891 125 H PHE 17 H PHE 17 103.709 -11.639 4.828 126 HA PHE 17 HA PHE 17 104.042 -9.801 7.084 127 HB2 PHE 17 HB2 PHE 17 105.187 -9.553 4.886 128 HB3 PHE 17 HB3 PHE 17 103.611 -9.274 4.110 129 HD1 PHE 17 HD1 PHE 17 105.821 -8.001 6.835 130 HD2 PHE 17 HD2 PHE 17 102.736 -7.094 3.997 131 HE1 PHE 17 HE1 PHE 17 106.002 -5.598 7.414 132 HE2 PHE 17 HE2 PHE 17 102.905 -4.688 4.578 133 HZ PHE 17 HZ PHE 17 104.541 -3.938 6.286 134 H MET 18 H MET 18 101.690 -9.842 4.384 135 HA MET 18 HA MET 18 99.865 -7.984 5.590 136 HB2 MET 18 HB3 MET 18 99.414 -10.251 3.605 137 HB3 MET 18 HB2 MET 18 98.157 -9.073 4.049 138 HG2 MET 18 HG2 MET 18 100.883 -8.131 3.127 139 HG3 MET 18 HG3 MET 18 99.642 -8.599 1.940 140 HE1 MET 18 HE1 MET 18 100.113 -4.554 2.677 141 HE2 MET 18 HE2 MET 18 100.658 -5.862 1.600 142 HE3 MET 18 HE3 MET 18 101.251 -5.784 3.276 143 H GLU 19 H GLU 19 100.454 -11.385 6.215 144 HA GLU 19 HA GLU 19 97.860 -11.804 7.559 145 HB2 GLU 19 HB2 GLU 19 98.967 -13.751 6.656 146 HB3 GLU 19 HB3 GLU 19 100.473 -13.371 7.526 147 HG2 GLU 19 HG2 GLU 19 99.449 -13.828 9.662 148 HG3 GLU 19 HG3 GLU 19 97.828 -13.925 8.932 149 H LYS 20 H LYS 20 101.161 -10.886 8.499 150 HA LYS 20 HA LYS 20 100.723 -11.114 11.358 151 HB2 LYS 20 HB2 LYS 20 102.638 -9.473 9.659 152 HB3 LYS 20 HB3 LYS 20 102.643 -9.393 11.437 153 HG2 LYS 20 HG3 LYS 20 102.720 -12.082 10.056 154 HG3 LYS 20 HG2 LYS 20 104.212 -11.124 10.209 155 HD2 LYS 20 HD2 LYS 20 103.708 -10.924 12.695 156 HD3 LYS 20 HD3 LYS 20 102.403 -12.111 12.453 157 HE2 LYS 20 HE2 LYS 20 104.248 -13.572 11.320 158 HE3 LYS 20 HE3 LYS 20 105.396 -12.485 12.139 159 HZ1 LYS 20 HZ1 LYS 20 104.864 -14.401 13.491 160 HZ2 LYS 20 HZ2 LYS 20 103.257 -14.033 13.461 161 HZ3 LYS 20 HZ3 LYS 20 104.320 -13.026 14.220 162 H MET 21 H MET 21 100.305 -8.428 9.027 163 HA MET 21 HA MET 21 99.592 -6.428 10.971 164 HB2 MET 21 HB2 MET 21 99.232 -6.839 8.043 165 HB3 MET 21 HB3 MET 21 98.031 -5.769 8.806 166 HG2 MET 21 HG3 MET 21 99.971 -4.521 9.878 167 HG3 MET 21 HG2 MET 21 101.065 -5.486 8.858 168 HE1 MET 21 HE1 MET 21 101.332 -3.671 5.745 169 HE2 MET 21 HE2 MET 21 102.158 -4.027 7.280 170 HE3 MET 21 HE3 MET 21 101.340 -5.331 6.386 171 H GLY 22 H GLY 22 98.005 -9.321 10.045 172 HA2 GLY 22 HA3 GLY 22 96.011 -10.197 11.046 173 HA3 GLY 22 HA2 GLY 22 95.705 -8.609 11.789 174 H VAL 23 H VAL 23 96.464 -8.735 8.391 175 HA VAL 23 HA VAL 23 93.877 -7.519 7.729 176 HB VAL 23 HB VAL 23 95.808 -8.732 5.726 177 HG11 VAL 23 HG11 VAL 23 93.676 -7.765 4.910 178 HG12 VAL 23 HG12 VAL 23 95.066 -6.783 4.387 179 HG13 VAL 23 HG13 VAL 23 94.051 -6.237 5.743 180 HG21 VAL 23 HG21 VAL 23 96.830 -6.309 5.864 181 HG22 VAL 23 HG22 VAL 23 97.343 -7.536 7.048 182 HG23 VAL 23 HG23 VAL 23 96.141 -6.306 7.505 183 H ASN 24 H ASN 24 92.041 -8.502 6.976 184 HA ASN 24 HA ASN 24 91.422 -11.184 7.404 185 HB2 ASN 24 HB2 ASN 24 90.428 -9.880 4.863 186 HB3 ASN 24 HB3 ASN 24 89.537 -10.876 6.040 187 HD21 ASN 24 HD21 ASN 24 90.551 -7.608 5.226 188 HD22 ASN 24 HD22 ASN 24 89.786 -6.826 6.591 189 H ILE 25 H ILE 25 91.099 -12.989 5.777 190 HA ILE 25 HA ILE 25 93.659 -13.433 4.377 191 HB ILE 25 HB ILE 25 91.156 -15.017 4.914 192 HG12 ILE 25 HG13 ILE 25 93.349 -14.861 6.338 193 HG13 ILE 25 HG12 ILE 25 92.640 -16.464 6.034 194 HG21 ILE 25 HG21 ILE 25 92.125 -16.852 3.451 195 HG22 ILE 25 HG22 ILE 25 91.456 -15.465 2.558 196 HG23 ILE 25 HG23 ILE 25 93.217 -15.629 2.758 197 HD11 ILE 25 HD11 ILE 25 95.213 -16.121 5.644 198 HD12 ILE 25 HD12 ILE 25 94.272 -17.026 4.433 199 HD13 ILE 25 HD13 ILE 25 94.704 -15.325 4.135 200 H VAL 26 H VAL 26 90.989 -11.709 3.649 201 HA VAL 26 HA VAL 26 90.621 -12.482 0.833 202 HB VAL 26 HB VAL 26 89.838 -9.946 2.342 203 HG11 VAL 26 HG11 VAL 26 89.938 -9.623 -0.115 204 HG12 VAL 26 HG12 VAL 26 88.254 -9.620 0.462 205 HG13 VAL 26 HG13 VAL 26 88.915 -11.062 -0.345 206 HG21 VAL 26 HG21 VAL 26 87.602 -11.018 2.426 207 HG22 VAL 26 HG22 VAL 26 88.823 -12.019 3.250 208 HG23 VAL 26 HG23 VAL 26 88.264 -12.460 1.619 209 H LYS 27 H LYS 27 91.948 -9.515 2.379 210 HA LYS 27 HA LYS 27 93.120 -8.485 -0.034 211 HB2 LYS 27 HB3 LYS 27 94.330 -8.120 2.730 212 HB3 LYS 27 HB2 LYS 27 94.309 -6.970 1.372 213 HG2 LYS 27 HG2 LYS 27 91.958 -7.864 3.090 214 HG3 LYS 27 HG3 LYS 27 92.634 -6.224 2.940 215 HD2 LYS 27 HD3 LYS 27 92.042 -6.349 0.451 216 HD3 LYS 27 HD2 LYS 27 91.118 -7.821 0.838 217 HE2 LYS 27 HE3 LYS 27 89.969 -6.379 2.668 218 HE3 LYS 27 HE2 LYS 27 90.646 -4.980 1.801 219 HZ1 LYS 27 HZ1 LYS 27 88.440 -5.529 1.018 220 HZ2 LYS 27 HZ2 LYS 27 89.542 -5.761 -0.187 221 HZ3 LYS 27 HZ3 LYS 27 88.914 -7.057 0.616 222 H ARG 28 H ARG 28 94.380 -10.693 2.465 223 HA ARG 28 HA ARG 28 97.075 -10.847 1.454 224 HB2 ARG 28 HB3 ARG 28 96.670 -11.782 3.610 225 HB3 ARG 28 HB2 ARG 28 95.316 -12.772 3.015 226 HG2 ARG 28 HG2 ARG 28 96.806 -14.214 1.780 227 HG3 ARG 28 HG3 ARG 28 98.186 -13.126 2.057 228 HD2 ARG 28 HD2 ARG 28 98.556 -13.936 4.162 229 HD3 ARG 28 HD3 ARG 28 96.818 -14.040 4.530 230 HE ARG 28 HE ARG 28 97.095 -16.115 2.756 231 HH11 ARG 28 HH11 ARG 28 97.823 -18.182 3.297 232 HH12 ARG 28 HH12 ARG 28 98.893 -18.404 4.663 233 HH21 ARG 28 HH21 ARG 28 98.981 -15.018 5.470 234 HH22 ARG 28 HH22 ARG 28 99.546 -16.620 5.888 235 H LYS 29 H LYS 29 94.100 -12.650 0.619 236 HA LYS 29 HA LYS 29 95.363 -14.564 -1.128 237 HB2 LYS 29 HB2 LYS 29 93.006 -14.734 -0.362 238 HB3 LYS 29 HB3 LYS 29 92.589 -13.313 -1.349 239 HG2 LYS 29 HG3 LYS 29 92.951 -14.463 -3.379 240 HG3 LYS 29 HG2 LYS 29 93.941 -15.719 -2.599 241 HD2 LYS 29 HD2 LYS 29 91.074 -15.393 -1.729 242 HD3 LYS 29 HD3 LYS 29 91.408 -16.204 -3.278 243 HE2 LYS 29 HE3 LYS 29 92.805 -16.974 -0.686 244 HE3 LYS 29 HE2 LYS 29 91.284 -17.730 -1.220 245 HZ1 LYS 29 HZ1 LYS 29 93.206 -18.972 -1.963 246 HZ2 LYS 29 HZ2 LYS 29 93.800 -17.659 -2.765 247 HZ3 LYS 29 HZ3 LYS 29 92.392 -18.360 -3.260 248 H LEU 30 H LEU 30 93.927 -11.348 -1.824 249 HA LEU 30 HA LEU 30 94.916 -11.532 -4.626 250 HB2 LEU 30 HB2 LEU 30 93.887 -9.259 -4.853 251 HB3 LEU 30 HB3 LEU 30 92.743 -10.489 -4.266 252 HG LEU 30 HG LEU 30 93.780 -9.584 -1.893 253 HD11 LEU 30 HD11 LEU 30 95.122 -7.841 -3.041 254 HD12 LEU 30 HD12 LEU 30 93.860 -7.109 -2.021 255 HD13 LEU 30 HD13 LEU 30 93.641 -7.193 -3.786 256 HD21 LEU 30 HD21 LEU 30 91.384 -9.848 -2.482 257 HD22 LEU 30 HD22 LEU 30 91.462 -8.363 -3.460 258 HD23 LEU 30 HD23 LEU 30 91.681 -8.279 -1.696 259 H ALA 31 H ALA 31 96.073 -10.543 -1.626 260 HA ALA 31 HA ALA 31 97.638 -8.243 -2.183 261 HB1 ALA 31 HB1 ALA 31 99.347 -9.638 -0.588 262 HB2 ALA 31 HB2 ALA 31 97.852 -10.563 -0.315 263 HB3 ALA 31 HB3 ALA 31 97.893 -8.817 0.028 264 H ALA 32 H ALA 32 98.626 -11.689 -2.580 265 HA ALA 32 HA ALA 32 101.185 -11.113 -3.748 266 HB1 ALA 32 HB1 ALA 32 101.051 -13.404 -4.687 267 HB2 ALA 32 HB2 ALA 32 99.310 -13.452 -4.319 268 HB3 ALA 32 HB3 ALA 32 100.497 -13.373 -2.996 269 H HIS 33 H HIS 33 97.929 -11.141 -5.133 270 HA HIS 33 HA HIS 33 99.067 -10.772 -7.879 271 HB2 HIS 33 HB2 HIS 33 96.299 -11.207 -6.735 272 HB3 HIS 33 HB3 HIS 33 96.494 -10.562 -8.383 273 HD2 HIS 33 HD2 HIS 33 98.774 -13.435 -6.834 274 HE1 HIS 33 HE1 HIS 33 96.727 -14.972 -10.192 275 HE2 HIS 33 HE2 HIS 33 98.489 -15.504 -8.423 276 H ASP 34 H ASP 34 99.588 -8.744 -5.848 277 HA ASP 34 HA ASP 34 97.977 -6.465 -7.020 278 HB2 ASP 34 HB2 ASP 34 97.592 -6.774 -4.592 279 HB3 ASP 34 HB3 ASP 34 99.344 -6.665 -4.299 280 H ASN 35 H ASN 35 99.691 -6.665 -8.776 281 HA ASN 35 HA ASN 35 102.405 -5.749 -7.957 282 HB2 ASN 35 HB2 ASN 35 102.724 -5.768 -10.533 283 HB3 ASN 35 HB3 ASN 35 102.456 -7.332 -9.726 284 HD21 ASN 35 HD21 ASN 35 99.987 -7.963 -9.579 285 HD22 ASN 35 HD22 ASN 35 99.035 -7.618 -11.005 286 H LEU 36 H LEU 36 100.437 -3.910 -7.247 287 HA LEU 36 HA LEU 36 99.597 -1.911 -8.948 288 HB2 LEU 36 HB2 LEU 36 99.845 -0.324 -7.129 289 HB3 LEU 36 HB3 LEU 36 99.415 -1.905 -6.436 290 HG LEU 36 HG LEU 36 102.337 -1.310 -6.753 291 HD11 LEU 36 HD11 LEU 36 101.436 0.828 -5.876 292 HD12 LEU 36 HD12 LEU 36 100.590 -0.059 -4.585 293 HD13 LEU 36 HD13 LEU 36 102.369 -0.033 -4.629 294 HD21 LEU 36 HD21 LEU 36 101.500 -3.449 -5.817 295 HD22 LEU 36 HD22 LEU 36 102.407 -2.527 -4.595 296 HD23 LEU 36 HD23 LEU 36 100.628 -2.553 -4.551 297 H LYS 37 H LYS 37 100.501 0.287 -9.341 298 HA LYS 37 HA LYS 37 103.340 0.053 -10.349 299 HB2 LYS 37 HB2 LYS 37 101.366 0.613 -11.922 300 HB3 LYS 37 HB3 LYS 37 101.283 2.176 -11.075 301 HG2 LYS 37 HG3 LYS 37 103.785 2.429 -11.588 302 HG3 LYS 37 HG2 LYS 37 103.601 1.039 -12.684 303 HD2 LYS 37 HD2 LYS 37 101.821 3.500 -12.852 304 HD3 LYS 37 HD3 LYS 37 103.348 3.361 -13.755 305 HE2 LYS 37 HE2 LYS 37 102.468 1.148 -14.676 306 HE3 LYS 37 HE3 LYS 37 100.893 1.571 -13.963 307 HZ1 LYS 37 HZ1 LYS 37 101.052 2.282 -16.255 308 HZ2 LYS 37 HZ2 LYS 37 102.381 3.201 -15.924 309 HZ3 LYS 37 HZ3 LYS 37 100.922 3.593 -15.263 310 H LEU 38 H LEU 38 104.844 1.714 -9.791 311 HA LEU 38 HA LEU 38 103.816 3.780 -7.856 312 HB2 LEU 38 HB2 LEU 38 106.389 2.286 -7.286 313 HB3 LEU 38 HB3 LEU 38 105.398 3.265 -6.180 314 HG LEU 38 HG LEU 38 103.545 1.436 -6.774 315 HD11 LEU 38 HD11 LEU 38 105.466 -0.677 -6.681 316 HD12 LEU 38 HD12 LEU 38 105.947 0.402 -8.012 317 HD13 LEU 38 HD13 LEU 38 104.314 -0.307 -7.986 318 HD21 LEU 38 HD21 LEU 38 103.950 1.405 -4.525 319 HD22 LEU 38 HD22 LEU 38 105.705 1.605 -4.744 320 HD23 LEU 38 HD23 LEU 38 104.967 -0.007 -4.898 321 H THR 39 H THR 39 104.516 5.736 -8.466 322 HA THR 39 HA THR 39 106.984 5.870 -10.201 323 HB THR 39 HB THR 39 104.992 8.112 -9.696 324 HG1 THR 39 HG1 THR 39 103.977 7.349 -11.635 325 HG21 THR 39 HG21 THR 39 105.830 8.875 -11.901 326 HG22 THR 39 HG22 THR 39 107.166 8.684 -10.740 327 HG23 THR 39 HG23 THR 39 106.891 7.449 -11.991 328 H ILE 40 H ILE 40 108.803 6.348 -9.061 329 HA ILE 40 HA ILE 40 108.441 7.999 -6.552 330 HB ILE 40 HB ILE 40 110.795 6.232 -7.347 331 HG12 ILE 40 HG12 ILE 40 109.822 4.720 -5.539 332 HG13 ILE 40 HG13 ILE 40 108.346 5.713 -5.608 333 HG21 ILE 40 HG21 ILE 40 111.319 8.052 -5.746 334 HG22 ILE 40 HG22 ILE 40 109.971 7.527 -4.709 335 HG23 ILE 40 HG23 ILE 40 111.378 6.463 -4.948 336 HD11 ILE 40 HD11 ILE 40 108.814 3.497 -7.181 337 HD12 ILE 40 HD12 ILE 40 109.347 4.813 -8.253 338 HD13 ILE 40 HD13 ILE 40 107.691 4.812 -7.601 339 H THR 41 H THR 41 109.531 9.894 -6.294 340 HA THR 41 HA THR 41 111.504 10.658 -8.449 341 HB THR 41 HB THR 41 109.674 12.708 -7.201 342 HG1 THR 41 HG1 THR 41 108.181 11.282 -7.988 343 HG21 THR 41 HG21 THR 41 110.043 13.807 -9.393 344 HG22 THR 41 HG22 THR 41 110.980 12.397 -9.941 345 HG23 THR 41 HG23 THR 41 111.590 13.407 -8.608 346 H GLN 42 H GLN 42 113.160 12.131 -7.695 347 HA GLN 42 HA GLN 42 113.189 12.548 -4.706 348 HB2 GLN 42 HB3 GLN 42 114.518 10.516 -5.175 349 HB3 GLN 42 HB2 GLN 42 115.480 11.414 -6.374 350 HG2 GLN 42 HG2 GLN 42 116.530 12.733 -4.734 351 HG3 GLN 42 HG3 GLN 42 115.244 12.443 -3.538 352 HE21 GLN 42 HE21 GLN 42 117.910 10.761 -5.316 353 HE22 GLN 42 HE22 GLN 42 118.185 9.570 -4.066 354 H GLU 43 H GLU 43 114.298 14.452 -4.053 355 HA GLU 43 HA GLU 43 115.703 16.002 -6.188 356 HB2 GLU 43 HB2 GLU 43 113.016 16.686 -5.059 357 HB3 GLU 43 HB3 GLU 43 114.175 18.025 -5.242 358 HG2 GLU 43 HG2 GLU 43 114.535 17.331 -7.625 359 HG3 GLU 43 HG3 GLU 43 113.281 16.085 -7.422 360 H GLY 44 H GLY 44 117.453 15.434 -4.653 361 HA2 GLY 44 HA2 GLY 44 118.954 16.133 -2.976 362 HA3 GLY 44 HA3 GLY 44 118.044 17.659 -2.903 363 H ASN 45 H ASN 45 116.325 17.865 -1.382 364 HA ASN 45 HA ASN 45 116.314 15.675 0.710 365 HB2 ASN 45 HB2 ASN 45 115.680 18.520 1.439 366 HB3 ASN 45 HB3 ASN 45 116.437 17.239 2.414 367 HD21 ASN 45 HD21 ASN 45 117.039 19.759 -0.025 368 HD22 ASN 45 HD22 ASN 45 118.784 19.662 0.057 369 H LYS 46 H LYS 46 114.479 16.114 -1.627 370 HA LYS 46 HA LYS 46 111.987 15.942 -0.021 371 HB2 LYS 46 HB2 LYS 46 110.801 17.660 -1.185 372 HB3 LYS 46 HB3 LYS 46 112.335 18.399 -0.671 373 HG2 LYS 46 HG3 LYS 46 113.201 17.582 -3.021 374 HG3 LYS 46 HG2 LYS 46 111.468 17.523 -3.430 375 HD2 LYS 46 HD3 LYS 46 111.263 19.890 -2.583 376 HD3 LYS 46 HD2 LYS 46 113.032 19.922 -2.393 377 HE2 LYS 46 HE2 LYS 46 112.114 18.970 -5.046 378 HE3 LYS 46 HE3 LYS 46 111.684 20.660 -4.688 379 HZ1 LYS 46 HZ1 LYS 46 113.861 21.246 -4.537 380 HZ2 LYS 46 HZ2 LYS 46 113.996 20.053 -5.668 381 HZ3 LYS 46 HZ3 LYS 46 114.387 19.747 -4.095 382 H PHE 47 H PHE 47 111.294 14.068 -0.687 383 HA PHE 47 HA PHE 47 111.632 13.333 -3.592 384 HB2 PHE 47 HB2 PHE 47 111.033 10.984 -2.634 385 HB3 PHE 47 HB3 PHE 47 112.649 11.644 -2.287 386 HD1 PHE 47 HD1 PHE 47 113.376 11.743 -0.072 387 HD2 PHE 47 HD2 PHE 47 109.161 11.596 -0.881 388 HE1 PHE 47 HE1 PHE 47 112.915 11.588 2.361 389 HE2 PHE 47 HE2 PHE 47 108.699 11.445 1.551 390 HZ PHE 47 HZ PHE 47 110.575 11.441 3.172 391 H THR 48 H THR 48 109.776 11.756 -4.302 392 HA THR 48 HA THR 48 107.154 12.563 -3.118 393 HB THR 48 HB THR 48 107.713 12.874 -6.096 394 HG1 THR 48 HG1 THR 48 108.642 14.690 -5.574 395 HG21 THR 48 HG21 THR 48 105.595 14.161 -6.026 396 HG22 THR 48 HG22 THR 48 105.470 13.859 -4.277 397 HG23 THR 48 HG23 THR 48 105.360 12.503 -5.424 398 H VAL 49 H VAL 49 106.565 10.496 -2.648 399 HA VAL 49 HA VAL 49 106.987 8.354 -4.696 400 HB VAL 49 HB VAL 49 105.695 8.166 -1.940 401 HG11 VAL 49 HG11 VAL 49 105.218 6.292 -3.492 402 HG12 VAL 49 HG12 VAL 49 106.292 5.771 -2.171 403 HG13 VAL 49 HG13 VAL 49 106.962 6.095 -3.788 404 HG21 VAL 49 HG21 VAL 49 108.008 9.050 -1.784 405 HG22 VAL 49 HG22 VAL 49 108.590 7.704 -2.792 406 HG23 VAL 49 HG23 VAL 49 107.921 7.379 -1.175 407 H LYS 50 H LYS 50 105.445 8.131 -6.241 408 HA LYS 50 HA LYS 50 102.608 8.843 -5.460 409 HB2 LYS 50 HB2 LYS 50 104.237 9.238 -7.932 410 HB3 LYS 50 HB3 LYS 50 102.542 8.759 -8.185 411 HG2 LYS 50 HG3 LYS 50 101.826 10.622 -6.675 412 HG3 LYS 50 HG2 LYS 50 103.527 11.125 -6.529 413 HD2 LYS 50 HD2 LYS 50 103.660 11.554 -8.928 414 HD3 LYS 50 HD3 LYS 50 102.023 10.900 -9.173 415 HE2 LYS 50 HE2 LYS 50 101.301 12.724 -7.430 416 HE3 LYS 50 HE3 LYS 50 102.862 13.481 -7.830 417 HZ1 LYS 50 HZ1 LYS 50 101.093 14.286 -9.247 418 HZ2 LYS 50 HZ2 LYS 50 100.759 12.759 -9.772 419 HZ3 LYS 50 HZ3 LYS 50 102.205 13.461 -10.143 420 H GLU 51 H GLU 51 101.783 6.878 -4.771 421 HA GLU 51 HA GLU 51 102.381 4.402 -6.302 422 HB2 GLU 51 HB3 GLU 51 100.504 5.007 -3.973 423 HB3 GLU 51 HB2 GLU 51 100.725 3.387 -4.677 424 HG2 GLU 51 HG2 GLU 51 103.249 3.732 -4.261 425 HG3 GLU 51 HG3 GLU 51 102.776 5.112 -3.242 426 H SER 52 H SER 52 100.660 3.124 -7.351 427 HA SER 52 HA SER 52 98.085 4.481 -7.864 428 HB2 SER 52 HB2 SER 52 99.799 3.877 -10.288 429 HB3 SER 52 HB3 SER 52 98.349 4.903 -10.172 430 HG SER 52 HG SER 52 100.498 6.000 -10.244 431 H SER 53 H SER 53 96.898 2.775 -7.385 432 HA SER 53 HA SER 53 97.367 0.259 -8.977 433 HB2 SER 53 HB2 SER 53 97.438 -1.068 -7.116 434 HB3 SER 53 HB3 SER 53 97.908 0.429 -6.274 435 HG SER 53 HG SER 53 96.146 -0.199 -5.162 436 H ALA 54 H ALA 54 95.433 -0.741 -9.654 437 HA ALA 54 HA ALA 54 93.136 0.947 -9.970 438 HB1 ALA 54 HB1 ALA 54 91.954 -1.123 -10.654 439 HB2 ALA 54 HB2 ALA 54 93.276 -2.102 -9.974 440 HB3 ALA 54 HB3 ALA 54 93.579 -1.048 -11.376 441 H PHE 55 H PHE 55 94.294 0.004 -7.093 442 HA PHE 55 HA PHE 55 91.548 -0.548 -5.960 443 HB2 PHE 55 HB3 PHE 55 94.332 -1.347 -5.080 444 HB3 PHE 55 HB2 PHE 55 92.978 -1.325 -3.925 445 HD1 PHE 55 HD1 PHE 55 94.473 -3.014 -6.805 446 HD2 PHE 55 HD2 PHE 55 90.979 -2.762 -4.318 447 HE1 PHE 55 HE1 PHE 55 93.695 -5.202 -7.676 448 HE2 PHE 55 HE2 PHE 55 90.202 -4.951 -5.189 449 HZ PHE 55 HZ PHE 55 91.558 -6.169 -6.870 450 H ARG 56 H ARG 56 94.217 1.747 -5.970 451 HA ARG 56 HA ARG 56 92.816 3.837 -4.752 452 HB2 ARG 56 HB2 ARG 56 93.548 1.774 -2.777 453 HB3 ARG 56 HB3 ARG 56 94.173 3.385 -2.353 454 HG2 ARG 56 HG3 ARG 56 91.322 3.144 -3.305 455 HG3 ARG 56 HG2 ARG 56 91.712 2.652 -1.639 456 HD2 ARG 56 HD2 ARG 56 92.547 4.826 -1.086 457 HD3 ARG 56 HD3 ARG 56 92.596 5.323 -2.795 458 HE ARG 56 HE ARG 56 89.880 4.604 -1.962 459 HH11 ARG 56 HH11 ARG 56 88.439 6.334 -1.749 460 HH12 ARG 56 HH12 ARG 56 89.048 7.970 -1.640 461 HH21 ARG 56 HH21 ARG 56 92.388 7.017 -1.878 462 HH22 ARG 56 HH22 ARG 56 91.274 8.355 -1.713 463 H ASN 57 H ASN 57 94.317 4.754 -6.296 464 HA ASN 57 HA ASN 57 97.189 4.588 -5.975 465 HB2 ASN 57 HB2 ASN 57 97.268 6.554 -7.442 466 HB3 ASN 57 HB3 ASN 57 96.029 5.421 -8.034 467 HD21 ASN 57 HD21 ASN 57 94.065 6.100 -5.895 468 HD22 ASN 57 HD22 ASN 57 93.475 7.700 -6.284 469 H ILE 58 H ILE 58 98.649 5.978 -4.901 470 HA ILE 58 HA ILE 58 97.402 8.036 -3.087 471 HB ILE 58 HB ILE 58 99.629 6.304 -2.049 472 HG12 ILE 58 HG12 ILE 58 96.708 5.545 -2.332 473 HG13 ILE 58 HG13 ILE 58 98.156 4.563 -2.667 474 HG21 ILE 58 HG21 ILE 58 98.553 8.461 -0.983 475 HG22 ILE 58 HG22 ILE 58 97.219 7.363 -0.554 476 HG23 ILE 58 HG23 ILE 58 98.864 7.044 0.048 477 HD11 ILE 58 HD11 ILE 58 97.447 3.717 -0.591 478 HD12 ILE 58 HD12 ILE 58 96.935 5.318 -0.005 479 HD13 ILE 58 HD13 ILE 58 98.667 4.922 -0.114 480 H GLU 59 H GLU 59 99.245 9.282 -1.955 481 HA GLU 59 HA GLU 59 101.722 9.484 -3.611 482 HB2 GLU 59 HB2 GLU 59 101.397 11.696 -4.353 483 HB3 GLU 59 HB3 GLU 59 99.792 10.966 -4.591 484 HG2 GLU 59 HG3 GLU 59 99.334 11.799 -2.140 485 HG3 GLU 59 HG2 GLU 59 100.716 12.881 -2.438 486 H CYS 60 H CYS 60 103.435 10.387 -2.447 487 HA CYS 60 HA CYS 60 102.810 11.626 0.211 488 HB2 CYS 60 HB2 CYS 60 103.876 8.897 -0.198 489 HB3 CYS 60 HB3 CYS 60 104.889 9.903 0.865 490 HG CYS 60 HG CYS 60 101.492 9.941 1.404 491 H VAL 61 H VAL 61 103.908 13.525 -0.013 492 HA VAL 61 HA VAL 61 106.659 13.385 -1.259 493 HB VAL 61 HB VAL 61 105.324 16.010 -0.717 494 HG11 VAL 61 HG11 VAL 61 106.354 16.544 -2.904 495 HG12 VAL 61 HG12 VAL 61 107.551 15.846 -1.787 496 HG13 VAL 61 HG13 VAL 61 106.855 14.845 -3.084 497 HG21 VAL 61 HG21 VAL 61 104.120 15.713 -2.983 498 HG22 VAL 61 HG22 VAL 61 103.399 14.898 -1.575 499 HG23 VAL 61 HG23 VAL 61 104.361 13.966 -2.748 500 H PHE 62 H PHE 62 108.426 14.151 -0.078 501 HA PHE 62 HA PHE 62 108.246 15.825 2.235 502 HB2 PHE 62 HB2 PHE 62 107.523 13.002 2.704 503 HB3 PHE 62 HB3 PHE 62 108.825 13.583 3.769 504 HD1 PHE 62 HD1 PHE 62 108.333 16.223 4.494 505 HD2 PHE 62 HD2 PHE 62 105.401 13.207 3.622 506 HE1 PHE 62 HE1 PHE 62 106.667 17.448 5.861 507 HE2 PHE 62 HE2 PHE 62 103.735 14.433 4.989 508 HZ PHE 62 HZ PHE 62 104.368 16.554 6.109 509 H GLU 63 H GLU 63 110.220 15.288 3.819 510 HA GLU 63 HA GLU 63 112.573 14.800 1.991 511 HB2 GLU 63 HB2 GLU 63 112.701 16.024 4.765 512 HB3 GLU 63 HB3 GLU 63 113.833 16.225 3.406 513 HG2 GLU 63 HG2 GLU 63 112.666 18.237 3.294 514 HG3 GLU 63 HG3 GLU 63 111.691 17.232 2.195 515 H LEU 64 H LEU 64 114.546 13.912 3.372 516 HA LEU 64 HA LEU 64 113.486 11.446 4.706 517 HB2 LEU 64 HB2 LEU 64 115.716 10.542 4.428 518 HB3 LEU 64 HB3 LEU 64 115.258 11.322 2.896 519 HG LEU 64 HG LEU 64 116.411 13.439 4.148 520 HD11 LEU 64 HD11 LEU 64 118.433 11.408 4.920 521 HD12 LEU 64 HD12 LEU 64 117.937 12.897 5.760 522 HD13 LEU 64 HD13 LEU 64 116.975 11.411 5.941 523 HD21 LEU 64 HD21 LEU 64 118.444 12.902 2.830 524 HD22 LEU 64 HD22 LEU 64 116.967 12.546 1.903 525 HD23 LEU 64 HD23 LEU 64 117.885 11.221 2.656 526 H GLY 65 H GLY 65 113.294 11.436 6.881 527 HA2 GLY 65 HA3 GLY 65 114.694 11.601 9.009 528 HA3 GLY 65 HA2 GLY 65 115.192 13.210 8.439 529 H VAL 66 H VAL 66 112.528 13.958 7.428 530 HA VAL 66 HA VAL 66 111.396 14.785 10.051 531 HB VAL 66 HB VAL 66 110.182 15.336 7.324 532 HG11 VAL 66 HG11 VAL 66 108.923 16.009 9.353 533 HG12 VAL 66 HG12 VAL 66 109.503 17.434 8.459 534 HG13 VAL 66 HG13 VAL 66 110.344 16.907 9.937 535 HG21 VAL 66 HG21 VAL 66 111.677 17.493 7.566 536 HG22 VAL 66 HG22 VAL 66 112.394 16.007 6.898 537 HG23 VAL 66 HG23 VAL 66 112.690 16.453 8.596 538 H THR 67 H THR 67 110.019 13.447 11.111 539 HA THR 67 HA THR 67 108.777 11.131 10.003 540 HB THR 67 HB THR 67 107.391 12.717 12.164 541 HG1 THR 67 HG1 THR 67 109.494 12.929 12.799 542 HG21 THR 67 HG21 THR 67 106.810 10.590 12.996 543 HG22 THR 67 HG22 THR 67 106.764 10.345 11.233 544 HG23 THR 67 HG23 THR 67 108.171 9.790 12.172 545 H PHE 68 H PHE 68 106.750 10.696 9.226 546 HA PHE 68 HA PHE 68 104.738 12.826 8.896 547 HB2 PHE 68 HB3 PHE 68 104.782 12.177 6.280 548 HB3 PHE 68 HB2 PHE 68 105.699 13.556 6.930 549 HD1 PHE 68 HD1 PHE 68 106.132 9.816 6.635 550 HD2 PHE 68 HD2 PHE 68 107.889 13.716 6.249 551 HE1 PHE 68 HE1 PHE 68 108.258 8.787 5.858 552 HE2 PHE 68 HE2 PHE 68 110.006 12.688 5.486 553 HZ PHE 68 HZ PHE 68 110.190 10.227 5.285 554 H ASN 69 H ASN 69 103.101 11.650 7.032 555 HA ASN 69 HA ASN 69 102.897 8.806 8.029 556 HB2 ASN 69 HB2 ASN 69 100.430 9.101 8.140 557 HB3 ASN 69 HB3 ASN 69 101.276 10.205 9.251 558 HD21 ASN 69 HD21 ASN 69 101.688 12.493 8.349 559 HD22 ASN 69 HD22 ASN 69 100.476 13.157 7.277 560 H CYS 70 H CYS 70 101.955 7.326 6.581 561 HA CYS 70 HA CYS 70 101.117 8.291 3.893 562 HB2 CYS 70 HB2 CYS 70 103.619 6.622 4.375 563 HB3 CYS 70 HB3 CYS 70 102.773 6.654 2.810 564 HG CYS 70 HG CYS 70 104.880 8.925 4.090 565 H ASN 71 H ASN 71 99.529 6.925 3.137 566 HA ASN 71 HA ASN 71 98.977 4.544 4.860 567 HB2 ASN 71 HB3 ASN 71 96.939 4.590 3.029 568 HB3 ASN 71 HB2 ASN 71 96.920 5.487 4.566 569 HD21 ASN 71 HD21 ASN 71 98.383 7.701 4.262 570 HD22 ASN 71 HD22 ASN 71 97.907 8.630 2.859 571 H LEU 72 H LEU 72 98.834 2.434 4.082 572 HA LEU 72 HA LEU 72 100.365 1.981 1.543 573 HB2 LEU 72 HB2 LEU 72 99.472 0.139 3.800 574 HB3 LEU 72 HB3 LEU 72 100.298 -0.436 2.333 575 HG LEU 72 HG LEU 72 101.412 1.724 4.173 576 HD11 LEU 72 HD11 LEU 72 101.240 -0.448 5.358 577 HD12 LEU 72 HD12 LEU 72 102.937 -0.045 5.003 578 HD13 LEU 72 HD13 LEU 72 102.083 -1.249 4.010 579 HD21 LEU 72 HD21 LEU 72 102.226 1.764 1.828 580 HD22 LEU 72 HD22 LEU 72 102.658 0.042 1.949 581 HD23 LEU 72 HD23 LEU 72 103.513 1.246 2.943 582 H ALA 73 H ALA 73 99.514 0.772 -0.193 583 HA ALA 73 HA ALA 73 96.895 1.191 -1.022 584 HB1 ALA 73 HB1 ALA 73 97.128 -0.816 -2.459 585 HB2 ALA 73 HB2 ALA 73 98.507 -1.359 -1.475 586 HB3 ALA 73 HB3 ALA 73 98.633 0.134 -2.435 587 H ASP 74 H ASP 74 98.017 -1.338 1.217 588 HA ASP 74 HA ASP 74 95.556 -2.853 1.263 589 HB2 ASP 74 HB3 ASP 74 97.873 -3.423 2.298 590 HB3 ASP 74 HB2 ASP 74 97.338 -2.446 3.686 591 H GLY 75 H GLY 75 95.663 0.308 1.678 592 HA2 GLY 75 HA3 GLY 75 94.148 1.802 2.718 593 HA3 GLY 75 HA2 GLY 75 93.213 0.388 3.262 594 H THR 76 H THR 76 96.641 0.711 4.001 595 HA THR 76 HA THR 76 95.876 0.907 6.901 596 HB THR 76 HB THR 76 98.729 0.574 6.209 597 HG1 THR 76 HG1 THR 76 97.872 -0.613 4.497 598 HG21 THR 76 HG21 THR 76 98.513 -1.253 7.868 599 HG22 THR 76 HG22 THR 76 96.746 -1.042 7.869 600 HG23 THR 76 HG23 THR 76 97.797 0.258 8.480 601 H GLU 77 H GLU 77 97.235 2.322 8.277 602 HA GLU 77 HA GLU 77 98.335 4.691 6.762 603 HB2 GLU 77 HB2 GLU 77 95.981 5.090 7.666 604 HB3 GLU 77 HB3 GLU 77 96.662 4.894 9.300 605 HG2 GLU 77 HG3 GLU 77 98.154 6.772 8.982 606 HG3 GLU 77 HG2 GLU 77 97.738 6.879 7.254 607 H LEU 78 H LEU 78 100.449 4.958 7.361 608 HA LEU 78 HA LEU 78 101.113 4.387 10.255 609 HB2 LEU 78 HB3 LEU 78 103.117 3.698 8.115 610 HB3 LEU 78 HB2 LEU 78 102.918 3.011 9.744 611 HG LEU 78 HG LEU 78 100.568 2.223 8.735 612 HD11 LEU 78 HD11 LEU 78 100.922 3.363 6.560 613 HD12 LEU 78 HD12 LEU 78 102.405 2.413 6.304 614 HD13 LEU 78 HD13 LEU 78 100.823 1.598 6.348 615 HD21 LEU 78 HD21 LEU 78 102.352 0.751 9.633 616 HD22 LEU 78 HD22 LEU 78 103.239 0.889 8.096 617 HD23 LEU 78 HD23 LEU 78 101.657 0.074 8.140 618 H ARG 79 H ARG 79 103.197 5.404 10.928 619 HA ARG 79 HA ARG 79 104.036 7.687 9.161 620 HB2 ARG 79 HB2 ARG 79 103.850 9.292 11.017 621 HB3 ARG 79 HB3 ARG 79 102.263 8.562 10.677 622 HG2 ARG 79 HG2 ARG 79 102.701 6.898 12.518 623 HG3 ARG 79 HG3 ARG 79 104.194 7.785 12.907 624 HD2 ARG 79 HD3 ARG 79 101.812 9.524 12.681 625 HD3 ARG 79 HD2 ARG 79 101.692 8.318 13.985 626 HE ARG 79 HE ARG 79 104.292 9.702 13.961 627 HH11 ARG 79 HH11 ARG 79 104.638 11.097 15.708 628 HH12 ARG 79 HH12 ARG 79 103.293 11.596 16.708 629 HH21 ARG 79 HH21 ARG 79 100.940 9.771 14.903 630 HH22 ARG 79 HH22 ARG 79 101.208 10.849 16.255 631 H GLY 80 H GLY 80 106.176 8.368 9.513 632 HA2 GLY 80 HA3 GLY 80 107.827 7.813 11.723 633 HA3 GLY 80 HA2 GLY 80 107.937 6.368 10.682 634 H THR 81 H THR 81 109.574 6.485 9.219 635 HA THR 81 HA THR 81 109.880 8.588 7.328 636 HB THR 81 HB THR 81 112.243 9.145 8.877 637 HG1 THR 81 HG1 THR 81 111.480 9.439 10.822 638 HG21 THR 81 HG21 THR 81 111.338 11.471 8.730 639 HG22 THR 81 HG22 THR 81 109.805 10.806 8.116 640 HG23 THR 81 HG23 THR 81 111.300 10.618 7.168 641 H TRP 82 H TRP 82 111.847 8.412 6.052 642 HA TRP 82 HA TRP 82 113.102 5.691 6.398 643 HB2 TRP 82 HB2 TRP 82 113.403 7.478 3.966 644 HB3 TRP 82 HB3 TRP 82 113.565 5.709 4.076 645 HD1 TRP 82 HD1 TRP 82 110.820 8.389 4.586 646 HE1 TRP 82 HE1 TRP 82 108.561 7.429 3.804 647 HE3 TRP 82 HE3 TRP 82 112.342 3.683 3.342 648 HZ2 TRP 82 HZ2 TRP 82 107.563 4.919 2.765 649 HZ3 TRP 82 HZ3 TRP 82 110.727 2.027 2.459 650 HH2 TRP 82 HH2 TRP 82 108.341 2.638 2.168 651 H SER 83 H SER 83 115.358 5.476 6.480 652 HA SER 83 HA SER 83 116.959 8.024 6.460 653 HB2 SER 83 HB2 SER 83 116.428 6.239 8.796 654 HB3 SER 83 HB3 SER 83 118.123 6.728 8.560 655 HG SER 83 HG SER 83 116.924 8.256 9.828 656 H LEU 84 H LEU 84 119.305 7.556 6.160 657 HA LEU 84 HA LEU 84 119.577 4.943 4.711 658 HB2 LEU 84 HB2 LEU 84 120.512 6.407 3.234 659 HB3 LEU 84 HB3 LEU 84 120.764 7.650 4.481 660 HG LEU 84 HG LEU 84 122.695 6.244 5.347 661 HD11 LEU 84 HD11 LEU 84 121.999 4.101 4.310 662 HD12 LEU 84 HD12 LEU 84 122.250 4.802 2.694 663 HD13 LEU 84 HD13 LEU 84 123.635 4.565 3.786 664 HD21 LEU 84 HD21 LEU 84 124.234 6.977 3.545 665 HD22 LEU 84 HD22 LEU 84 123.031 8.236 3.912 666 HD23 LEU 84 HD23 LEU 84 122.845 7.223 2.460 667 H GLU 85 H GLU 85 120.554 3.295 5.726 668 HA GLU 85 HA GLU 85 122.434 3.957 8.003 669 HB2 GLU 85 HB2 GLU 85 120.213 1.958 7.732 670 HB3 GLU 85 HB3 GLU 85 121.679 1.429 8.593 671 HG2 GLU 85 HG2 GLU 85 121.519 3.440 10.059 672 HG3 GLU 85 HG3 GLU 85 120.022 3.915 9.222 673 H GLY 86 H GLY 86 124.474 3.577 7.267 674 HA2 GLY 86 HA3 GLY 86 126.255 2.407 6.234 675 HA3 GLY 86 HA2 GLY 86 125.241 0.944 6.320 676 H ASN 87 H ASN 87 124.303 0.206 4.439 677 HA ASN 87 HA ASN 87 124.389 2.102 2.080 678 HB2 ASN 87 HB2 ASN 87 126.159 0.387 1.886 679 HB3 ASN 87 HB3 ASN 87 124.944 -0.897 2.093 680 HD21 ASN 87 HD21 ASN 87 124.448 2.132 0.222 681 HD22 ASN 87 HD22 ASN 87 124.295 1.333 -1.327 682 H LYS 88 H LYS 88 122.113 1.565 3.909 683 HA LYS 88 HA LYS 88 120.260 0.504 1.788 684 HB2 LYS 88 HB2 LYS 88 119.365 -0.315 4.436 685 HB3 LYS 88 HB3 LYS 88 119.639 -1.308 2.986 686 HG2 LYS 88 HG2 LYS 88 121.973 -1.579 3.505 687 HG3 LYS 88 HG3 LYS 88 121.904 -0.330 4.771 688 HD2 LYS 88 HD2 LYS 88 120.295 -1.769 6.043 689 HD3 LYS 88 HD3 LYS 88 120.497 -3.035 4.808 690 HE2 LYS 88 HE3 LYS 88 123.052 -2.780 5.292 691 HE3 LYS 88 HE2 LYS 88 122.530 -1.966 6.787 692 HZ1 LYS 88 HZ1 LYS 88 122.817 -4.332 7.114 693 HZ2 LYS 88 HZ2 LYS 88 121.234 -3.920 7.319 694 HZ3 LYS 88 HZ3 LYS 88 121.717 -4.674 5.934 695 H LEU 89 H LEU 89 118.161 1.391 1.864 696 HA LEU 89 HA LEU 89 117.975 3.885 3.529 697 HB2 LEU 89 HB2 LEU 89 116.322 2.820 1.195 698 HB3 LEU 89 HB3 LEU 89 115.960 4.331 2.062 699 HG LEU 89 HG LEU 89 118.753 3.903 1.012 700 HD11 LEU 89 HD11 LEU 89 117.275 3.301 -0.888 701 HD12 LEU 89 HD12 LEU 89 118.075 4.866 -1.171 702 HD13 LEU 89 HD13 LEU 89 116.369 4.817 -0.663 703 HD21 LEU 89 HD21 LEU 89 118.184 5.871 2.410 704 HD22 LEU 89 HD22 LEU 89 116.900 6.316 1.261 705 HD23 LEU 89 HD23 LEU 89 118.605 6.365 0.753 706 H ILE 90 H ILE 90 117.231 3.369 5.558 707 HA ILE 90 HA ILE 90 115.355 1.148 5.951 708 HB ILE 90 HB ILE 90 115.194 2.373 8.304 709 HG12 ILE 90 HG12 ILE 90 117.837 3.410 7.226 710 HG13 ILE 90 HG13 ILE 90 116.367 4.412 7.328 711 HG21 ILE 90 HG21 ILE 90 116.262 0.183 7.845 712 HG22 ILE 90 HG22 ILE 90 117.244 1.157 8.966 713 HG23 ILE 90 HG23 ILE 90 117.719 1.020 7.256 714 HD11 ILE 90 HD11 ILE 90 116.402 4.475 9.624 715 HD12 ILE 90 HD12 ILE 90 117.108 2.847 9.762 716 HD13 ILE 90 HD13 ILE 90 118.145 4.234 9.352 717 H GLY 91 H GLY 91 113.286 1.436 7.080 718 HA2 GLY 91 HA2 GLY 91 111.867 4.014 6.526 719 HA3 GLY 91 HA3 GLY 91 111.240 2.547 5.730 720 H LYS 92 H LYS 92 111.596 4.258 8.758 721 HA LYS 92 HA LYS 92 110.441 1.980 10.301 722 HB2 LYS 92 HB3 LYS 92 111.573 4.695 10.949 723 HB3 LYS 92 HB2 LYS 92 110.449 3.945 12.108 724 HG2 LYS 92 HG2 LYS 92 111.853 1.937 12.223 725 HG3 LYS 92 HG3 LYS 92 112.943 2.597 10.980 726 HD2 LYS 92 HD2 LYS 92 112.392 4.186 13.492 727 HD3 LYS 92 HD3 LYS 92 113.571 2.854 13.531 728 HE2 LYS 92 HE3 LYS 92 114.706 3.912 11.527 729 HE3 LYS 92 HE2 LYS 92 113.617 5.306 11.720 730 HZ1 LYS 92 HZ1 LYS 92 115.707 5.645 12.862 731 HZ2 LYS 92 HZ2 LYS 92 115.480 4.289 13.773 732 HZ3 LYS 92 HZ3 LYS 92 114.470 5.580 13.952 733 H PHE 93 H PHE 93 108.312 1.675 9.781 734 HA PHE 93 HA PHE 93 106.543 4.128 9.909 735 HB2 PHE 93 HB2 PHE 93 106.510 1.675 8.152 736 HB3 PHE 93 HB3 PHE 93 104.970 2.465 8.556 737 HD1 PHE 93 HD1 PHE 93 107.243 5.062 8.737 738 HD2 PHE 93 HD2 PHE 93 105.424 2.489 5.818 739 HE1 PHE 93 HE1 PHE 93 107.661 6.759 6.979 740 HE2 PHE 93 HE2 PHE 93 105.842 4.187 4.061 741 HZ PHE 93 HZ PHE 93 106.958 6.324 4.642 742 H LYS 94 H LYS 94 104.849 4.073 11.293 743 HA LYS 94 HA LYS 94 104.355 1.449 12.711 744 HB2 LYS 94 HB3 LYS 94 104.234 2.522 14.799 745 HB3 LYS 94 HB2 LYS 94 105.593 3.358 14.011 746 HG2 LYS 94 HG2 LYS 94 103.876 5.079 13.190 747 HG3 LYS 94 HG3 LYS 94 102.725 4.325 14.319 748 HD2 LYS 94 HD2 LYS 94 104.728 4.626 16.046 749 HD3 LYS 94 HD3 LYS 94 105.233 5.893 14.902 750 HE2 LYS 94 HE3 LYS 94 102.674 6.599 15.053 751 HE3 LYS 94 HE2 LYS 94 102.749 5.727 16.604 752 HZ1 LYS 94 HZ1 LYS 94 103.313 8.051 16.861 753 HZ2 LYS 94 HZ2 LYS 94 104.550 7.917 15.779 754 HZ3 LYS 94 HZ3 LYS 94 104.619 7.109 17.216 755 H ARG 95 H ARG 95 102.309 0.762 12.436 756 HA ARG 95 HA ARG 95 100.332 2.146 10.949 757 HB2 ARG 95 HB2 ARG 95 100.390 -0.178 12.794 758 HB3 ARG 95 HB3 ARG 95 98.804 0.620 12.670 759 HG2 ARG 95 HG2 ARG 95 98.669 0.253 10.333 760 HG3 ARG 95 HG3 ARG 95 100.416 -0.053 10.189 761 HD2 ARG 95 HD3 ARG 95 99.089 -2.159 10.045 762 HD3 ARG 95 HD2 ARG 95 100.171 -2.152 11.458 763 HE ARG 95 HE ARG 95 98.258 -2.038 12.899 764 HH11 ARG 95 HH11 ARG 95 96.023 -2.200 13.193 765 HH12 ARG 95 HH12 ARG 95 94.947 -2.044 11.823 766 HH21 ARG 95 HH21 ARG 95 97.521 -1.557 9.530 767 HH22 ARG 95 HH22 ARG 95 95.791 -1.682 9.758 768 H THR 96 H THR 96 99.348 4.047 11.389 769 HA THR 96 HA THR 96 99.433 5.210 14.071 770 HB THR 96 HB THR 96 97.469 6.606 12.709 771 HG1 THR 96 HG1 THR 96 99.372 5.732 10.779 772 HG21 THR 96 HG21 THR 96 99.308 8.161 12.132 773 HG22 THR 96 HG22 THR 96 99.503 7.525 13.783 774 HG23 THR 96 HG23 THR 96 100.496 6.876 12.456 775 H ASP 97 H ASP 97 97.541 2.913 12.598 776 HA ASP 97 HA ASP 97 95.030 3.486 14.052 777 HB2 ASP 97 HB2 ASP 97 96.020 1.160 12.358 778 HB3 ASP 97 HB3 ASP 97 94.441 1.143 13.179 779 H ASN 98 H ASN 98 97.645 1.027 14.242 780 HA ASN 98 HA ASN 98 96.848 0.652 17.131 781 HB2 ASN 98 HB2 ASN 98 97.713 -1.585 15.250 782 HB3 ASN 98 HB3 ASN 98 97.165 -1.749 16.936 783 HD21 ASN 98 HD21 ASN 98 94.863 -1.439 17.396 784 HD22 ASN 98 HD22 ASN 98 93.684 -1.456 16.104 785 H GLY 99 H GLY 99 99.164 1.843 15.205 786 HA2 GLY 99 HA3 GLY 99 101.535 1.964 15.346 787 HA3 GLY 99 HA2 GLY 99 101.230 1.925 17.099 788 H ASN 100 H ASN 100 100.674 -0.622 14.632 789 HA ASN 100 HA ASN 100 101.890 -2.622 16.397 790 HB2 ASN 100 HB2 ASN 100 100.793 -2.611 13.587 791 HB3 ASN 100 HB3 ASN 100 101.762 -3.997 14.142 792 HD21 ASN 100 HD21 ASN 100 98.771 -3.801 13.568 793 HD22 ASN 100 HD22 ASN 100 98.010 -4.324 15.054 794 H GLU 101 H GLU 101 103.357 -0.195 15.035 795 HA GLU 101 HA GLU 101 105.518 0.217 14.180 796 HB2 GLU 101 HB3 GLU 101 105.718 -1.942 16.216 797 HB3 GLU 101 HB2 GLU 101 107.135 -1.762 15.156 798 HG2 GLU 101 HG2 GLU 101 107.566 0.421 15.875 799 HG3 GLU 101 HG3 GLU 101 105.879 0.701 16.369 800 H LEU 102 H LEU 102 106.529 -0.100 12.270 801 HA LEU 102 HA LEU 102 106.613 -2.897 11.152 802 HB2 LEU 102 HB3 LEU 102 104.914 -2.193 9.761 803 HB3 LEU 102 HB2 LEU 102 105.289 -0.473 10.004 804 HG LEU 102 HG LEU 102 107.267 -0.699 8.511 805 HD11 LEU 102 HD11 LEU 102 106.476 -3.249 7.316 806 HD12 LEU 102 HD12 LEU 102 106.931 -3.450 9.025 807 HD13 LEU 102 HD13 LEU 102 108.079 -2.716 7.879 808 HD21 LEU 102 HD21 LEU 102 105.065 -0.041 7.572 809 HD22 LEU 102 HD22 LEU 102 104.668 -1.755 7.307 810 HD23 LEU 102 HD23 LEU 102 106.001 -1.000 6.400 811 H ASN 103 H ASN 103 108.642 -3.376 10.337 812 HA ASN 103 HA ASN 103 110.529 -1.017 10.089 813 HB2 ASN 103 HB3 ASN 103 110.776 -3.673 11.408 814 HB3 ASN 103 HB2 ASN 103 112.176 -3.193 10.418 815 HD21 ASN 103 HD21 ASN 103 113.692 -1.952 11.517 816 HD22 ASN 103 HD22 ASN 103 113.335 -0.934 12.895 817 H THR 104 H THR 104 111.020 -0.637 7.991 818 HA THR 104 HA THR 104 111.245 -3.061 6.197 819 HB THR 104 HB THR 104 109.182 -1.961 5.607 820 HG1 THR 104 HG1 THR 104 109.953 -2.258 3.651 821 HG21 THR 104 HG21 THR 104 109.440 0.574 4.911 822 HG22 THR 104 HG22 THR 104 109.253 0.150 6.629 823 HG23 THR 104 HG23 THR 104 110.866 0.523 5.974 824 H VAL 105 H VAL 105 112.356 -2.335 4.051 825 HA VAL 105 HA VAL 105 114.464 -0.260 4.517 826 HB VAL 105 HB VAL 105 115.045 -3.194 3.909 827 HG11 VAL 105 HG11 VAL 105 117.476 -2.233 4.081 828 HG12 VAL 105 HG12 VAL 105 116.708 -0.669 3.722 829 HG13 VAL 105 HG13 VAL 105 116.579 -2.011 2.560 830 HG21 VAL 105 HG21 VAL 105 116.461 -2.945 5.993 831 HG22 VAL 105 HG22 VAL 105 115.730 -1.340 6.231 832 HG23 VAL 105 HG23 VAL 105 114.711 -2.798 6.285 833 H ARG 106 H ARG 106 115.509 0.375 2.484 834 HA ARG 106 HA ARG 106 113.986 -0.613 0.059 835 HB2 ARG 106 HB2 ARG 106 114.034 2.033 1.212 836 HB3 ARG 106 HB3 ARG 106 114.857 2.086 -0.365 837 HG2 ARG 106 HG2 ARG 106 112.941 1.137 -1.487 838 HG3 ARG 106 HG3 ARG 106 112.148 0.760 0.061 839 HD2 ARG 106 HD3 ARG 106 111.432 2.922 -1.268 840 HD3 ARG 106 HD2 ARG 106 111.638 3.009 0.498 841 HE ARG 106 HE ARG 106 114.148 3.619 -0.860 842 HH11 ARG 106 HH11 ARG 106 114.774 5.790 -0.864 843 HH12 ARG 106 HH12 ARG 106 113.601 7.039 -0.513 844 HH21 ARG 106 HH21 ARG 106 110.973 4.801 -0.052 845 HH22 ARG 106 HH22 ARG 106 111.459 6.482 -0.055 846 H GLU 107 H GLU 107 115.228 -1.099 -1.699 847 HA GLU 107 HA GLU 107 118.094 -0.166 -1.700 848 HB2 GLU 107 HB2 GLU 107 118.745 -2.266 -1.122 849 HB3 GLU 107 HB3 GLU 107 117.104 -2.915 -1.338 850 HG2 GLU 107 HG2 GLU 107 117.452 -3.125 -3.746 851 HG3 GLU 107 HG3 GLU 107 119.037 -2.324 -3.622 852 H ILE 108 H ILE 108 119.038 -0.287 -3.921 853 HA ILE 108 HA ILE 108 116.862 -0.355 -6.015 854 HB ILE 108 HB ILE 108 119.297 1.474 -5.942 855 HG12 ILE 108 HG12 ILE 108 116.476 1.746 -4.920 856 HG13 ILE 108 HG13 ILE 108 117.989 2.393 -4.246 857 HG21 ILE 108 HG21 ILE 108 118.180 0.718 -8.156 858 HG22 ILE 108 HG22 ILE 108 116.786 1.691 -7.629 859 HG23 ILE 108 HG23 ILE 108 118.367 2.468 -7.886 860 HD11 ILE 108 HD11 ILE 108 116.885 4.304 -5.107 861 HD12 ILE 108 HD12 ILE 108 118.061 3.883 -6.374 862 HD13 ILE 108 HD13 ILE 108 116.348 3.443 -6.569 863 H ILE 109 H ILE 109 117.518 -2.586 -6.344 864 HA ILE 109 HA ILE 109 120.240 -3.317 -6.969 865 HB ILE 109 HB ILE 109 117.529 -4.520 -7.592 866 HG12 ILE 109 HG13 ILE 109 119.948 -5.552 -6.046 867 HG13 ILE 109 HG12 ILE 109 118.586 -4.679 -5.304 868 HG21 ILE 109 HG21 ILE 109 119.419 -6.472 -8.238 869 HG22 ILE 109 HG22 ILE 109 118.440 -5.550 -9.403 870 HG23 ILE 109 HG23 ILE 109 120.081 -5.000 -8.988 871 HD11 ILE 109 HD11 ILE 109 118.686 -7.452 -6.457 872 HD12 ILE 109 HD12 ILE 109 117.171 -6.535 -6.635 873 HD13 ILE 109 HD13 ILE 109 117.834 -6.851 -5.014 874 H GLY 110 H GLY 110 121.115 -1.770 -8.371 875 HA2 GLY 110 HA3 GLY 110 121.613 -0.842 -10.482 876 HA3 GLY 110 HA2 GLY 110 120.909 -2.324 -11.169 877 H ASP 111 H ASP 111 118.520 -2.359 -11.473 878 HA ASP 111 HA ASP 111 117.390 0.434 -11.715 879 HB2 ASP 111 HB2 ASP 111 118.268 -0.724 -13.906 880 HB3 ASP 111 HB3 ASP 111 116.782 -1.695 -13.771 881 H GLU 112 H GLU 112 116.982 -1.722 -9.692 882 HA GLU 112 HA GLU 112 113.995 -1.968 -10.095 883 HB2 GLU 112 HB2 GLU 112 115.941 -4.101 -9.117 884 HB3 GLU 112 HB3 GLU 112 114.178 -4.208 -8.897 885 HG2 GLU 112 HG3 GLU 112 113.772 -4.395 -11.206 886 HG3 GLU 112 HG2 GLU 112 115.339 -3.671 -11.639 887 H LEU 113 H LEU 113 112.780 -1.555 -8.195 888 HA LEU 113 HA LEU 113 114.469 -0.550 -5.910 889 HB2 LEU 113 HB3 LEU 113 112.698 0.963 -6.799 890 HB3 LEU 113 HB2 LEU 113 111.471 -0.255 -6.377 891 HG LEU 113 HG LEU 113 112.640 -0.107 -3.981 892 HD11 LEU 113 HD11 LEU 113 114.421 1.446 -4.739 893 HD12 LEU 113 HD12 LEU 113 113.182 2.627 -5.228 894 HD13 LEU 113 HD13 LEU 113 113.386 2.211 -3.509 895 HD21 LEU 113 HD21 LEU 113 110.270 0.429 -4.492 896 HD22 LEU 113 HD22 LEU 113 110.761 2.034 -5.084 897 HD23 LEU 113 HD23 LEU 113 110.965 1.618 -3.365 898 H VAL 114 H VAL 114 114.940 -2.090 -4.443 899 HA VAL 114 HA VAL 114 112.916 -4.253 -3.963 900 HB VAL 114 HB VAL 114 115.667 -3.966 -2.696 901 HG11 VAL 114 HG11 VAL 114 114.107 -5.608 -1.685 902 HG12 VAL 114 HG12 VAL 114 113.865 -6.359 -3.281 903 HG13 VAL 114 HG13 VAL 114 115.462 -6.427 -2.498 904 HG21 VAL 114 HG21 VAL 114 116.196 -5.715 -4.611 905 HG22 VAL 114 HG22 VAL 114 116.264 -3.971 -4.958 906 HG23 VAL 114 HG23 VAL 114 114.837 -4.918 -5.438 907 H GLN 115 H GLN 115 111.387 -3.735 -2.486 908 HA GLN 115 HA GLN 115 112.296 -2.127 -0.088 909 HB2 GLN 115 HB3 GLN 115 110.571 -1.005 -1.509 910 HB3 GLN 115 HB2 GLN 115 109.492 -2.399 -1.265 911 HG2 GLN 115 HG2 GLN 115 109.512 -2.013 1.170 912 HG3 GLN 115 HG3 GLN 115 110.638 -0.651 0.959 913 HE21 GLN 115 HE21 GLN 115 108.423 0.181 2.194 914 HE22 GLN 115 HE22 GLN 115 107.296 0.954 1.102 915 H THR 116 H THR 116 112.706 -3.602 1.501 916 HA THR 116 HA THR 116 110.829 -5.947 1.714 917 HB THR 116 HB THR 116 113.237 -5.640 3.484 918 HG1 THR 116 HG1 THR 116 114.153 -5.131 1.528 919 HG21 THR 116 HG21 THR 116 113.333 -8.087 3.112 920 HG22 THR 116 HG22 THR 116 111.718 -7.587 3.669 921 HG23 THR 116 HG23 THR 116 111.989 -7.963 1.951 922 H TYR 117 H TYR 117 109.675 -6.341 3.601 923 HA TYR 117 HA TYR 117 109.785 -4.104 5.638 924 HB2 TYR 117 HB3 TYR 117 107.275 -5.712 5.108 925 HB3 TYR 117 HB2 TYR 117 107.442 -4.121 5.887 926 HD1 TYR 117 HD1 TYR 117 108.276 -5.784 2.656 927 HD2 TYR 117 HD2 TYR 117 106.841 -2.263 4.626 928 HE1 TYR 117 HE1 TYR 117 107.894 -4.717 0.452 929 HE2 TYR 117 HE2 TYR 117 106.458 -1.180 2.428 930 HH TYR 117 HH TYR 117 106.636 -1.377 0.200 931 H VAL 118 H VAL 118 109.305 -4.702 7.772 932 HA VAL 118 HA VAL 118 109.508 -7.672 8.316 933 HB VAL 118 HB VAL 118 110.628 -5.513 10.132 934 HG11 VAL 118 HG11 VAL 118 111.502 -7.275 11.368 935 HG12 VAL 118 HG12 VAL 118 111.588 -8.360 9.959 936 HG13 VAL 118 HG13 VAL 118 110.022 -8.042 10.743 937 HG21 VAL 118 HG21 VAL 118 111.808 -5.392 7.959 938 HG22 VAL 118 HG22 VAL 118 112.860 -6.064 9.228 939 HG23 VAL 118 HG23 VAL 118 112.111 -7.144 8.028 940 H TYR 119 H TYR 119 108.276 -8.398 10.058 941 HA TYR 119 HA TYR 119 106.624 -6.326 11.452 942 HB2 TYR 119 HB2 TYR 119 105.591 -7.516 9.226 943 HB3 TYR 119 HB3 TYR 119 105.075 -8.671 10.478 944 HD1 TYR 119 HD1 TYR 119 103.853 -7.795 12.508 945 HD2 TYR 119 HD2 TYR 119 104.530 -5.395 9.016 946 HE1 TYR 119 HE1 TYR 119 102.047 -6.252 13.221 947 HE2 TYR 119 HE2 TYR 119 102.731 -3.844 9.730 948 HH TYR 119 HH TYR 119 100.690 -3.906 11.173 949 H GLU 120 H GLU 120 107.075 -6.740 13.493 950 HA GLU 120 HA GLU 120 107.449 -7.934 15.487 951 HB2 GLU 120 HB2 GLU 120 105.217 -9.589 14.242 952 HB3 GLU 120 HB3 GLU 120 105.729 -9.698 15.943 953 HG2 GLU 120 HG2 GLU 120 104.827 -7.111 14.609 954 HG3 GLU 120 HG3 GLU 120 103.745 -8.170 15.544 955 H GLY 121 H GLY 121 108.843 -8.910 12.904 956 HA2 GLY 121 HA2 GLY 121 110.772 -10.478 13.233 957 HA3 GLY 121 HA3 GLY 121 109.666 -11.558 14.116 958 H VAL 122 H VAL 122 108.626 -9.842 11.247 959 HA VAL 122 HA VAL 122 108.810 -12.446 9.733 960 HB VAL 122 HB VAL 122 106.449 -11.352 10.491 961 HG11 VAL 122 HG11 VAL 122 106.813 -10.240 7.694 962 HG12 VAL 122 HG12 VAL 122 105.527 -9.893 8.874 963 HG13 VAL 122 HG13 VAL 122 107.167 -9.251 9.131 964 HG21 VAL 122 HG21 VAL 122 105.459 -12.557 8.566 965 HG22 VAL 122 HG22 VAL 122 106.785 -13.489 9.301 966 HG23 VAL 122 HG23 VAL 122 107.056 -12.606 7.780 967 H GLU 123 H GLU 123 108.519 -11.809 7.256 968 HA GLU 123 HA GLU 123 109.748 -9.164 6.716 969 HB2 GLU 123 HB3 GLU 123 111.338 -11.639 6.872 970 HB3 GLU 123 HB2 GLU 123 111.512 -10.797 5.314 971 HG2 GLU 123 HG2 GLU 123 111.964 -8.668 6.575 972 HG3 GLU 123 HG3 GLU 123 111.928 -9.602 8.090 973 H ALA 124 H ALA 124 108.900 -8.410 4.881 974 HA ALA 124 HA ALA 124 108.012 -10.432 2.807 975 HB1 ALA 124 HB1 ALA 124 106.687 -7.973 2.329 976 HB2 ALA 124 HB2 ALA 124 105.969 -9.470 2.968 977 HB3 ALA 124 HB3 ALA 124 106.589 -8.233 4.087 978 H LYS 125 H LYS 125 108.373 -9.762 0.548 979 HA LYS 125 HA LYS 125 110.346 -7.478 0.351 980 HB2 LYS 125 HB3 LYS 125 111.379 -9.845 0.295 981 HB3 LYS 125 HB2 LYS 125 110.583 -10.022 -1.287 982 HG2 LYS 125 HG2 LYS 125 111.925 -8.411 -2.298 983 HG3 LYS 125 HG3 LYS 125 112.206 -7.536 -0.775 984 HD2 LYS 125 HD2 LYS 125 114.282 -8.624 -1.338 985 HD3 LYS 125 HD3 LYS 125 113.567 -9.557 -0.002 986 HE2 LYS 125 HE3 LYS 125 112.496 -11.027 -1.850 987 HE3 LYS 125 HE2 LYS 125 113.650 -10.248 -2.959 988 HZ1 LYS 125 HZ1 LYS 125 114.540 -12.281 -2.032 989 HZ2 LYS 125 HZ2 LYS 125 114.360 -11.711 -0.495 990 HZ3 LYS 125 HZ3 LYS 125 115.430 -10.989 -1.523 991 H ARG 126 H ARG 126 110.122 -6.155 -1.391 992 HA ARG 126 HA ARG 126 108.203 -7.002 -3.563 993 HB2 ARG 126 HB2 ARG 126 108.073 -4.564 -1.778 994 HB3 ARG 126 HB3 ARG 126 107.494 -4.455 -3.458 995 HG2 ARG 126 HG2 ARG 126 106.043 -6.469 -3.025 996 HG3 ARG 126 HG3 ARG 126 106.541 -6.408 -1.317 997 HD2 ARG 126 HD2 ARG 126 105.468 -3.898 -2.591 998 HD3 ARG 126 HD3 ARG 126 104.319 -5.181 -2.142 999 HE ARG 126 HE ARG 126 106.119 -4.686 0.076 1000 HH11 ARG 126 HH11 ARG 126 105.302 -3.480 1.805 1001 HH12 ARG 126 HH12 ARG 126 103.886 -2.478 1.582 1002 HH21 ARG 126 HH21 ARG 126 103.501 -3.324 -1.773 1003 HH22 ARG 126 HH22 ARG 126 102.871 -2.390 -0.435 1004 H ILE 127 H ILE 127 109.439 -6.931 -5.403 1005 HA ILE 127 HA ILE 127 111.568 -4.782 -5.515 1006 HB ILE 127 HB ILE 127 111.387 -7.328 -7.173 1007 HG12 ILE 127 HG13 ILE 127 113.447 -7.082 -5.036 1008 HG13 ILE 127 HG12 ILE 127 111.777 -7.302 -4.460 1009 HG21 ILE 127 HG21 ILE 127 113.779 -6.840 -7.609 1010 HG22 ILE 127 HG22 ILE 127 112.739 -5.499 -8.145 1011 HG23 ILE 127 HG23 ILE 127 113.655 -5.362 -6.624 1012 HD11 ILE 127 HD11 ILE 127 112.897 -9.489 -4.801 1013 HD12 ILE 127 HD12 ILE 127 111.533 -9.287 -5.927 1014 HD13 ILE 127 HD13 ILE 127 113.203 -9.067 -6.503 1015 H PHE 128 H PHE 128 111.206 -3.142 -6.882 1016 HA PHE 128 HA PHE 128 109.131 -3.508 -9.032 1017 HB2 PHE 128 HB2 PHE 128 110.540 -0.951 -8.142 1018 HB3 PHE 128 HB3 PHE 128 109.088 -1.076 -9.160 1019 HD1 PHE 128 HD1 PHE 128 108.163 -3.543 -7.309 1020 HD2 PHE 128 HD2 PHE 128 109.195 0.558 -6.628 1021 HE1 PHE 128 HE1 PHE 128 106.715 -3.520 -5.298 1022 HE2 PHE 128 HE2 PHE 128 107.755 0.589 -4.607 1023 HZ PHE 128 HZ PHE 128 106.511 -1.453 -3.943 1024 H LYS 129 H LYS 129 109.671 -2.258 -11.119 1025 HA LYS 129 HA LYS 129 112.573 -2.155 -11.788 1026 HB2 LYS 129 HB2 LYS 129 111.752 -4.580 -12.113 1027 HB3 LYS 129 HB3 LYS 129 110.740 -3.943 -13.431 1028 HG2 LYS 129 HG3 LYS 129 112.676 -3.145 -14.638 1029 HG3 LYS 129 HG2 LYS 129 113.745 -3.472 -13.253 1030 HD2 LYS 129 HD3 LYS 129 114.117 -5.335 -14.650 1031 HD3 LYS 129 HD2 LYS 129 112.905 -5.942 -13.497 1032 HE2 LYS 129 HE2 LYS 129 112.309 -6.527 -15.840 1033 HE3 LYS 129 HE3 LYS 129 111.101 -5.443 -15.110 1034 HZ1 LYS 129 HZ1 LYS 129 112.133 -4.954 -17.443 1035 HZ2 LYS 129 HZ2 LYS 129 111.769 -3.725 -16.405 1036 HZ3 LYS 129 HZ3 LYS 129 113.327 -4.247 -16.551 1037 H LYS 130 H LYS 130 112.902 -1.185 -13.952 1038 HA LYS 130 HA LYS 130 111.156 1.041 -14.426 1039 HB2 LYS 130 HB2 LYS 130 112.331 1.069 -16.726 1040 HB3 LYS 130 HB3 LYS 130 113.378 1.175 -15.290 1041 HG2 LYS 130 HG2 LYS 130 113.852 -1.230 -15.415 1042 HG3 LYS 130 HG3 LYS 130 112.725 -1.406 -16.782 1043 HD2 LYS 130 HD2 LYS 130 114.121 0.088 -18.155 1044 HD3 LYS 130 HD3 LYS 130 115.226 0.344 -16.783 1045 HE2 LYS 130 HE2 LYS 130 116.105 -1.815 -16.914 1046 HE3 LYS 130 HE3 LYS 130 114.642 -2.476 -17.682 1047 HZ1 LYS 130 HZ1 LYS 130 116.454 -2.267 -19.250 1048 HZ2 LYS 130 HZ2 LYS 130 116.574 -0.648 -18.962 1049 HZ3 LYS 130 HZ3 LYS 130 115.219 -1.260 -19.675 1050 H ASP 131 H ASP 131 109.300 1.278 -15.610 1051 HA ASP 131 HA ASP 131 107.926 -1.139 -16.532 1052 HB2 ASP 131 HB2 ASP 131 106.709 0.835 -15.644 1053 HB3 ASP 131 HB3 ASP 131 107.281 1.803 -17.024 Start of MODEL 8 1 H1 ALA 1 H1 ALA 1 116.600 9.725 -6.634 2 H2 ALA 1 H2 ALA 1 116.477 8.773 -5.292 3 H3 ALA 1 H3 ALA 1 117.944 9.379 -5.742 4 HA ALA 1 HA ALA 1 117.937 8.074 -7.761 5 HB1 ALA 1 HB1 ALA 1 118.881 7.174 -5.586 6 HB2 ALA 1 HB2 ALA 1 118.319 5.918 -6.714 7 HB3 ALA 1 HB3 ALA 1 117.318 6.367 -5.312 8 H PHE 2 H PHE 2 116.866 5.638 -8.199 9 HA PHE 2 HA PHE 2 114.956 4.781 -9.330 10 HB2 PHE 2 HB2 PHE 2 114.636 4.619 -6.635 11 HB3 PHE 2 HB3 PHE 2 113.219 5.615 -7.041 12 HD1 PHE 2 HD1 PHE 2 114.979 2.743 -8.757 13 HD2 PHE 2 HD2 PHE 2 111.306 4.328 -7.186 14 HE1 PHE 2 HE1 PHE 2 113.764 0.736 -9.565 15 HE2 PHE 2 HE2 PHE 2 110.098 2.317 -7.986 16 HZ PHE 2 HZ PHE 2 111.326 0.526 -9.175 17 H ASP 3 H ASP 3 115.524 7.516 -9.983 18 HA ASP 3 HA ASP 3 112.980 9.016 -9.868 19 HB2 ASP 3 HB2 ASP 3 115.287 9.575 -11.759 20 HB3 ASP 3 HB3 ASP 3 114.138 10.727 -11.039 21 H SER 4 H SER 4 111.367 7.809 -10.914 22 HA SER 4 HA SER 4 110.871 8.108 -13.624 23 HB2 SER 4 HB3 SER 4 112.679 7.035 -14.568 24 HB3 SER 4 HB2 SER 4 112.925 5.981 -13.155 25 HG SER 4 HG SER 4 112.076 4.883 -15.053 26 H THR 5 H THR 5 109.758 5.773 -14.525 27 HA THR 5 HA THR 5 107.720 5.256 -12.381 28 HB THR 5 HB THR 5 107.756 4.621 -15.365 29 HG1 THR 5 HG1 THR 5 106.126 6.269 -15.347 30 HG21 THR 5 HG21 THR 5 105.231 4.229 -14.824 31 HG22 THR 5 HG22 THR 5 106.389 2.941 -14.417 32 HG23 THR 5 HG23 THR 5 105.781 4.025 -13.143 33 H TRP 6 H TRP 6 107.138 3.096 -11.785 34 HA TRP 6 HA TRP 6 108.863 0.887 -12.817 35 HB2 TRP 6 HB2 TRP 6 108.757 1.451 -9.835 36 HB3 TRP 6 HB3 TRP 6 109.807 0.305 -10.702 37 HD1 TRP 6 HD1 TRP 6 109.209 4.112 -10.386 38 HE1 TRP 6 HE1 TRP 6 111.421 5.350 -10.866 39 HE3 TRP 6 HE3 TRP 6 112.100 0.121 -11.702 40 HZ2 TRP 6 HZ2 TRP 6 114.096 4.671 -11.716 41 HZ3 TRP 6 HZ3 TRP 6 114.471 0.437 -12.339 42 HH2 TRP 6 HH2 TRP 6 115.474 2.706 -12.349 43 H LYS 7 H LYS 7 108.170 -1.252 -11.723 44 HA LYS 7 HA LYS 7 105.402 -1.166 -10.612 45 HB2 LYS 7 HB2 LYS 7 104.340 -2.325 -12.370 46 HB3 LYS 7 HB3 LYS 7 105.376 -1.168 -13.238 47 HG2 LYS 7 HG2 LYS 7 107.160 -3.025 -13.272 48 HG3 LYS 7 HG3 LYS 7 105.866 -4.131 -12.752 49 HD2 LYS 7 HD3 LYS 7 104.507 -3.280 -14.744 50 HD3 LYS 7 HD2 LYS 7 105.994 -2.478 -15.306 51 HE2 LYS 7 HE2 LYS 7 105.494 -5.454 -14.920 52 HE3 LYS 7 HE3 LYS 7 105.954 -4.600 -16.413 53 HZ1 LYS 7 HZ1 LYS 7 107.941 -5.437 -15.690 54 HZ2 LYS 7 HZ2 LYS 7 107.599 -5.253 -14.087 55 HZ3 LYS 7 HZ3 LYS 7 107.991 -3.938 -15.003 56 H VAL 8 H VAL 8 105.321 -2.697 -9.030 57 HA VAL 8 HA VAL 8 107.384 -4.365 -8.243 58 HB VAL 8 HB VAL 8 105.610 -4.486 -6.769 59 HG11 VAL 8 HG11 VAL 8 103.225 -4.997 -7.638 60 HG12 VAL 8 HG12 VAL 8 103.909 -3.400 -8.022 61 HG13 VAL 8 HG13 VAL 8 103.887 -4.680 -9.259 62 HG21 VAL 8 HG21 VAL 8 104.837 -6.735 -6.647 63 HG22 VAL 8 HG22 VAL 8 104.857 -6.924 -8.417 64 HG23 VAL 8 HG23 VAL 8 106.388 -6.840 -7.514 65 H ASP 9 H ASP 9 108.625 -5.532 -9.600 66 HA ASP 9 HA ASP 9 107.284 -7.162 -11.732 67 HB2 ASP 9 HB2 ASP 9 109.289 -5.797 -12.323 68 HB3 ASP 9 HB3 ASP 9 110.244 -6.711 -11.131 69 H ARG 10 H ARG 10 109.015 -7.421 -8.668 70 HA ARG 10 HA ARG 10 108.222 -10.307 -8.608 71 HB2 ARG 10 HB3 ARG 10 111.067 -9.562 -7.875 72 HB3 ARG 10 HB2 ARG 10 110.385 -11.172 -8.205 73 HG2 ARG 10 HG2 ARG 10 110.006 -10.487 -10.582 74 HG3 ARG 10 HG3 ARG 10 110.787 -8.927 -10.232 75 HD2 ARG 10 HD2 ARG 10 112.535 -10.957 -9.249 76 HD3 ARG 10 HD3 ARG 10 112.020 -11.469 -10.874 77 HE ARG 10 HE ARG 10 113.700 -9.115 -10.226 78 HH11 ARG 10 HH11 ARG 10 114.449 -7.993 -12.040 79 HH12 ARG 10 HH12 ARG 10 113.746 -8.303 -13.612 80 HH21 ARG 10 HH21 ARG 10 111.511 -10.694 -12.427 81 HH22 ARG 10 HH22 ARG 10 112.090 -9.825 -13.830 82 H SER 11 H SER 11 108.484 -11.234 -6.392 83 HA SER 11 HA SER 11 108.999 -9.386 -4.157 84 HB2 SER 11 HB2 SER 11 106.882 -8.776 -3.560 85 HB3 SER 11 HB3 SER 11 106.481 -9.127 -5.258 86 HG SER 11 HG SER 11 105.092 -10.313 -3.934 87 H GLU 12 H GLU 12 108.091 -10.591 -2.021 88 HA GLU 12 HA GLU 12 108.023 -13.542 -2.389 89 HB2 GLU 12 HB2 GLU 12 110.103 -14.071 -1.583 90 HB3 GLU 12 HB3 GLU 12 110.518 -12.464 -2.223 91 HG2 GLU 12 HG2 GLU 12 109.841 -11.550 0.096 92 HG3 GLU 12 HG3 GLU 12 109.877 -13.243 0.646 93 H ASN 13 H ASN 13 107.551 -14.670 -0.365 94 HA ASN 13 HA ASN 13 106.334 -14.864 1.643 95 HB2 ASN 13 HB2 ASN 13 107.980 -12.372 2.049 96 HB3 ASN 13 HB3 ASN 13 106.720 -12.769 3.241 97 HD21 ASN 13 HD21 ASN 13 108.449 -13.234 4.847 98 HD22 ASN 13 HD22 ASN 13 109.340 -14.736 4.747 99 H TYR 14 H TYR 14 105.868 -11.564 2.364 100 HA TYR 14 HA TYR 14 104.013 -10.125 2.036 101 HB2 TYR 14 HB2 TYR 14 104.254 -11.344 -0.414 102 HB3 TYR 14 HB3 TYR 14 102.622 -11.866 0.065 103 HD1 TYR 14 HD1 TYR 14 104.459 -8.682 0.836 104 HD2 TYR 14 HD2 TYR 14 101.145 -10.531 -1.176 105 HE1 TYR 14 HE1 TYR 14 103.571 -6.445 0.241 106 HE2 TYR 14 HE2 TYR 14 100.255 -8.294 -1.768 107 HH TYR 14 HH TYR 14 100.875 -5.619 -0.388 108 H ASP 15 H ASP 15 103.004 -13.576 1.663 109 HA ASP 15 HA ASP 15 100.498 -13.201 3.037 110 HB2 ASP 15 HB3 ASP 15 102.091 -15.766 3.261 111 HB3 ASP 15 HB2 ASP 15 100.334 -15.549 3.075 112 H LYS 16 H LYS 16 103.759 -14.085 4.207 113 HA LYS 16 HA LYS 16 102.963 -14.397 6.977 114 HB2 LYS 16 HB3 LYS 16 105.669 -13.275 6.277 115 HB3 LYS 16 HB2 LYS 16 105.240 -14.566 7.425 116 HG2 LYS 16 HG2 LYS 16 104.493 -15.877 5.272 117 HG3 LYS 16 HG3 LYS 16 105.525 -14.707 4.415 118 HD2 LYS 16 HD3 LYS 16 107.076 -16.385 4.882 119 HD3 LYS 16 HD2 LYS 16 107.272 -15.351 6.317 120 HE2 LYS 16 HE2 LYS 16 107.018 -17.469 7.290 121 HE3 LYS 16 HE3 LYS 16 105.346 -16.858 7.315 122 HZ1 LYS 16 HZ1 LYS 16 105.465 -19.087 6.421 123 HZ2 LYS 16 HZ2 LYS 16 106.503 -18.604 5.234 124 HZ3 LYS 16 HZ3 LYS 16 104.954 -18.038 5.257 125 H PHE 17 H PHE 17 103.781 -11.631 4.943 126 HA PHE 17 HA PHE 17 103.928 -9.698 7.146 127 HB2 PHE 17 HB2 PHE 17 104.717 -9.580 4.607 128 HB3 PHE 17 HB3 PHE 17 103.063 -8.982 4.342 129 HD1 PHE 17 HD1 PHE 17 105.830 -8.496 6.837 130 HD2 PHE 17 HD2 PHE 17 102.809 -6.675 4.392 131 HE1 PHE 17 HE1 PHE 17 106.535 -6.257 7.637 132 HE2 PHE 17 HE2 PHE 17 103.505 -4.433 5.199 133 HZ PHE 17 HZ PHE 17 105.372 -4.226 6.818 134 H MET 18 H MET 18 101.550 -10.104 4.520 135 HA MET 18 HA MET 18 99.484 -8.554 5.758 136 HB2 MET 18 HB2 MET 18 99.554 -10.713 3.654 137 HB3 MET 18 HB3 MET 18 97.980 -10.182 4.292 138 HG2 MET 18 HG3 MET 18 98.673 -8.883 2.270 139 HG3 MET 18 HG2 MET 18 98.497 -7.851 3.710 140 HE1 MET 18 HE1 MET 18 99.910 -5.933 2.613 141 HE2 MET 18 HE2 MET 18 99.925 -6.964 1.162 142 HE3 MET 18 HE3 MET 18 101.435 -6.223 1.742 143 H GLU 19 H GLU 19 100.635 -11.775 6.466 144 HA GLU 19 HA GLU 19 98.127 -12.600 7.802 145 HB2 GLU 19 HB2 GLU 19 99.521 -14.358 6.919 146 HB3 GLU 19 HB3 GLU 19 100.955 -13.731 7.766 147 HG2 GLU 19 HG2 GLU 19 98.503 -14.492 9.357 148 HG3 GLU 19 HG3 GLU 19 99.608 -15.766 8.788 149 H LYS 20 H LYS 20 101.258 -11.194 8.737 150 HA LYS 20 HA LYS 20 100.807 -11.442 11.602 151 HB2 LYS 20 HB2 LYS 20 102.535 -9.565 9.939 152 HB3 LYS 20 HB3 LYS 20 102.538 -9.574 11.719 153 HG2 LYS 20 HG2 LYS 20 102.894 -12.176 10.231 154 HG3 LYS 20 HG3 LYS 20 104.275 -11.064 10.377 155 HD2 LYS 20 HD2 LYS 20 103.891 -11.008 12.866 156 HD3 LYS 20 HD3 LYS 20 102.631 -12.248 12.658 157 HE2 LYS 20 HE2 LYS 20 104.554 -13.529 11.348 158 HE3 LYS 20 HE3 LYS 20 105.619 -12.477 12.310 159 HZ1 LYS 20 HZ1 LYS 20 105.143 -14.541 13.448 160 HZ2 LYS 20 HZ2 LYS 20 103.521 -14.248 13.396 161 HZ3 LYS 20 HZ3 LYS 20 104.507 -13.272 14.289 162 H MET 21 H MET 21 100.100 -8.889 9.201 163 HA MET 21 HA MET 21 99.082 -7.006 11.178 164 HB2 MET 21 HB2 MET 21 99.419 -7.123 8.316 165 HB3 MET 21 HB3 MET 21 97.742 -6.639 8.665 166 HG2 MET 21 HG2 MET 21 98.678 -4.930 10.298 167 HG3 MET 21 HG3 MET 21 100.299 -5.324 9.676 168 HE1 MET 21 HE1 MET 21 100.651 -3.777 6.364 169 HE2 MET 21 HE2 MET 21 100.737 -5.436 7.003 170 HE3 MET 21 HE3 MET 21 101.370 -4.078 7.964 171 H GLY 22 H GLY 22 97.942 -10.017 10.188 172 HA2 GLY 22 HA3 GLY 22 95.895 -11.094 10.711 173 HA3 GLY 22 HA2 GLY 22 95.419 -9.640 11.621 174 H VAL 23 H VAL 23 96.402 -9.599 8.219 175 HA VAL 23 HA VAL 23 93.926 -8.208 7.490 176 HB VAL 23 HB VAL 23 95.979 -9.505 5.648 177 HG11 VAL 23 HG11 VAL 23 93.867 -8.772 4.577 178 HG12 VAL 23 HG12 VAL 23 95.227 -7.735 4.085 179 HG13 VAL 23 HG13 VAL 23 94.062 -7.157 5.300 180 HG21 VAL 23 HG21 VAL 23 97.102 -7.293 5.674 181 HG22 VAL 23 HG22 VAL 23 95.937 -6.717 6.889 182 HG23 VAL 23 HG23 VAL 23 97.080 -8.018 7.299 183 H ASN 24 H ASN 24 92.019 -9.099 6.858 184 HA ASN 24 HA ASN 24 91.308 -11.778 7.123 185 HB2 ASN 24 HB2 ASN 24 90.351 -9.874 4.937 186 HB3 ASN 24 HB3 ASN 24 89.514 -11.362 5.441 187 HD21 ASN 24 HD21 ASN 24 87.899 -11.019 6.962 188 HD22 ASN 24 HD22 ASN 24 87.877 -9.699 8.111 189 H ILE 25 H ILE 25 91.065 -13.570 5.600 190 HA ILE 25 HA ILE 25 93.450 -13.835 3.888 191 HB ILE 25 HB ILE 25 91.139 -15.586 4.698 192 HG12 ILE 25 HG13 ILE 25 93.462 -15.283 5.866 193 HG13 ILE 25 HG12 ILE 25 92.836 -16.931 5.628 194 HG21 ILE 25 HG21 ILE 25 92.059 -17.347 3.115 195 HG22 ILE 25 HG22 ILE 25 91.197 -16.008 2.320 196 HG23 ILE 25 HG23 ILE 25 92.977 -16.049 2.315 197 HD11 ILE 25 HD11 ILE 25 95.319 -16.408 4.953 198 HD12 ILE 25 HD12 ILE 25 94.312 -17.373 3.847 199 HD13 ILE 25 HD13 ILE 25 94.589 -15.646 3.520 200 H VAL 26 H VAL 26 90.586 -12.307 3.504 201 HA VAL 26 HA VAL 26 90.054 -13.080 0.693 202 HB VAL 26 HB VAL 26 89.003 -10.704 2.293 203 HG11 VAL 26 HG11 VAL 26 88.712 -10.537 -0.165 204 HG12 VAL 26 HG12 VAL 26 87.151 -10.801 0.646 205 HG13 VAL 26 HG13 VAL 26 87.961 -12.150 -0.185 206 HG21 VAL 26 HG21 VAL 26 87.043 -12.158 2.741 207 HG22 VAL 26 HG22 VAL 26 88.530 -12.859 3.423 208 HG23 VAL 26 HG23 VAL 26 87.854 -13.506 1.909 209 H LYS 27 H LYS 27 90.999 -9.996 2.296 210 HA LYS 27 HA LYS 27 91.827 -8.740 -0.175 211 HB2 LYS 27 HB3 LYS 27 92.340 -8.259 2.762 212 HB3 LYS 27 HB2 LYS 27 93.315 -7.379 1.560 213 HG2 LYS 27 HG2 LYS 27 91.338 -6.046 2.129 214 HG3 LYS 27 HG3 LYS 27 91.190 -6.628 0.453 215 HD2 LYS 27 HD3 LYS 27 89.726 -8.458 1.182 216 HD3 LYS 27 HD2 LYS 27 89.935 -7.979 2.883 217 HE2 LYS 27 HE2 LYS 27 87.904 -6.939 2.341 218 HE3 LYS 27 HE3 LYS 27 89.073 -5.632 2.035 219 HZ1 LYS 27 HZ1 LYS 27 87.541 -5.903 0.200 220 HZ2 LYS 27 HZ2 LYS 27 87.991 -7.477 -0.001 221 HZ3 LYS 27 HZ3 LYS 27 89.075 -6.267 -0.285 222 H ARG 28 H ARG 28 93.429 -10.909 2.103 223 HA ARG 28 HA ARG 28 96.126 -10.486 1.072 224 HB2 ARG 28 HB2 ARG 28 95.632 -11.541 3.283 225 HB3 ARG 28 HB3 ARG 28 94.931 -12.941 2.438 226 HG2 ARG 28 HG2 ARG 28 97.462 -12.524 1.235 227 HG3 ARG 28 HG3 ARG 28 97.732 -12.332 2.983 228 HD2 ARG 28 HD3 ARG 28 98.002 -14.681 2.472 229 HD3 ARG 28 HD2 ARG 28 96.445 -14.504 3.316 230 HE ARG 28 HE ARG 28 95.688 -14.303 0.660 231 HH11 ARG 28 HH11 ARG 28 95.236 -16.094 -0.642 232 HH12 ARG 28 HH12 ARG 28 95.965 -17.643 -0.283 233 HH21 ARG 28 HH21 ARG 28 97.711 -16.467 2.490 234 HH22 ARG 28 HH22 ARG 28 97.360 -17.853 1.482 235 H LYS 29 H LYS 29 93.540 -12.876 0.364 236 HA LYS 29 HA LYS 29 95.092 -14.386 -1.553 237 HB2 LYS 29 HB2 LYS 29 93.008 -15.283 -0.668 238 HB3 LYS 29 HB3 LYS 29 92.088 -13.909 -1.325 239 HG2 LYS 29 HG3 LYS 29 92.466 -14.607 -3.583 240 HG3 LYS 29 HG2 LYS 29 93.734 -15.756 -3.094 241 HD2 LYS 29 HD2 LYS 29 92.101 -17.174 -1.978 242 HD3 LYS 29 HD3 LYS 29 90.814 -15.975 -2.245 243 HE2 LYS 29 HE2 LYS 29 92.368 -17.192 -4.553 244 HE3 LYS 29 HE3 LYS 29 90.918 -17.977 -3.883 245 HZ1 LYS 29 HZ1 LYS 29 90.373 -16.512 -5.711 246 HZ2 LYS 29 HZ2 LYS 29 89.701 -15.948 -4.314 247 HZ3 LYS 29 HZ3 LYS 29 91.045 -15.221 -4.935 248 H LEU 30 H LEU 30 93.172 -11.412 -1.814 249 HA LEU 30 HA LEU 30 93.525 -11.376 -4.770 250 HB2 LEU 30 HB2 LEU 30 92.167 -9.559 -2.762 251 HB3 LEU 30 HB3 LEU 30 92.449 -9.027 -4.437 252 HG LEU 30 HG LEU 30 91.209 -11.734 -3.944 253 HD11 LEU 30 HD11 LEU 30 89.915 -10.163 -2.526 254 HD12 LEU 30 HD12 LEU 30 89.722 -9.067 -3.916 255 HD13 LEU 30 HD13 LEU 30 88.964 -10.678 -3.940 256 HD21 LEU 30 HD21 LEU 30 91.880 -11.031 -6.227 257 HD22 LEU 30 HD22 LEU 30 90.111 -11.185 -6.099 258 HD23 LEU 30 HD23 LEU 30 90.868 -9.574 -6.075 259 H ALA 31 H ALA 31 95.230 -10.463 -2.020 260 HA ALA 31 HA ALA 31 96.609 -8.138 -3.223 261 HB1 ALA 31 HB1 ALA 31 98.189 -8.639 -1.176 262 HB2 ALA 31 HB2 ALA 31 96.549 -8.016 -0.878 263 HB3 ALA 31 HB3 ALA 31 96.891 -9.751 -0.680 264 H ALA 32 H ALA 32 97.227 -11.617 -2.773 265 HA ALA 32 HA ALA 32 99.947 -11.831 -3.351 266 HB1 ALA 32 HB1 ALA 32 99.432 -13.957 -4.518 267 HB2 ALA 32 HB2 ALA 32 98.449 -13.782 -3.044 268 HB3 ALA 32 HB3 ALA 32 97.723 -13.476 -4.640 269 H HIS 33 H HIS 33 97.430 -10.624 -5.468 270 HA HIS 33 HA HIS 33 98.912 -10.935 -7.963 271 HB2 HIS 33 HB2 HIS 33 96.451 -9.582 -7.024 272 HB3 HIS 33 HB3 HIS 33 97.290 -8.711 -8.330 273 HD2 HIS 33 HD2 HIS 33 95.503 -12.196 -7.764 274 HE1 HIS 33 HE1 HIS 33 96.283 -11.749 -11.891 275 HE2 HIS 33 HE2 HIS 33 95.118 -13.213 -10.153 276 H ASP 34 H ASP 34 100.573 -9.927 -5.812 277 HA ASP 34 HA ASP 34 101.038 -7.185 -5.663 278 HB2 ASP 34 HB3 ASP 34 103.394 -7.688 -5.320 279 HB3 ASP 34 HB2 ASP 34 102.432 -9.003 -4.604 280 H ASN 35 H ASN 35 100.347 -6.135 -7.593 281 HA ASN 35 HA ASN 35 102.491 -6.051 -9.682 282 HB2 ASN 35 HB2 ASN 35 100.770 -7.741 -10.441 283 HB3 ASN 35 HB3 ASN 35 99.550 -6.446 -10.393 284 HD21 ASN 35 HD21 ASN 35 99.478 -4.965 -12.143 285 HD22 ASN 35 HD22 ASN 35 100.599 -5.019 -13.485 286 H LEU 36 H LEU 36 101.883 -4.182 -7.660 287 HA LEU 36 HA LEU 36 100.075 -2.142 -8.826 288 HB2 LEU 36 HB2 LEU 36 100.089 -1.232 -6.741 289 HB3 LEU 36 HB3 LEU 36 100.838 -2.770 -6.258 290 HG LEU 36 HG LEU 36 103.073 -1.486 -7.015 291 HD11 LEU 36 HD11 LEU 36 102.111 0.912 -5.736 292 HD12 LEU 36 HD12 LEU 36 101.061 0.560 -7.129 293 HD13 LEU 36 HD13 LEU 36 102.818 0.733 -7.360 294 HD21 LEU 36 HD21 LEU 36 103.362 -0.838 -4.636 295 HD22 LEU 36 HD22 LEU 36 101.610 -1.014 -4.377 296 HD23 LEU 36 HD23 LEU 36 102.598 -2.440 -4.776 297 H LYS 37 H LYS 37 100.803 0.072 -9.263 298 HA LYS 37 HA LYS 37 103.640 0.124 -10.327 299 HB2 LYS 37 HB2 LYS 37 101.015 0.925 -11.513 300 HB3 LYS 37 HB3 LYS 37 102.361 2.057 -11.778 301 HG2 LYS 37 HG3 LYS 37 103.681 -0.171 -12.395 302 HG3 LYS 37 HG2 LYS 37 102.043 -0.793 -12.705 303 HD2 LYS 37 HD2 LYS 37 103.232 1.744 -13.916 304 HD3 LYS 37 HD3 LYS 37 103.047 0.187 -14.759 305 HE2 LYS 37 HE2 LYS 37 100.779 1.851 -13.574 306 HE3 LYS 37 HE3 LYS 37 101.180 1.724 -15.304 307 HZ1 LYS 37 HZ1 LYS 37 99.423 0.203 -14.683 308 HZ2 LYS 37 HZ2 LYS 37 100.759 -0.639 -15.161 309 HZ3 LYS 37 HZ3 LYS 37 100.388 -0.521 -13.558 310 H LEU 38 H LEU 38 104.778 2.134 -10.073 311 HA LEU 38 HA LEU 38 103.406 4.311 -8.576 312 HB2 LEU 38 HB3 LEU 38 104.958 4.258 -6.682 313 HB3 LEU 38 HB2 LEU 38 104.123 2.692 -6.809 314 HG LEU 38 HG LEU 38 106.888 3.281 -7.954 315 HD11 LEU 38 HD11 LEU 38 106.528 3.214 -5.355 316 HD12 LEU 38 HD12 LEU 38 107.828 2.230 -6.068 317 HD13 LEU 38 HD13 LEU 38 106.287 1.468 -5.605 318 HD21 LEU 38 HD21 LEU 38 106.738 0.596 -7.792 319 HD22 LEU 38 HD22 LEU 38 105.003 0.944 -7.986 320 HD23 LEU 38 HD23 LEU 38 106.163 1.486 -9.223 321 H THR 39 H THR 39 104.564 6.286 -8.661 322 HA THR 39 HA THR 39 106.989 6.205 -10.478 323 HB THR 39 HB THR 39 104.930 8.437 -10.157 324 HG1 THR 39 HG1 THR 39 104.316 7.733 -12.279 325 HG21 THR 39 HG21 THR 39 106.076 9.387 -12.139 326 HG22 THR 39 HG22 THR 39 107.204 9.205 -10.775 327 HG23 THR 39 HG23 THR 39 107.235 8.036 -12.117 328 H ILE 40 H ILE 40 108.839 6.877 -9.483 329 HA ILE 40 HA ILE 40 108.488 8.503 -6.958 330 HB ILE 40 HB ILE 40 110.820 6.752 -7.844 331 HG12 ILE 40 HG12 ILE 40 109.979 5.449 -5.758 332 HG13 ILE 40 HG13 ILE 40 108.471 6.373 -5.958 333 HG21 ILE 40 HG21 ILE 40 111.503 8.667 -6.426 334 HG22 ILE 40 HG22 ILE 40 110.256 8.229 -5.234 335 HG23 ILE 40 HG23 ILE 40 111.628 7.135 -5.529 336 HD11 ILE 40 HD11 ILE 40 109.055 3.988 -7.237 337 HD12 ILE 40 HD12 ILE 40 109.491 5.194 -8.471 338 HD13 ILE 40 HD13 ILE 40 107.848 5.174 -7.789 339 H THR 41 H THR 41 109.288 10.508 -6.867 340 HA THR 41 HA THR 41 111.329 11.332 -8.934 341 HB THR 41 HB THR 41 109.207 13.251 -7.965 342 HG1 THR 41 HG1 THR 41 107.936 11.635 -8.770 343 HG21 THR 41 HG21 THR 41 109.644 14.256 -10.187 344 HG22 THR 41 HG22 THR 41 110.764 12.926 -10.568 345 HG23 THR 41 HG23 THR 41 111.152 14.069 -9.261 346 H GLN 42 H GLN 42 112.763 13.026 -8.169 347 HA GLN 42 HA GLN 42 112.689 13.294 -5.151 348 HB2 GLN 42 HB3 GLN 42 115.089 13.291 -5.140 349 HB3 GLN 42 HB2 GLN 42 114.602 11.942 -6.195 350 HG2 GLN 42 HG2 GLN 42 114.745 13.718 -8.119 351 HG3 GLN 42 HG3 GLN 42 115.725 14.649 -6.960 352 HE21 GLN 42 HE21 GLN 42 116.801 12.121 -5.681 353 HE22 GLN 42 HE22 GLN 42 117.970 11.506 -6.827 354 H GLU 43 H GLU 43 113.225 15.358 -4.260 355 HA GLU 43 HA GLU 43 113.710 17.577 -6.214 356 HB2 GLU 43 HB2 GLU 43 111.286 17.373 -4.382 357 HB3 GLU 43 HB3 GLU 43 111.847 18.914 -5.077 358 HG2 GLU 43 HG3 GLU 43 111.728 17.787 -7.367 359 HG3 GLU 43 HG2 GLU 43 110.889 16.436 -6.566 360 H GLY 44 H GLY 44 115.793 17.439 -5.036 361 HA2 GLY 44 HA3 GLY 44 117.240 18.473 -3.466 362 HA3 GLY 44 HA2 GLY 44 115.839 19.363 -2.825 363 H ASN 45 H ASN 45 114.684 18.508 -1.068 364 HA ASN 45 HA ASN 45 115.830 15.964 0.102 365 HB2 ASN 45 HB2 ASN 45 114.987 17.426 2.303 366 HB3 ASN 45 HB3 ASN 45 116.673 17.287 1.748 367 HD21 ASN 45 HD21 ASN 45 116.990 18.910 -0.357 368 HD22 ASN 45 HD22 ASN 45 116.457 20.543 -0.024 369 H LYS 46 H LYS 46 113.390 16.529 -1.540 370 HA LYS 46 HA LYS 46 111.506 15.187 0.332 371 HB2 LYS 46 HB2 LYS 46 109.710 16.729 0.017 372 HB3 LYS 46 HB3 LYS 46 111.120 17.730 0.439 373 HG2 LYS 46 HG2 LYS 46 111.494 17.826 -2.165 374 HG3 LYS 46 HG3 LYS 46 109.777 17.357 -2.244 375 HD2 LYS 46 HD3 LYS 46 109.260 19.266 -0.680 376 HD3 LYS 46 HD2 LYS 46 110.959 19.777 -0.824 377 HE2 LYS 46 HE2 LYS 46 109.180 19.361 -3.254 378 HE3 LYS 46 HE3 LYS 46 109.278 20.922 -2.405 379 HZ1 LYS 46 HZ1 LYS 46 111.392 21.231 -3.090 380 HZ2 LYS 46 HZ2 LYS 46 110.902 20.289 -4.352 381 HZ3 LYS 46 HZ3 LYS 46 111.775 19.627 -3.119 382 H PHE 47 H PHE 47 111.140 13.439 -0.766 383 HA PHE 47 HA PHE 47 111.200 13.432 -3.734 384 HB2 PHE 47 HB3 PHE 47 111.039 11.355 -1.553 385 HB3 PHE 47 HB2 PHE 47 110.536 10.920 -3.204 386 HD1 PHE 47 HD1 PHE 47 113.268 13.096 -1.800 387 HD2 PHE 47 HD2 PHE 47 112.231 9.767 -4.307 388 HE1 PHE 47 HE1 PHE 47 115.647 12.850 -2.456 389 HE2 PHE 47 HE2 PHE 47 114.609 9.521 -4.964 390 HZ PHE 47 HZ PHE 47 116.318 11.062 -4.040 391 H THR 48 H THR 48 109.387 12.032 -4.786 392 HA THR 48 HA THR 48 106.722 12.571 -3.524 393 HB THR 48 HB THR 48 107.381 13.358 -6.396 394 HG1 THR 48 HG1 THR 48 107.220 15.507 -5.544 395 HG21 THR 48 HG21 THR 48 105.166 14.463 -6.269 396 HG22 THR 48 HG22 THR 48 105.029 12.717 -5.952 397 HG23 THR 48 HG23 THR 48 104.969 13.874 -4.601 398 H VAL 49 H VAL 49 106.171 10.470 -3.350 399 HA VAL 49 HA VAL 49 106.658 8.653 -5.694 400 HB VAL 49 HB VAL 49 105.650 8.014 -2.886 401 HG11 VAL 49 HG11 VAL 49 106.262 5.693 -3.511 402 HG12 VAL 49 HG12 VAL 49 106.734 6.254 -5.132 403 HG13 VAL 49 HG13 VAL 49 105.033 6.350 -4.618 404 HG21 VAL 49 HG21 VAL 49 107.965 7.214 -2.490 405 HG22 VAL 49 HG22 VAL 49 107.944 8.953 -2.867 406 HG23 VAL 49 HG23 VAL 49 108.437 7.779 -4.111 407 H LYS 50 H LYS 50 105.029 8.776 -7.166 408 HA LYS 50 HA LYS 50 102.228 9.168 -6.163 409 HB2 LYS 50 HB2 LYS 50 103.496 10.232 -8.321 410 HB3 LYS 50 HB3 LYS 50 102.802 8.779 -9.078 411 HG2 LYS 50 HG3 LYS 50 101.081 10.538 -7.314 412 HG3 LYS 50 HG2 LYS 50 101.383 10.997 -9.007 413 HD2 LYS 50 HD2 LYS 50 100.536 8.168 -8.399 414 HD3 LYS 50 HD3 LYS 50 99.308 9.455 -8.373 415 HE2 LYS 50 HE3 LYS 50 99.999 10.140 -10.665 416 HE3 LYS 50 HE2 LYS 50 101.193 8.820 -10.688 417 HZ1 LYS 50 HZ1 LYS 50 99.468 7.243 -10.559 418 HZ2 LYS 50 HZ2 LYS 50 99.009 8.307 -11.732 419 HZ3 LYS 50 HZ3 LYS 50 98.315 8.377 -10.238 420 H GLU 51 H GLU 51 101.553 7.189 -5.332 421 HA GLU 51 HA GLU 51 102.262 4.649 -6.590 422 HB2 GLU 51 HB2 GLU 51 100.169 5.484 -4.550 423 HB3 GLU 51 HB3 GLU 51 100.295 3.809 -5.138 424 HG2 GLU 51 HG2 GLU 51 102.754 3.871 -4.491 425 HG3 GLU 51 HG3 GLU 51 102.436 5.435 -3.704 426 H SER 52 H SER 52 100.786 3.213 -7.741 427 HA SER 52 HA SER 52 98.238 4.321 -8.730 428 HB2 SER 52 HB2 SER 52 100.365 3.748 -10.818 429 HB3 SER 52 HB3 SER 52 98.809 4.589 -11.019 430 HG SER 52 HG SER 52 101.134 5.702 -10.538 431 H SER 53 H SER 53 97.129 2.543 -8.314 432 HA SER 53 HA SER 53 97.931 0.030 -9.739 433 HB2 SER 53 HB2 SER 53 96.819 -0.403 -7.022 434 HB3 SER 53 HB3 SER 53 98.154 -1.240 -7.851 435 HG SER 53 HG SER 53 98.235 1.277 -6.513 436 H ALA 54 H ALA 54 96.108 -1.185 -10.394 437 HA ALA 54 HA ALA 54 93.649 0.237 -10.748 438 HB1 ALA 54 HB1 ALA 54 92.678 -1.968 -11.337 439 HB2 ALA 54 HB2 ALA 54 94.286 -1.762 -12.074 440 HB3 ALA 54 HB3 ALA 54 94.094 -2.781 -10.626 441 H PHE 55 H PHE 55 94.923 -0.472 -7.860 442 HA PHE 55 HA PHE 55 92.299 -1.330 -6.643 443 HB2 PHE 55 HB2 PHE 55 94.547 -2.581 -6.217 444 HB3 PHE 55 HB3 PHE 55 94.948 -1.192 -5.179 445 HD1 PHE 55 HD1 PHE 55 93.531 -0.655 -3.208 446 HD2 PHE 55 HD2 PHE 55 92.861 -4.176 -5.575 447 HE1 PHE 55 HE1 PHE 55 92.136 -1.610 -1.393 448 HE2 PHE 55 HE2 PHE 55 91.464 -5.130 -3.763 449 HZ PHE 55 HZ PHE 55 91.102 -3.849 -1.670 450 H ARG 56 H ARG 56 94.621 1.335 -6.801 451 HA ARG 56 HA ARG 56 92.931 3.351 -5.917 452 HB2 ARG 56 HB2 ARG 56 93.684 1.588 -3.657 453 HB3 ARG 56 HB3 ARG 56 94.012 3.312 -3.363 454 HG2 ARG 56 HG3 ARG 56 91.771 3.892 -3.444 455 HG3 ARG 56 HG2 ARG 56 91.368 2.597 -4.596 456 HD2 ARG 56 HD2 ARG 56 90.382 2.063 -2.421 457 HD3 ARG 56 HD3 ARG 56 91.706 0.920 -2.753 458 HE ARG 56 HE ARG 56 92.861 3.090 -1.311 459 HH11 ARG 56 HH11 ARG 56 93.120 2.915 0.928 460 HH12 ARG 56 HH12 ARG 56 92.141 1.785 1.836 461 HH21 ARG 56 HH21 ARG 56 90.416 0.636 -0.961 462 HH22 ARG 56 HH22 ARG 56 90.617 0.501 0.771 463 H ASN 57 H ASN 57 94.450 4.353 -7.340 464 HA ASN 57 HA ASN 57 97.293 4.458 -6.828 465 HB2 ASN 57 HB2 ASN 57 97.312 6.341 -8.382 466 HB3 ASN 57 HB3 ASN 57 96.153 5.128 -8.980 467 HD21 ASN 57 HD21 ASN 57 96.519 8.444 -8.242 468 HD22 ASN 57 HD22 ASN 57 94.822 8.859 -8.158 469 H ILE 58 H ILE 58 98.556 6.012 -5.714 470 HA ILE 58 HA ILE 58 97.037 8.056 -4.119 471 HB ILE 58 HB ILE 58 99.160 6.426 -2.745 472 HG12 ILE 58 HG13 ILE 58 96.257 5.625 -3.172 473 HG13 ILE 58 HG12 ILE 58 97.718 4.676 -3.546 474 HG21 ILE 58 HG21 ILE 58 97.881 8.617 -1.936 475 HG22 ILE 58 HG22 ILE 58 98.210 7.289 -0.798 476 HG23 ILE 58 HG23 ILE 58 96.596 7.453 -1.531 477 HD11 ILE 58 HD11 ILE 58 97.109 3.759 -1.484 478 HD12 ILE 58 HD12 ILE 58 98.231 5.042 -0.968 479 HD13 ILE 58 HD13 ILE 58 96.473 5.304 -0.870 480 H GLU 59 H GLU 59 98.660 9.394 -2.824 481 HA GLU 59 HA GLU 59 101.260 9.716 -4.319 482 HB2 GLU 59 HB3 GLU 59 100.939 12.030 -4.652 483 HB3 GLU 59 HB2 GLU 59 99.329 11.362 -5.011 484 HG2 GLU 59 HG2 GLU 59 98.904 11.734 -2.435 485 HG3 GLU 59 HG3 GLU 59 100.269 12.869 -2.564 486 H CYS 60 H CYS 60 102.976 10.363 -2.964 487 HA CYS 60 HA CYS 60 102.332 11.183 -0.175 488 HB2 CYS 60 HB2 CYS 60 102.377 8.514 -0.567 489 HB3 CYS 60 HB3 CYS 60 104.126 8.786 -0.382 490 HG CYS 60 HG CYS 60 102.926 10.588 1.998 491 H VAL 61 H VAL 61 103.709 12.883 0.045 492 HA VAL 61 HA VAL 61 106.263 12.972 -1.419 493 HB VAL 61 HB VAL 61 105.781 14.737 0.961 494 HG11 VAL 61 HG11 VAL 61 106.562 16.451 -0.683 495 HG12 VAL 61 HG12 VAL 61 107.708 15.099 -0.525 496 HG13 VAL 61 HG13 VAL 61 106.627 15.188 -1.936 497 HG21 VAL 61 HG21 VAL 61 104.237 16.130 -0.581 498 HG22 VAL 61 HG22 VAL 61 104.031 14.632 -1.521 499 HG23 VAL 61 HG23 VAL 61 103.527 14.688 0.185 500 H PHE 62 H PHE 62 108.385 12.788 -0.445 501 HA PHE 62 HA PHE 62 108.320 11.527 2.300 502 HB2 PHE 62 HB2 PHE 62 108.699 9.611 1.054 503 HB3 PHE 62 HB3 PHE 62 109.505 10.495 -0.263 504 HD1 PHE 62 HD1 PHE 62 110.180 10.621 3.422 505 HD2 PHE 62 HD2 PHE 62 111.613 9.452 -0.455 506 HE1 PHE 62 HE1 PHE 62 112.390 10.073 4.403 507 HE2 PHE 62 HE2 PHE 62 113.822 8.901 0.528 508 HZ PHE 62 HZ PHE 62 114.211 9.214 2.957 509 H GLU 63 H GLU 63 109.524 12.651 3.674 510 HA GLU 63 HA GLU 63 111.983 14.055 2.598 511 HB2 GLU 63 HB2 GLU 63 110.176 15.658 3.245 512 HB3 GLU 63 HB3 GLU 63 110.143 14.939 4.873 513 HG2 GLU 63 HG3 GLU 63 112.673 15.478 4.966 514 HG3 GLU 63 HG2 GLU 63 112.379 16.513 3.548 515 H LEU 64 H LEU 64 113.877 13.691 3.809 516 HA LEU 64 HA LEU 64 113.531 11.679 6.028 517 HB2 LEU 64 HB3 LEU 64 115.988 11.259 5.676 518 HB3 LEU 64 HB2 LEU 64 114.993 10.919 4.241 519 HG LEU 64 HG LEU 64 116.079 13.700 4.518 520 HD11 LEU 64 HD11 LEU 64 118.015 12.286 5.155 521 HD12 LEU 64 HD12 LEU 64 118.252 13.006 3.545 522 HD13 LEU 64 HD13 LEU 64 117.773 11.298 3.695 523 HD21 LEU 64 HD21 LEU 64 114.649 13.006 2.612 524 HD22 LEU 64 HD22 LEU 64 116.288 13.426 2.061 525 HD23 LEU 64 HD23 LEU 64 115.809 11.718 2.211 526 H GLY 65 H GLY 65 114.573 11.974 8.040 527 HA2 GLY 65 HA2 GLY 65 115.987 13.249 9.572 528 HA3 GLY 65 HA3 GLY 65 115.883 14.647 8.477 529 H VAL 66 H VAL 66 112.796 13.542 8.522 530 HA VAL 66 HA VAL 66 112.090 14.822 11.146 531 HB VAL 66 HB VAL 66 110.980 15.739 8.456 532 HG11 VAL 66 HG11 VAL 66 109.306 15.753 10.284 533 HG12 VAL 66 HG12 VAL 66 109.770 17.410 9.828 534 HG13 VAL 66 HG13 VAL 66 110.433 16.675 11.308 535 HG21 VAL 66 HG21 VAL 66 112.081 17.891 9.048 536 HG22 VAL 66 HG22 VAL 66 112.766 17.129 10.504 537 HG23 VAL 66 HG23 VAL 66 113.266 16.573 8.889 538 H THR 67 H THR 67 110.725 13.409 12.113 539 HA THR 67 HA THR 67 109.508 11.168 10.901 540 HB THR 67 HB THR 67 108.019 12.683 13.047 541 HG1 THR 67 HG1 THR 67 110.090 12.873 13.782 542 HG21 THR 67 HG21 THR 67 107.729 10.379 13.924 543 HG22 THR 67 HG22 THR 67 107.173 10.499 12.237 544 HG23 THR 67 HG23 THR 67 108.746 9.751 12.605 545 H PHE 68 H PHE 68 107.587 10.746 9.973 546 HA PHE 68 HA PHE 68 105.513 12.798 9.647 547 HB2 PHE 68 HB2 PHE 68 105.654 13.238 7.354 548 HB3 PHE 68 HB3 PHE 68 107.362 13.278 7.846 549 HD1 PHE 68 HD1 PHE 68 107.654 10.253 8.225 550 HD2 PHE 68 HD2 PHE 68 106.006 12.618 5.053 551 HE1 PHE 68 HE1 PHE 68 108.228 8.469 6.601 552 HE2 PHE 68 HE2 PHE 68 106.550 10.823 3.430 553 HZ PHE 68 HZ PHE 68 107.667 8.751 4.203 554 H ASN 69 H ASN 69 104.125 11.605 7.529 555 HA ASN 69 HA ASN 69 104.060 8.705 8.269 556 HB2 ASN 69 HB2 ASN 69 101.626 8.820 8.773 557 HB3 ASN 69 HB3 ASN 69 102.594 9.776 9.920 558 HD21 ASN 69 HD21 ASN 69 102.812 11.550 7.145 559 HD22 ASN 69 HD22 ASN 69 101.417 12.587 7.344 560 H CYS 70 H CYS 70 102.762 7.422 6.901 561 HA CYS 70 HA CYS 70 101.674 8.698 4.427 562 HB2 CYS 70 HB2 CYS 70 104.158 8.116 4.069 563 HB3 CYS 70 HB3 CYS 70 103.677 6.411 4.249 564 HG CYS 70 HG CYS 70 102.468 6.128 1.890 565 H ASN 71 H ASN 71 99.882 7.536 3.721 566 HA ASN 71 HA ASN 71 99.223 5.146 5.413 567 HB2 ASN 71 HB2 ASN 71 96.956 5.505 4.055 568 HB3 ASN 71 HB3 ASN 71 97.363 6.535 5.449 569 HD21 ASN 71 HD21 ASN 71 96.613 8.594 4.860 570 HD22 ASN 71 HD22 ASN 71 97.027 9.390 3.358 571 H LEU 72 H LEU 72 98.623 3.148 4.512 572 HA LEU 72 HA LEU 72 99.703 2.744 1.728 573 HB2 LEU 72 HB2 LEU 72 98.998 0.704 3.885 574 HB3 LEU 72 HB3 LEU 72 99.795 0.357 2.331 575 HG LEU 72 HG LEU 72 100.968 2.382 4.258 576 HD11 LEU 72 HD11 LEU 72 101.421 -0.636 4.235 577 HD12 LEU 72 HD12 LEU 72 100.658 0.298 5.543 578 HD13 LEU 72 HD13 LEU 72 102.380 0.541 5.164 579 HD21 LEU 72 HD21 LEU 72 101.822 2.273 1.931 580 HD22 LEU 72 HD22 LEU 72 103.055 1.723 3.091 581 HD23 LEU 72 HD23 LEU 72 102.143 0.534 2.131 582 H ALA 73 H ALA 73 98.460 1.710 0.132 583 HA ALA 73 HA ALA 73 95.786 2.343 -0.202 584 HB1 ALA 73 HB1 ALA 73 95.590 0.377 -1.702 585 HB2 ALA 73 HB2 ALA 73 97.152 1.201 -1.924 586 HB3 ALA 73 HB3 ALA 73 97.068 -0.312 -0.990 587 H ASP 74 H ASP 74 97.063 -0.346 1.746 588 HA ASP 74 HA ASP 74 94.584 -1.714 2.202 589 HB2 ASP 74 HB2 ASP 74 97.097 -1.341 3.860 590 HB3 ASP 74 HB3 ASP 74 95.709 -2.260 4.492 591 H GLY 75 H GLY 75 95.006 1.473 2.594 592 HA2 GLY 75 HA2 GLY 75 93.715 3.071 3.772 593 HA3 GLY 75 HA3 GLY 75 92.721 1.732 4.397 594 H THR 76 H THR 76 96.197 1.644 4.808 595 HA THR 76 HA THR 76 95.739 1.966 7.761 596 HB THR 76 HB THR 76 98.434 1.192 6.845 597 HG1 THR 76 HG1 THR 76 97.265 0.172 5.203 598 HG21 THR 76 HG21 THR 76 98.063 -0.597 8.520 599 HG22 THR 76 HG22 THR 76 97.635 0.999 9.181 600 HG23 THR 76 HG23 THR 76 96.354 -0.118 8.653 601 H GLU 77 H GLU 77 97.385 3.173 8.984 602 HA GLU 77 HA GLU 77 98.745 5.305 7.337 603 HB2 GLU 77 HB2 GLU 77 96.601 6.187 8.291 604 HB3 GLU 77 HB3 GLU 77 97.190 5.777 9.920 605 HG2 GLU 77 HG3 GLU 77 98.998 7.345 9.763 606 HG3 GLU 77 HG2 GLU 77 98.754 7.559 8.013 607 H LEU 78 H LEU 78 100.900 5.400 7.866 608 HA LEU 78 HA LEU 78 101.620 4.557 10.686 609 HB2 LEU 78 HB2 LEU 78 103.412 3.944 8.325 610 HB3 LEU 78 HB3 LEU 78 103.401 3.205 9.944 611 HG LEU 78 HG LEU 78 100.882 2.582 9.171 612 HD11 LEU 78 HD11 LEU 78 101.483 3.764 6.919 613 HD12 LEU 78 HD12 LEU 78 100.683 2.176 6.850 614 HD13 LEU 78 HD13 LEU 78 102.438 2.300 6.584 615 HD21 LEU 78 HD21 LEU 78 101.789 0.364 8.529 616 HD22 LEU 78 HD22 LEU 78 102.632 1.011 9.957 617 HD23 LEU 78 HD23 LEU 78 103.410 1.077 8.358 618 H ARG 79 H ARG 79 103.709 5.423 11.445 619 HA ARG 79 HA ARG 79 104.664 7.795 9.853 620 HB2 ARG 79 HB2 ARG 79 104.425 9.325 11.632 621 HB3 ARG 79 HB3 ARG 79 102.910 8.394 11.681 622 HG2 ARG 79 HG2 ARG 79 103.972 6.892 13.413 623 HG3 ARG 79 HG3 ARG 79 105.369 7.995 13.439 624 HD2 ARG 79 HD2 ARG 79 102.478 8.714 14.098 625 HD3 ARG 79 HD3 ARG 79 103.826 8.586 15.253 626 HE ARG 79 HE ARG 79 104.260 10.521 13.038 627 HH11 ARG 79 HH11 ARG 79 104.477 12.660 13.735 628 HH12 ARG 79 HH12 ARG 79 104.055 13.092 15.377 629 HH21 ARG 79 HH21 ARG 79 103.127 9.854 16.262 630 HH22 ARG 79 HH22 ARG 79 103.294 11.510 16.802 631 H GLY 80 H GLY 80 106.816 8.471 10.359 632 HA2 GLY 80 HA2 GLY 80 108.559 7.629 12.346 633 HA3 GLY 80 HA3 GLY 80 108.549 6.255 11.206 634 H THR 81 H THR 81 109.896 6.421 9.451 635 HA THR 81 HA THR 81 110.174 8.665 7.776 636 HB THR 81 HB THR 81 112.688 9.146 8.923 637 HG1 THR 81 HG1 THR 81 112.388 9.305 11.056 638 HG21 THR 81 HG21 THR 81 111.497 10.927 7.919 639 HG22 THR 81 HG22 THR 81 111.495 11.340 9.650 640 HG23 THR 81 HG23 THR 81 110.044 10.629 8.903 641 H TRP 82 H TRP 82 111.767 8.430 6.185 642 HA TRP 82 HA TRP 82 113.208 5.775 6.299 643 HB2 TRP 82 HB3 TRP 82 112.407 7.498 3.907 644 HB3 TRP 82 HB2 TRP 82 113.267 5.943 3.816 645 HD1 TRP 82 HD1 TRP 82 110.010 7.229 5.510 646 HE1 TRP 82 HE1 TRP 82 108.168 5.451 5.207 647 HE3 TRP 82 HE3 TRP 82 112.691 3.703 2.968 648 HZ2 TRP 82 HZ2 TRP 82 107.910 2.839 4.012 649 HZ3 TRP 82 HZ3 TRP 82 111.624 1.582 2.259 650 HH2 TRP 82 HH2 TRP 82 109.239 1.146 2.775 651 H SER 83 H SER 83 115.442 5.838 6.328 652 HA SER 83 HA SER 83 116.765 8.350 5.342 653 HB2 SER 83 HB2 SER 83 116.705 7.363 8.180 654 HB3 SER 83 HB3 SER 83 118.234 8.038 7.566 655 HG SER 83 HG SER 83 116.844 9.661 8.469 656 H LEU 84 H LEU 84 119.083 8.026 4.929 657 HA LEU 84 HA LEU 84 119.597 5.172 4.251 658 HB2 LEU 84 HB2 LEU 84 120.582 6.219 2.502 659 HB3 LEU 84 HB3 LEU 84 120.516 7.793 3.327 660 HG LEU 84 HG LEU 84 122.545 7.099 4.661 661 HD11 LEU 84 HD11 LEU 84 123.433 5.069 2.768 662 HD12 LEU 84 HD12 LEU 84 121.923 4.563 3.561 663 HD13 LEU 84 HD13 LEU 84 123.345 4.987 4.544 664 HD21 LEU 84 HD21 LEU 84 124.131 7.437 2.783 665 HD22 LEU 84 HD22 LEU 84 122.832 7.069 1.622 666 HD23 LEU 84 HD23 LEU 84 122.729 8.524 2.643 667 H GLU 85 H GLU 85 121.086 3.877 5.305 668 HA GLU 85 HA GLU 85 123.023 5.060 7.200 669 HB2 GLU 85 HB2 GLU 85 120.570 3.544 8.169 670 HB3 GLU 85 HB3 GLU 85 122.067 3.632 9.127 671 HG2 GLU 85 HG2 GLU 85 121.888 6.214 8.732 672 HG3 GLU 85 HG3 GLU 85 120.191 5.870 8.317 673 H GLY 86 H GLY 86 124.487 3.366 8.038 674 HA2 GLY 86 HA3 GLY 86 125.795 1.448 7.554 675 HA3 GLY 86 HA2 GLY 86 124.233 0.593 7.468 676 H ASN 87 H ASN 87 123.853 -0.363 5.524 677 HA ASN 87 HA ASN 87 124.998 1.022 3.090 678 HB2 ASN 87 HB3 ASN 87 125.041 -1.894 3.891 679 HB3 ASN 87 HB2 ASN 87 125.072 -1.436 2.172 680 HD21 ASN 87 HD21 ASN 87 126.915 -1.428 5.198 681 HD22 ASN 87 HD22 ASN 87 128.403 -0.831 4.497 682 H LYS 88 H LYS 88 122.241 1.283 4.207 683 HA LYS 88 HA LYS 88 120.851 0.648 1.693 684 HB2 LYS 88 HB3 LYS 88 119.222 -0.928 2.623 685 HB3 LYS 88 HB2 LYS 88 120.867 -1.575 2.825 686 HG2 LYS 88 HG2 LYS 88 119.355 -0.040 4.983 687 HG3 LYS 88 HG3 LYS 88 119.428 -1.815 4.883 688 HD2 LYS 88 HD3 LYS 88 122.062 -1.327 4.734 689 HD3 LYS 88 HD2 LYS 88 121.585 0.156 5.595 690 HE2 LYS 88 HE2 LYS 88 120.315 -1.337 7.229 691 HE3 LYS 88 HE3 LYS 88 121.108 -2.728 6.451 692 HZ1 LYS 88 HZ1 LYS 88 122.344 -1.955 8.364 693 HZ2 LYS 88 HZ2 LYS 88 123.231 -1.736 6.991 694 HZ3 LYS 88 HZ3 LYS 88 122.496 -0.448 7.712 695 H LEU 89 H LEU 89 118.546 1.358 1.761 696 HA LEU 89 HA LEU 89 118.325 3.777 3.478 697 HB2 LEU 89 HB2 LEU 89 116.367 2.610 1.446 698 HB3 LEU 89 HB3 LEU 89 116.299 4.238 2.162 699 HG LEU 89 HG LEU 89 118.823 3.366 0.759 700 HD11 LEU 89 HD11 LEU 89 116.991 2.776 -0.806 701 HD12 LEU 89 HD12 LEU 89 116.307 4.409 -0.619 702 HD13 LEU 89 HD13 LEU 89 117.898 4.193 -1.388 703 HD21 LEU 89 HD21 LEU 89 118.715 5.517 1.993 704 HD22 LEU 89 HD22 LEU 89 118.904 5.791 0.245 705 HD23 LEU 89 HD23 LEU 89 117.313 6.008 1.012 706 H ILE 90 H ILE 90 117.299 3.739 5.440 707 HA ILE 90 HA ILE 90 115.757 1.247 6.063 708 HB ILE 90 HB ILE 90 115.721 2.831 8.365 709 HG12 ILE 90 HG13 ILE 90 118.412 3.081 8.415 710 HG13 ILE 90 HG12 ILE 90 118.130 3.431 6.693 711 HG21 ILE 90 HG21 ILE 90 116.126 0.388 8.178 712 HG22 ILE 90 HG22 ILE 90 117.366 1.179 9.180 713 HG23 ILE 90 HG23 ILE 90 117.741 0.714 7.504 714 HD11 ILE 90 HD11 ILE 90 116.881 4.835 9.092 715 HD12 ILE 90 HD12 ILE 90 116.356 5.091 7.411 716 HD13 ILE 90 HD13 ILE 90 118.009 5.529 7.903 717 H GLY 91 H GLY 91 113.719 1.430 7.227 718 HA2 GLY 91 HA3 GLY 91 112.197 3.966 6.807 719 HA3 GLY 91 HA2 GLY 91 111.602 2.517 5.956 720 H LYS 92 H LYS 92 111.810 4.171 8.984 721 HA LYS 92 HA LYS 92 110.746 1.771 10.449 722 HB2 LYS 92 HB2 LYS 92 112.002 4.391 11.238 723 HB3 LYS 92 HB3 LYS 92 110.869 3.626 12.377 724 HG2 LYS 92 HG2 LYS 92 112.198 1.497 12.185 725 HG3 LYS 92 HG3 LYS 92 113.376 2.369 11.175 726 HD2 LYS 92 HD3 LYS 92 113.947 3.861 12.977 727 HD3 LYS 92 HD2 LYS 92 112.577 3.297 13.963 728 HE2 LYS 92 HE2 LYS 92 113.651 0.969 13.881 729 HE3 LYS 92 HE3 LYS 92 115.095 1.763 13.209 730 HZ1 LYS 92 HZ1 LYS 92 115.217 1.573 15.603 731 HZ2 LYS 92 HZ2 LYS 92 115.155 3.161 15.163 732 HZ3 LYS 92 HZ3 LYS 92 113.817 2.426 15.786 733 H PHE 93 H PHE 93 108.573 1.549 10.172 734 HA PHE 93 HA PHE 93 106.907 4.057 10.453 735 HB2 PHE 93 HB2 PHE 93 106.864 1.883 8.392 736 HB3 PHE 93 HB3 PHE 93 105.287 2.470 8.964 737 HD1 PHE 93 HD1 PHE 93 107.614 5.077 9.391 738 HD2 PHE 93 HD2 PHE 93 105.363 3.057 6.344 739 HE1 PHE 93 HE1 PHE 93 107.826 7.057 7.926 740 HE2 PHE 93 HE2 PHE 93 105.573 5.043 4.873 741 HZ PHE 93 HZ PHE 93 106.803 7.046 5.666 742 H LYS 94 H LYS 94 105.222 3.932 11.822 743 HA LYS 94 HA LYS 94 104.573 1.205 12.948 744 HB2 LYS 94 HB3 LYS 94 104.634 1.989 15.134 745 HB3 LYS 94 HB2 LYS 94 105.916 2.993 14.417 746 HG2 LYS 94 HG2 LYS 94 104.152 4.761 13.962 747 HG3 LYS 94 HG3 LYS 94 103.014 3.779 14.914 748 HD2 LYS 94 HD2 LYS 94 105.701 4.458 16.100 749 HD3 LYS 94 HD3 LYS 94 104.432 5.705 16.075 750 HE2 LYS 94 HE2 LYS 94 104.120 2.897 17.230 751 HE3 LYS 94 HE3 LYS 94 104.382 4.377 18.184 752 HZ1 LYS 94 HZ1 LYS 94 102.047 3.819 18.029 753 HZ2 LYS 94 HZ2 LYS 94 102.339 5.251 17.265 754 HZ3 LYS 94 HZ3 LYS 94 102.096 3.880 16.382 755 H ARG 95 H ARG 95 102.440 0.708 12.803 756 HA ARG 95 HA ARG 95 100.598 2.350 11.373 757 HB2 ARG 95 HB3 ARG 95 100.369 -0.024 13.199 758 HB3 ARG 95 HB2 ARG 95 98.879 0.882 12.840 759 HG2 ARG 95 HG2 ARG 95 99.435 0.687 10.383 760 HG3 ARG 95 HG3 ARG 95 100.795 -0.373 10.825 761 HD2 ARG 95 HD2 ARG 95 98.969 -1.838 10.304 762 HD3 ARG 95 HD3 ARG 95 99.077 -1.812 12.081 763 HE ARG 95 HE ARG 95 97.209 0.182 10.906 764 HH11 ARG 95 HH11 ARG 95 95.055 -0.131 11.520 765 HH12 ARG 95 HH12 ARG 95 94.577 -1.620 12.304 766 HH21 ARG 95 HH21 ARG 95 97.778 -2.987 12.231 767 HH22 ARG 95 HH22 ARG 95 96.112 -3.229 12.705 768 H THR 96 H THR 96 99.869 4.329 11.958 769 HA THR 96 HA THR 96 100.021 5.259 14.724 770 HB THR 96 HB THR 96 98.234 6.950 13.423 771 HG1 THR 96 HG1 THR 96 100.148 6.030 11.521 772 HG21 THR 96 HG21 THR 96 100.233 8.367 13.070 773 HG22 THR 96 HG22 THR 96 101.282 6.953 13.336 774 HG23 THR 96 HG23 THR 96 100.281 7.582 14.666 775 H ASP 97 H ASP 97 97.929 3.290 13.075 776 HA ASP 97 HA ASP 97 95.468 4.033 14.553 777 HB2 ASP 97 HB2 ASP 97 95.665 2.982 12.165 778 HB3 ASP 97 HB3 ASP 97 95.894 1.446 13.034 779 H ASN 98 H ASN 98 97.801 1.303 14.531 780 HA ASN 98 HA ASN 98 96.901 0.731 17.356 781 HB2 ASN 98 HB2 ASN 98 97.493 -1.328 15.185 782 HB3 ASN 98 HB3 ASN 98 97.112 -1.693 16.885 783 HD21 ASN 98 HD21 ASN 98 94.991 -2.446 16.972 784 HD22 ASN 98 HD22 ASN 98 93.648 -1.720 16.118 785 H GLY 99 H GLY 99 99.367 1.877 15.612 786 HA2 GLY 99 HA2 GLY 99 101.731 1.773 15.818 787 HA3 GLY 99 HA3 GLY 99 101.379 1.525 17.546 788 H ASN 100 H ASN 100 100.697 -0.588 14.721 789 HA ASN 100 HA ASN 100 101.684 -2.917 16.219 790 HB2 ASN 100 HB2 ASN 100 100.852 -2.532 13.316 791 HB3 ASN 100 HB3 ASN 100 101.333 -4.101 14.004 792 HD21 ASN 100 HD21 ASN 100 100.134 -3.540 16.681 793 HD22 ASN 100 HD22 ASN 100 98.402 -3.636 16.450 794 H GLU 101 H GLU 101 103.362 -0.465 15.148 795 HA GLU 101 HA GLU 101 105.571 -0.142 14.392 796 HB2 GLU 101 HB2 GLU 101 105.535 -2.582 16.084 797 HB3 GLU 101 HB3 GLU 101 106.966 -2.417 15.040 798 HG2 GLU 101 HG2 GLU 101 107.424 -0.193 15.935 799 HG3 GLU 101 HG3 GLU 101 105.912 -0.219 16.873 800 H LEU 102 H LEU 102 106.676 -0.315 12.501 801 HA LEU 102 HA LEU 102 106.587 -2.892 10.977 802 HB2 LEU 102 HB2 LEU 102 104.621 -1.474 10.204 803 HB3 LEU 102 HB3 LEU 102 105.795 -0.239 9.690 804 HG LEU 102 HG LEU 102 105.929 -3.136 8.753 805 HD11 LEU 102 HD11 LEU 102 103.770 -2.134 8.048 806 HD12 LEU 102 HD12 LEU 102 104.642 -0.738 7.371 807 HD13 LEU 102 HD13 LEU 102 104.861 -2.355 6.659 808 HD21 LEU 102 HD21 LEU 102 107.062 -1.615 6.804 809 HD22 LEU 102 HD22 LEU 102 107.405 -0.589 8.218 810 HD23 LEU 102 HD23 LEU 102 107.984 -2.272 8.178 811 H ASN 103 H ASN 103 108.679 -3.268 10.361 812 HA ASN 103 HA ASN 103 110.447 -0.822 10.088 813 HB2 ASN 103 HB3 ASN 103 110.938 -3.637 11.081 814 HB3 ASN 103 HB2 ASN 103 112.282 -2.703 10.382 815 HD21 ASN 103 HD21 ASN 103 109.563 -1.205 12.166 816 HD22 ASN 103 HD22 ASN 103 110.529 -0.695 13.532 817 H THR 104 H THR 104 111.906 -0.778 8.231 818 HA THR 104 HA THR 104 111.687 -3.041 6.340 819 HB THR 104 HB THR 104 109.606 -2.008 5.783 820 HG1 THR 104 HG1 THR 104 110.306 -2.271 3.802 821 HG21 THR 104 HG21 THR 104 109.735 0.519 5.079 822 HG22 THR 104 HG22 THR 104 111.216 0.536 6.066 823 HG23 THR 104 HG23 THR 104 109.657 0.106 6.809 824 H VAL 105 H VAL 105 112.723 -2.362 4.153 825 HA VAL 105 HA VAL 105 114.865 -0.299 4.542 826 HB VAL 105 HB VAL 105 115.313 -3.263 4.023 827 HG11 VAL 105 HG11 VAL 105 117.748 -2.497 3.670 828 HG12 VAL 105 HG12 VAL 105 116.620 -2.199 2.326 829 HG13 VAL 105 HG13 VAL 105 117.082 -0.866 3.411 830 HG21 VAL 105 HG21 VAL 105 116.948 -2.978 5.869 831 HG22 VAL 105 HG22 VAL 105 115.315 -2.485 6.378 832 HG23 VAL 105 HG23 VAL 105 116.532 -1.251 5.970 833 H ARG 106 H ARG 106 115.892 0.273 2.443 834 HA ARG 106 HA ARG 106 114.246 -0.665 0.085 835 HB2 ARG 106 HB3 ARG 106 114.212 1.942 1.258 836 HB3 ARG 106 HB2 ARG 106 115.096 2.077 -0.280 837 HG2 ARG 106 HG2 ARG 106 113.180 0.760 -1.351 838 HG3 ARG 106 HG3 ARG 106 112.285 0.998 0.168 839 HD2 ARG 106 HD3 ARG 106 113.525 3.318 -1.355 840 HD3 ARG 106 HD2 ARG 106 111.881 2.731 -1.701 841 HE ARG 106 HE ARG 106 111.959 3.116 1.102 842 HH11 ARG 106 HH11 ARG 106 111.264 5.073 1.997 843 HH12 ARG 106 HH12 ARG 106 111.267 6.528 1.026 844 HH21 ARG 106 HH21 ARG 106 112.494 4.938 -1.817 845 HH22 ARG 106 HH22 ARG 106 111.960 6.453 -1.123 846 H GLU 107 H GLU 107 115.442 -1.180 -1.686 847 HA GLU 107 HA GLU 107 118.279 -0.161 -1.813 848 HB2 GLU 107 HB3 GLU 107 117.317 -3.026 -1.782 849 HB3 GLU 107 HB2 GLU 107 118.759 -2.596 -2.734 850 HG2 GLU 107 HG2 GLU 107 119.734 -1.524 -0.684 851 HG3 GLU 107 HG3 GLU 107 118.330 -2.102 0.245 852 H ILE 108 H ILE 108 119.161 -0.270 -4.032 853 HA ILE 108 HA ILE 108 116.973 -0.498 -6.100 854 HB ILE 108 HB ILE 108 119.294 1.438 -6.302 855 HG12 ILE 108 HG12 ILE 108 116.896 1.576 -4.545 856 HG13 ILE 108 HG13 ILE 108 118.427 2.476 -4.451 857 HG21 ILE 108 HG21 ILE 108 117.819 0.748 -8.264 858 HG22 ILE 108 HG22 ILE 108 116.466 1.533 -7.414 859 HG23 ILE 108 HG23 ILE 108 117.873 2.495 -7.927 860 HD11 ILE 108 HD11 ILE 108 116.724 4.091 -4.962 861 HD12 ILE 108 HD12 ILE 108 117.618 3.813 -6.476 862 HD13 ILE 108 HD13 ILE 108 116.027 3.053 -6.229 863 H ILE 109 H ILE 109 117.773 -2.677 -6.408 864 HA ILE 109 HA ILE 109 120.539 -3.238 -7.025 865 HB ILE 109 HB ILE 109 117.966 -4.650 -7.848 866 HG12 ILE 109 HG12 ILE 109 120.062 -5.291 -5.724 867 HG13 ILE 109 HG13 ILE 109 118.487 -4.528 -5.398 868 HG21 ILE 109 HG21 ILE 109 119.817 -5.180 -9.412 869 HG22 ILE 109 HG22 ILE 109 120.867 -5.579 -8.032 870 HG23 ILE 109 HG23 ILE 109 119.434 -6.577 -8.378 871 HD11 ILE 109 HD11 ILE 109 119.047 -7.327 -6.441 872 HD12 ILE 109 HD12 ILE 109 117.446 -6.565 -6.600 873 HD13 ILE 109 HD13 ILE 109 118.140 -6.851 -4.986 874 H GLY 110 H GLY 110 121.311 -1.671 -8.467 875 HA2 GLY 110 HA2 GLY 110 121.713 -0.730 -10.595 876 HA3 GLY 110 HA3 GLY 110 121.172 -2.295 -11.244 877 H ASP 111 H ASP 111 118.780 -2.580 -11.523 878 HA ASP 111 HA ASP 111 117.399 0.085 -11.885 879 HB2 ASP 111 HB2 ASP 111 116.394 -0.856 -13.990 880 HB3 ASP 111 HB3 ASP 111 118.157 -0.636 -14.086 881 H GLU 112 H GLU 112 117.221 -2.012 -9.760 882 HA GLU 112 HA GLU 112 114.257 -2.492 -10.063 883 HB2 GLU 112 HB2 GLU 112 115.889 -4.529 -8.582 884 HB3 GLU 112 HB3 GLU 112 114.396 -4.738 -9.526 885 HG2 GLU 112 HG3 GLU 112 115.864 -4.145 -11.591 886 HG3 GLU 112 HG2 GLU 112 117.249 -4.477 -10.523 887 H LEU 113 H LEU 113 113.087 -2.056 -8.172 888 HA LEU 113 HA LEU 113 114.782 -1.003 -5.903 889 HB2 LEU 113 HB2 LEU 113 113.054 0.512 -6.941 890 HB3 LEU 113 HB3 LEU 113 111.798 -0.621 -6.387 891 HG LEU 113 HG LEU 113 113.025 -0.319 -4.042 892 HD11 LEU 113 HD11 LEU 113 114.859 1.075 -4.964 893 HD12 LEU 113 HD12 LEU 113 113.890 1.994 -3.787 894 HD13 LEU 113 HD13 LEU 113 113.667 2.269 -5.532 895 HD21 LEU 113 HD21 LEU 113 111.547 1.851 -3.786 896 HD22 LEU 113 HD22 LEU 113 110.760 0.298 -4.153 897 HD23 LEU 113 HD23 LEU 113 111.043 1.481 -5.453 898 H VAL 114 H VAL 114 115.098 -2.431 -4.292 899 HA VAL 114 HA VAL 114 112.949 -4.491 -3.824 900 HB VAL 114 HB VAL 114 115.776 -4.373 -2.688 901 HG11 VAL 114 HG11 VAL 114 114.155 -5.742 -1.406 902 HG12 VAL 114 HG12 VAL 114 115.360 -6.769 -2.218 903 HG13 VAL 114 HG13 VAL 114 113.720 -6.618 -2.893 904 HG21 VAL 114 HG21 VAL 114 115.812 -4.537 -5.165 905 HG22 VAL 114 HG22 VAL 114 114.688 -5.914 -5.088 906 HG23 VAL 114 HG23 VAL 114 116.328 -6.066 -4.414 907 H GLN 115 H GLN 115 111.463 -3.712 -2.394 908 HA GLN 115 HA GLN 115 112.531 -2.191 -0.006 909 HB2 GLN 115 HB2 GLN 115 110.822 -1.044 -1.497 910 HB3 GLN 115 HB3 GLN 115 109.661 -2.310 -1.031 911 HG2 GLN 115 HG3 GLN 115 109.624 -1.616 1.227 912 HG3 GLN 115 HG2 GLN 115 111.162 -0.732 1.077 913 HE21 GLN 115 HE21 GLN 115 107.752 -0.689 -0.152 914 HE22 GLN 115 HE22 GLN 115 107.691 1.050 -0.331 915 H THR 116 H THR 116 112.871 -3.677 1.600 916 HA THR 116 HA THR 116 110.815 -5.869 1.878 917 HB THR 116 HB THR 116 113.333 -5.836 3.508 918 HG1 THR 116 HG1 THR 116 114.186 -5.320 1.522 919 HG21 THR 116 HG21 THR 116 113.201 -8.267 3.032 920 HG22 THR 116 HG22 THR 116 111.810 -7.978 1.958 921 HG23 THR 116 HG23 THR 116 111.669 -7.658 3.704 922 H TYR 117 H TYR 117 109.746 -6.195 3.820 923 HA TYR 117 HA TYR 117 110.255 -4.105 5.944 924 HB2 TYR 117 HB2 TYR 117 107.465 -5.127 5.648 925 HB3 TYR 117 HB3 TYR 117 108.044 -3.517 6.131 926 HD1 TYR 117 HD1 TYR 117 108.179 -5.779 3.161 927 HD2 TYR 117 HD2 TYR 117 107.663 -1.787 4.631 928 HE1 TYR 117 HE1 TYR 117 107.770 -4.986 0.848 929 HE2 TYR 117 HE2 TYR 117 107.256 -0.980 2.321 930 HH TYR 117 HH TYR 117 106.879 -3.198 -0.376 931 H VAL 118 H VAL 118 109.886 -4.753 8.046 932 HA VAL 118 HA VAL 118 109.645 -7.745 8.416 933 HB VAL 118 HB VAL 118 110.790 -5.805 10.443 934 HG11 VAL 118 HG11 VAL 118 111.588 -7.720 11.511 935 HG12 VAL 118 HG12 VAL 118 110.066 -8.328 10.816 936 HG13 VAL 118 HG13 VAL 118 111.613 -8.674 10.007 937 HG21 VAL 118 HG21 VAL 118 113.046 -6.752 9.479 938 HG22 VAL 118 HG22 VAL 118 112.090 -7.013 8.000 939 HG23 VAL 118 HG23 VAL 118 112.260 -5.374 8.672 940 H TYR 119 H TYR 119 108.290 -8.481 10.053 941 HA TYR 119 HA TYR 119 106.663 -6.380 11.449 942 HB2 TYR 119 HB3 TYR 119 105.683 -7.558 9.188 943 HB3 TYR 119 HB2 TYR 119 105.115 -8.704 10.426 944 HD1 TYR 119 HD1 TYR 119 103.822 -7.830 12.396 945 HD2 TYR 119 HD2 TYR 119 104.676 -5.406 8.960 946 HE1 TYR 119 HE1 TYR 119 102.009 -6.269 13.050 947 HE2 TYR 119 HE2 TYR 119 102.873 -3.835 9.616 948 HH TYR 119 HH TYR 119 100.784 -3.869 10.964 949 H GLU 120 H GLU 120 107.051 -6.818 13.501 950 HA GLU 120 HA GLU 120 107.370 -8.035 15.492 951 HB2 GLU 120 HB2 GLU 120 105.178 -9.719 14.213 952 HB3 GLU 120 HB3 GLU 120 105.610 -9.717 15.939 953 HG2 GLU 120 HG3 GLU 120 104.945 -7.114 14.554 954 HG3 GLU 120 HG2 GLU 120 103.633 -8.189 15.092 955 H GLY 121 H GLY 121 108.814 -9.010 12.931 956 HA2 GLY 121 HA2 GLY 121 110.716 -10.607 13.288 957 HA3 GLY 121 HA3 GLY 121 109.578 -11.678 14.141 958 H VAL 122 H VAL 122 108.640 -9.927 11.259 959 HA VAL 122 HA VAL 122 108.814 -12.518 9.725 960 HB VAL 122 HB VAL 122 106.453 -11.420 10.498 961 HG11 VAL 122 HG11 VAL 122 106.783 -10.346 7.687 962 HG12 VAL 122 HG12 VAL 122 107.182 -9.339 9.099 963 HG13 VAL 122 HG13 VAL 122 105.529 -9.965 8.891 964 HG21 VAL 122 HG21 VAL 122 105.456 -12.645 8.592 965 HG22 VAL 122 HG22 VAL 122 106.784 -13.570 9.334 966 HG23 VAL 122 HG23 VAL 122 107.049 -12.705 7.801 967 H GLU 123 H GLU 123 108.503 -11.850 7.250 968 HA GLU 123 HA GLU 123 109.775 -9.207 6.751 969 HB2 GLU 123 HB2 GLU 123 111.199 -11.848 6.322 970 HB3 GLU 123 HB3 GLU 123 111.609 -10.406 5.363 971 HG2 GLU 123 HG3 GLU 123 111.868 -9.158 7.582 972 HG3 GLU 123 HG2 GLU 123 111.762 -10.744 8.385 973 H ALA 124 H ALA 124 108.757 -8.383 5.044 974 HA ALA 124 HA ALA 124 107.825 -10.297 2.890 975 HB1 ALA 124 HB1 ALA 124 106.635 -7.637 2.743 976 HB2 ALA 124 HB2 ALA 124 105.833 -9.219 2.894 977 HB3 ALA 124 HB3 ALA 124 106.371 -8.351 4.352 978 H LYS 125 H LYS 125 108.332 -9.703 0.692 979 HA LYS 125 HA LYS 125 110.258 -7.372 0.527 980 HB2 LYS 125 HB2 LYS 125 111.253 -9.774 0.429 981 HB3 LYS 125 HB3 LYS 125 110.518 -9.853 -1.191 982 HG2 LYS 125 HG3 LYS 125 111.693 -7.530 -1.558 983 HG3 LYS 125 HG2 LYS 125 112.701 -8.016 -0.174 984 HD2 LYS 125 HD2 LYS 125 112.263 -9.888 -2.520 985 HD3 LYS 125 HD3 LYS 125 113.526 -8.636 -2.569 986 HE2 LYS 125 HE2 LYS 125 113.328 -10.435 -0.153 987 HE3 LYS 125 HE3 LYS 125 114.088 -11.055 -1.639 988 HZ1 LYS 125 HZ1 LYS 125 115.693 -10.000 -0.191 989 HZ2 LYS 125 HZ2 LYS 125 115.560 -9.154 -1.600 990 HZ3 LYS 125 HZ3 LYS 125 114.855 -8.580 -0.224 991 H ARG 126 H ARG 126 110.068 -6.031 -1.197 992 HA ARG 126 HA ARG 126 108.074 -6.794 -3.343 993 HB2 ARG 126 HB2 ARG 126 108.047 -4.516 -1.461 994 HB3 ARG 126 HB3 ARG 126 107.945 -4.013 -3.165 995 HG2 ARG 126 HG3 ARG 126 106.087 -5.692 -3.481 996 HG3 ARG 126 HG2 ARG 126 106.135 -6.006 -1.729 997 HD2 ARG 126 HD2 ARG 126 105.567 -3.689 -1.241 998 HD3 ARG 126 HD3 ARG 126 105.695 -3.252 -2.961 999 HE ARG 126 HE ARG 126 103.389 -4.532 -1.668 1000 HH11 ARG 126 HH11 ARG 126 101.678 -5.054 -3.053 1001 HH12 ARG 126 HH12 ARG 126 101.935 -5.090 -4.783 1002 HH21 ARG 126 HH21 ARG 126 105.297 -4.211 -4.561 1003 HH22 ARG 126 HH22 ARG 126 103.976 -4.614 -5.634 1004 H ILE 127 H ILE 127 109.262 -6.932 -5.215 1005 HA ILE 127 HA ILE 127 111.626 -5.056 -5.446 1006 HB ILE 127 HB ILE 127 111.157 -7.604 -7.038 1007 HG12 ILE 127 HG12 ILE 127 113.050 -7.459 -4.693 1008 HG13 ILE 127 HG13 ILE 127 111.322 -7.758 -4.387 1009 HG21 ILE 127 HG21 ILE 127 112.783 -5.967 -7.948 1010 HG22 ILE 127 HG22 ILE 127 113.644 -5.960 -6.390 1011 HG23 ILE 127 HG23 ILE 127 113.604 -7.440 -7.377 1012 HD11 ILE 127 HD11 ILE 127 112.560 -9.889 -4.657 1013 HD12 ILE 127 HD12 ILE 127 111.373 -9.669 -5.965 1014 HD13 ILE 127 HD13 ILE 127 113.101 -9.370 -6.271 1015 H PHE 128 H PHE 128 111.431 -3.444 -6.882 1016 HA PHE 128 HA PHE 128 109.330 -3.723 -9.034 1017 HB2 PHE 128 HB2 PHE 128 110.849 -1.203 -8.246 1018 HB3 PHE 128 HB3 PHE 128 109.355 -1.318 -9.201 1019 HD1 PHE 128 HD1 PHE 128 108.382 -3.645 -7.201 1020 HD2 PHE 128 HD2 PHE 128 109.647 0.424 -6.749 1021 HE1 PHE 128 HE1 PHE 128 107.018 -3.457 -5.143 1022 HE2 PHE 128 HE2 PHE 128 108.289 0.619 -4.682 1023 HZ PHE 128 HZ PHE 128 106.970 -1.324 -3.878 1024 H LYS 129 H LYS 129 110.015 -2.374 -11.079 1025 HA LYS 129 HA LYS 129 112.886 -2.385 -11.726 1026 HB2 LYS 129 HB3 LYS 129 112.573 -4.764 -11.998 1027 HB3 LYS 129 HB2 LYS 129 111.045 -4.521 -12.878 1028 HG2 LYS 129 HG2 LYS 129 112.125 -3.784 -14.819 1029 HG3 LYS 129 HG3 LYS 129 113.577 -3.259 -13.934 1030 HD2 LYS 129 HD2 LYS 129 114.239 -5.578 -13.548 1031 HD3 LYS 129 HD3 LYS 129 112.723 -6.168 -14.270 1032 HE2 LYS 129 HE3 LYS 129 114.167 -6.356 -16.091 1033 HE3 LYS 129 HE2 LYS 129 113.528 -4.715 -16.348 1034 HZ1 LYS 129 HZ1 LYS 129 116.160 -5.452 -15.962 1035 HZ2 LYS 129 HZ2 LYS 129 115.555 -3.923 -16.092 1036 HZ3 LYS 129 HZ3 LYS 129 115.720 -4.622 -14.607 1037 H LYS 130 H LYS 130 113.269 -1.382 -13.802 1038 HA LYS 130 HA LYS 130 111.536 0.726 -14.497 1039 HB2 LYS 130 HB3 LYS 130 112.648 0.525 -16.835 1040 HB3 LYS 130 HB2 LYS 130 113.720 0.769 -15.435 1041 HG2 LYS 130 HG2 LYS 130 114.463 -1.455 -15.448 1042 HG3 LYS 130 HG3 LYS 130 113.021 -2.037 -16.314 1043 HD2 LYS 130 HD3 LYS 130 113.790 -1.230 -18.394 1044 HD3 LYS 130 HD2 LYS 130 114.928 -0.090 -17.637 1045 HE2 LYS 130 HE2 LYS 130 115.226 -3.089 -17.273 1046 HE3 LYS 130 HE3 LYS 130 115.911 -2.257 -18.690 1047 HZ1 LYS 130 HZ1 LYS 130 117.183 -0.881 -17.254 1048 HZ2 LYS 130 HZ2 LYS 130 116.449 -1.468 -15.899 1049 HZ3 LYS 130 HZ3 LYS 130 117.443 -2.441 -16.786 1050 H ASP 131 H ASP 131 109.634 0.906 -15.595 1051 HA ASP 131 HA ASP 131 108.199 -1.534 -16.340 1052 HB2 ASP 131 HB2 ASP 131 106.508 0.121 -17.267 1053 HB3 ASP 131 HB3 ASP 131 106.931 0.377 -15.557 Start of MODEL 9 1 H1 ALA 1 H1 ALA 1 118.402 6.984 -9.007 2 H2 ALA 1 H2 ALA 1 119.293 7.828 -7.905 3 H3 ALA 1 H3 ALA 1 117.776 8.338 -8.304 4 HA ALA 1 HA ALA 1 118.425 5.824 -6.900 5 HB1 ALA 1 HB1 ALA 1 117.982 6.890 -4.923 6 HB2 ALA 1 HB2 ALA 1 116.725 7.922 -5.646 7 HB3 ALA 1 HB3 ALA 1 118.443 8.346 -5.837 8 H PHE 2 H PHE 2 117.066 5.311 -9.083 9 HA PHE 2 HA PHE 2 115.014 4.374 -9.792 10 HB2 PHE 2 HB3 PHE 2 114.967 4.088 -7.033 11 HB3 PHE 2 HB2 PHE 2 113.472 5.002 -7.347 12 HD1 PHE 2 HD1 PHE 2 115.373 2.234 -9.073 13 HD2 PHE 2 HD2 PHE 2 111.600 3.670 -7.604 14 HE1 PHE 2 HE1 PHE 2 114.265 0.172 -9.896 15 HE2 PHE 2 HE2 PHE 2 110.498 1.606 -8.423 16 HZ PHE 2 HZ PHE 2 111.831 -0.140 -9.571 17 H ASP 3 H ASP 3 115.687 7.251 -10.025 18 HA ASP 3 HA ASP 3 113.177 8.733 -9.606 19 HB2 ASP 3 HB2 ASP 3 115.292 9.600 -11.577 20 HB3 ASP 3 HB3 ASP 3 114.333 10.584 -10.445 21 H SER 4 H SER 4 111.531 7.589 -10.715 22 HA SER 4 HA SER 4 110.906 8.310 -13.342 23 HB2 SER 4 HB3 SER 4 112.651 7.325 -14.487 24 HB3 SER 4 HB2 SER 4 112.906 6.080 -13.241 25 HG SER 4 HG SER 4 111.945 5.308 -15.260 26 H THR 5 H THR 5 109.742 6.041 -14.459 27 HA THR 5 HA THR 5 107.691 5.449 -12.361 28 HB THR 5 HB THR 5 107.773 4.799 -15.342 29 HG1 THR 5 HG1 THR 5 106.243 6.539 -15.397 30 HG21 THR 5 HG21 THR 5 105.212 4.584 -14.829 31 HG22 THR 5 HG22 THR 5 106.285 3.229 -14.407 32 HG23 THR 5 HG23 THR 5 105.737 4.357 -13.144 33 H TRP 6 H TRP 6 107.177 3.352 -11.677 34 HA TRP 6 HA TRP 6 108.754 1.068 -12.783 35 HB2 TRP 6 HB2 TRP 6 108.851 1.643 -9.805 36 HB3 TRP 6 HB3 TRP 6 109.835 0.494 -10.742 37 HD1 TRP 6 HD1 TRP 6 109.291 4.315 -10.408 38 HE1 TRP 6 HE1 TRP 6 111.507 5.519 -10.948 39 HE3 TRP 6 HE3 TRP 6 112.089 0.280 -11.786 40 HZ2 TRP 6 HZ2 TRP 6 114.148 4.799 -11.872 41 HZ3 TRP 6 HZ3 TRP 6 114.445 0.558 -12.487 42 HH2 TRP 6 HH2 TRP 6 115.481 2.811 -12.531 43 H LYS 7 H LYS 7 108.027 -1.028 -11.640 44 HA LYS 7 HA LYS 7 105.403 -0.791 -10.255 45 HB2 LYS 7 HB2 LYS 7 104.070 -1.824 -11.881 46 HB3 LYS 7 HB3 LYS 7 105.109 -0.776 -12.876 47 HG2 LYS 7 HG2 LYS 7 106.693 -2.771 -13.106 48 HG3 LYS 7 HG3 LYS 7 105.412 -3.764 -12.371 49 HD2 LYS 7 HD2 LYS 7 105.101 -2.066 -14.886 50 HD3 LYS 7 HD3 LYS 7 105.322 -3.832 -14.859 51 HE2 LYS 7 HE2 LYS 7 102.943 -2.187 -14.003 52 HE3 LYS 7 HE3 LYS 7 102.994 -3.678 -14.973 53 HZ1 LYS 7 HZ1 LYS 7 102.241 -4.357 -12.911 54 HZ2 LYS 7 HZ2 LYS 7 103.267 -3.380 -12.067 55 HZ3 LYS 7 HZ3 LYS 7 103.848 -4.720 -12.833 56 H VAL 8 H VAL 8 105.159 -2.453 -8.828 57 HA VAL 8 HA VAL 8 107.196 -4.166 -8.061 58 HB VAL 8 HB VAL 8 105.362 -4.278 -6.643 59 HG11 VAL 8 HG11 VAL 8 103.020 -4.845 -7.618 60 HG12 VAL 8 HG12 VAL 8 103.678 -3.222 -7.932 61 HG13 VAL 8 HG13 VAL 8 103.743 -4.469 -9.200 62 HG21 VAL 8 HG21 VAL 8 104.648 -6.541 -6.545 63 HG22 VAL 8 HG22 VAL 8 106.210 -6.617 -7.396 64 HG23 VAL 8 HG23 VAL 8 104.689 -6.721 -8.316 65 H ASP 9 H ASP 9 108.448 -5.292 -9.440 66 HA ASP 9 HA ASP 9 107.102 -6.900 -11.598 67 HB2 ASP 9 HB2 ASP 9 109.183 -5.347 -11.962 68 HB3 ASP 9 HB3 ASP 9 110.096 -6.655 -11.173 69 H ARG 10 H ARG 10 108.961 -7.106 -8.611 70 HA ARG 10 HA ARG 10 108.374 -10.056 -8.596 71 HB2 ARG 10 HB2 ARG 10 111.079 -8.736 -8.397 72 HB3 ARG 10 HB3 ARG 10 110.767 -10.229 -7.479 73 HG2 ARG 10 HG3 ARG 10 109.958 -10.125 -10.377 74 HG3 ARG 10 HG2 ARG 10 111.681 -10.327 -9.981 75 HD2 ARG 10 HD3 ARG 10 111.349 -12.401 -8.981 76 HD3 ARG 10 HD2 ARG 10 109.666 -12.034 -8.533 77 HE ARG 10 HE ARG 10 109.685 -12.083 -11.362 78 HH11 ARG 10 HH11 ARG 10 109.176 -13.983 -12.474 79 HH12 ARG 10 HH12 ARG 10 109.364 -15.534 -11.687 80 HH21 ARG 10 HH21 ARG 10 110.511 -14.166 -8.697 81 HH22 ARG 10 HH22 ARG 10 110.117 -15.637 -9.558 82 H SER 11 H SER 11 108.843 -10.968 -6.321 83 HA SER 11 HA SER 11 108.981 -9.166 -4.052 84 HB2 SER 11 HB2 SER 11 106.793 -8.373 -4.662 85 HB3 SER 11 HB3 SER 11 106.212 -10.026 -4.981 86 HG SER 11 HG SER 11 105.617 -9.989 -2.949 87 H GLU 12 H GLU 12 108.000 -10.457 -2.005 88 HA GLU 12 HA GLU 12 108.050 -13.396 -2.418 89 HB2 GLU 12 HB2 GLU 12 110.119 -13.881 -1.565 90 HB3 GLU 12 HB3 GLU 12 110.508 -12.240 -2.131 91 HG2 GLU 12 HG2 GLU 12 109.751 -11.409 0.174 92 HG3 GLU 12 HG3 GLU 12 109.737 -13.115 0.682 93 H ASN 13 H ASN 13 107.415 -14.560 -0.501 94 HA ASN 13 HA ASN 13 106.087 -14.800 1.433 95 HB2 ASN 13 HB3 ASN 13 107.833 -12.417 2.064 96 HB3 ASN 13 HB2 ASN 13 106.539 -12.883 3.194 97 HD21 ASN 13 HD21 ASN 13 108.115 -13.607 4.815 98 HD22 ASN 13 HD22 ASN 13 109.012 -15.090 4.582 99 H TYR 14 H TYR 14 105.807 -11.541 2.367 100 HA TYR 14 HA TYR 14 104.077 -9.952 2.069 101 HB2 TYR 14 HB3 TYR 14 104.310 -11.018 -0.446 102 HB3 TYR 14 HB2 TYR 14 102.636 -11.469 -0.047 103 HD1 TYR 14 HD1 TYR 14 104.597 -8.464 1.048 104 HD2 TYR 14 HD2 TYR 14 101.317 -9.964 -1.289 105 HE1 TYR 14 HE1 TYR 14 103.859 -6.141 0.590 106 HE2 TYR 14 HE2 TYR 14 100.581 -7.640 -1.746 107 HH TYR 14 HH TYR 14 102.463 -4.974 -1.316 108 H ASP 15 H ASP 15 102.842 -13.292 1.460 109 HA ASP 15 HA ASP 15 100.338 -12.784 2.829 110 HB2 ASP 15 HB2 ASP 15 101.816 -15.439 2.539 111 HB3 ASP 15 HB3 ASP 15 100.081 -15.222 2.873 112 H LYS 16 H LYS 16 103.476 -14.116 3.911 113 HA LYS 16 HA LYS 16 102.591 -14.585 6.641 114 HB2 LYS 16 HB3 LYS 16 105.424 -13.852 5.805 115 HB3 LYS 16 HB2 LYS 16 104.908 -14.885 7.160 116 HG2 LYS 16 HG2 LYS 16 104.714 -15.493 4.181 117 HG3 LYS 16 HG3 LYS 16 105.674 -16.358 5.406 118 HD2 LYS 16 HD3 LYS 16 103.435 -16.835 6.591 119 HD3 LYS 16 HD2 LYS 16 102.650 -16.285 5.091 120 HE2 LYS 16 HE2 LYS 16 102.870 -18.675 4.908 121 HE3 LYS 16 HE3 LYS 16 104.119 -17.973 3.851 122 HZ1 LYS 16 HZ1 LYS 16 105.008 -19.725 5.238 123 HZ2 LYS 16 HZ2 LYS 16 104.548 -18.934 6.610 124 HZ3 LYS 16 HZ3 LYS 16 105.705 -18.284 5.632 125 H PHE 17 H PHE 17 103.816 -11.785 4.866 126 HA PHE 17 HA PHE 17 104.223 -10.132 7.249 127 HB2 PHE 17 HB2 PHE 17 105.363 -9.501 5.240 128 HB3 PHE 17 HB3 PHE 17 103.863 -9.558 4.285 129 HD1 PHE 17 HD1 PHE 17 105.874 -7.641 6.656 130 HD2 PHE 17 HD2 PHE 17 102.158 -7.776 4.519 131 HE1 PHE 17 HE1 PHE 17 105.509 -5.242 7.153 132 HE2 PHE 17 HE2 PHE 17 101.783 -5.374 5.018 133 HZ PHE 17 HZ PHE 17 103.461 -4.105 6.335 134 H MET 18 H MET 18 101.746 -10.015 4.657 135 HA MET 18 HA MET 18 99.967 -8.247 6.033 136 HB2 MET 18 HB2 MET 18 99.818 -10.123 3.750 137 HB3 MET 18 HB3 MET 18 98.268 -9.915 4.601 138 HG2 MET 18 HG2 MET 18 98.329 -7.523 4.298 139 HG3 MET 18 HG3 MET 18 100.013 -7.576 3.725 140 HE1 MET 18 HE1 MET 18 99.735 -6.316 1.741 141 HE2 MET 18 HE2 MET 18 99.409 -7.126 0.190 142 HE3 MET 18 HE3 MET 18 100.675 -7.753 1.273 143 H GLU 19 H GLU 19 100.630 -11.664 6.493 144 HA GLU 19 HA GLU 19 98.157 -12.139 8.041 145 HB2 GLU 19 HB2 GLU 19 99.168 -14.041 6.940 146 HB3 GLU 19 HB3 GLU 19 100.744 -13.714 7.700 147 HG2 GLU 19 HG3 GLU 19 99.991 -14.392 9.837 148 HG3 GLU 19 HG2 GLU 19 98.277 -14.214 9.391 149 H LYS 20 H LYS 20 101.476 -11.114 8.684 150 HA LYS 20 HA LYS 20 101.345 -11.559 11.568 151 HB2 LYS 20 HB2 LYS 20 103.396 -11.052 9.949 152 HB3 LYS 20 HB3 LYS 20 103.024 -9.362 10.366 153 HG2 LYS 20 HG2 LYS 20 104.518 -9.936 12.073 154 HG3 LYS 20 HG3 LYS 20 102.955 -10.302 12.841 155 HD2 LYS 20 HD2 LYS 20 103.175 -12.663 12.309 156 HD3 LYS 20 HD3 LYS 20 104.630 -12.354 11.331 157 HE2 LYS 20 HE3 LYS 20 104.596 -11.466 14.213 158 HE3 LYS 20 HE2 LYS 20 104.848 -13.189 13.847 159 HZ1 LYS 20 HZ1 LYS 20 106.905 -12.728 13.246 160 HZ2 LYS 20 HZ2 LYS 20 106.412 -11.607 12.142 161 HZ3 LYS 20 HZ3 LYS 20 106.704 -11.155 13.700 162 H MET 21 H MET 21 100.673 -8.755 9.444 163 HA MET 21 HA MET 21 100.073 -6.962 11.665 164 HB2 MET 21 HB3 MET 21 98.527 -6.311 9.289 165 HB3 MET 21 HB2 MET 21 99.904 -5.440 10.003 166 HG2 MET 21 HG2 MET 21 101.491 -6.828 8.797 167 HG3 MET 21 HG3 MET 21 100.188 -7.894 8.217 168 HE1 MET 21 HE1 MET 21 100.172 -3.803 8.423 169 HE2 MET 21 HE2 MET 21 101.780 -4.566 8.392 170 HE3 MET 21 HE3 MET 21 101.220 -3.614 6.997 171 H GLY 22 H GLY 22 98.519 -9.735 10.568 172 HA2 GLY 22 HA2 GLY 22 96.468 -10.653 11.357 173 HA3 GLY 22 HA3 GLY 22 96.166 -9.144 12.251 174 H VAL 23 H VAL 23 96.932 -9.169 8.803 175 HA VAL 23 HA VAL 23 94.424 -7.728 8.241 176 HB VAL 23 HB VAL 23 96.414 -8.928 6.266 177 HG11 VAL 23 HG11 VAL 23 94.246 -8.189 5.312 178 HG12 VAL 23 HG12 VAL 23 94.450 -6.598 6.083 179 HG13 VAL 23 HG13 VAL 23 95.570 -7.116 4.799 180 HG21 VAL 23 HG21 VAL 23 97.564 -7.483 7.921 181 HG22 VAL 23 HG22 VAL 23 97.506 -6.704 6.321 182 HG23 VAL 23 HG23 VAL 23 96.387 -6.185 7.605 183 H ASN 24 H ASN 24 92.535 -8.553 7.412 184 HA ASN 24 HA ASN 24 91.848 -11.277 7.686 185 HB2 ASN 24 HB2 ASN 24 90.765 -9.428 5.518 186 HB3 ASN 24 HB3 ASN 24 89.935 -10.817 6.260 187 HD21 ASN 24 HD21 ASN 24 90.162 -10.546 8.933 188 HD22 ASN 24 HD22 ASN 24 89.594 -8.985 9.482 189 H ILE 25 H ILE 25 91.494 -12.968 6.033 190 HA ILE 25 HA ILE 25 93.834 -13.095 4.210 191 HB ILE 25 HB ILE 25 91.689 -14.986 5.147 192 HG12 ILE 25 HG12 ILE 25 94.077 -14.575 6.138 193 HG13 ILE 25 HG13 ILE 25 93.521 -16.250 5.917 194 HG21 ILE 25 HG21 ILE 25 92.573 -16.665 3.460 195 HG22 ILE 25 HG22 ILE 25 91.587 -15.360 2.760 196 HG23 ILE 25 HG23 ILE 25 93.360 -15.307 2.621 197 HD11 ILE 25 HD11 ILE 25 95.913 -15.585 5.062 198 HD12 ILE 25 HD12 ILE 25 94.875 -16.584 4.017 199 HD13 ILE 25 HD13 ILE 25 95.035 -14.838 3.706 200 H VAL 26 H VAL 26 90.881 -11.711 4.058 201 HA VAL 26 HA VAL 26 90.154 -12.474 1.294 202 HB VAL 26 HB VAL 26 89.186 -10.238 3.130 203 HG11 VAL 26 HG11 VAL 26 88.882 -9.668 0.736 204 HG12 VAL 26 HG12 VAL 26 87.320 -10.023 1.512 205 HG13 VAL 26 HG13 VAL 26 88.089 -11.238 0.463 206 HG21 VAL 26 HG21 VAL 26 88.665 -12.537 3.903 207 HG22 VAL 26 HG22 VAL 26 87.193 -11.696 3.360 208 HG23 VAL 26 HG23 VAL 26 87.962 -12.912 2.311 209 H LYS 27 H LYS 27 91.150 -9.368 2.821 210 HA LYS 27 HA LYS 27 91.705 -8.028 0.348 211 HB2 LYS 27 HB3 LYS 27 93.113 -7.689 3.037 212 HB3 LYS 27 HB2 LYS 27 93.113 -6.511 1.703 213 HG2 LYS 27 HG2 LYS 27 90.517 -6.632 1.877 214 HG3 LYS 27 HG3 LYS 27 90.803 -7.379 3.467 215 HD2 LYS 27 HD2 LYS 27 92.130 -5.428 4.170 216 HD3 LYS 27 HD3 LYS 27 91.924 -4.688 2.565 217 HE2 LYS 27 HE3 LYS 27 90.274 -3.674 3.993 218 HE3 LYS 27 HE2 LYS 27 89.399 -4.833 2.963 219 HZ1 LYS 27 HZ1 LYS 27 88.771 -5.045 5.275 220 HZ2 LYS 27 HZ2 LYS 27 89.519 -6.422 4.763 221 HZ3 LYS 27 HZ3 LYS 27 90.330 -5.349 5.717 222 H ARG 28 H ARG 28 93.773 -10.046 2.447 223 HA ARG 28 HA ARG 28 96.210 -9.722 0.960 224 HB2 ARG 28 HB2 ARG 28 96.006 -10.845 3.199 225 HB3 ARG 28 HB3 ARG 28 95.223 -12.227 2.398 226 HG2 ARG 28 HG2 ARG 28 97.466 -11.934 0.843 227 HG3 ARG 28 HG3 ARG 28 98.088 -11.414 2.428 228 HD2 ARG 28 HD2 ARG 28 98.409 -13.812 2.268 229 HD3 ARG 28 HD3 ARG 28 97.078 -13.526 3.414 230 HE ARG 28 HE ARG 28 95.532 -14.453 1.824 231 HH11 ARG 28 HH11 ARG 28 95.170 -15.678 -0.040 232 HH12 ARG 28 HH12 ARG 28 96.452 -15.888 -1.212 233 HH21 ARG 28 HH21 ARG 28 98.752 -13.987 0.582 234 HH22 ARG 28 HH22 ARG 28 98.471 -14.935 -0.862 235 H LYS 29 H LYS 29 93.568 -12.138 0.627 236 HA LYS 29 HA LYS 29 94.711 -13.663 -1.487 237 HB2 LYS 29 HB3 LYS 29 92.499 -14.061 -0.243 238 HB3 LYS 29 HB2 LYS 29 91.773 -12.882 -1.360 239 HG2 LYS 29 HG2 LYS 29 92.681 -14.282 -3.276 240 HG3 LYS 29 HG3 LYS 29 93.132 -15.514 -2.073 241 HD2 LYS 29 HD2 LYS 29 90.615 -15.241 -1.294 242 HD3 LYS 29 HD3 LYS 29 90.387 -14.597 -2.937 243 HE2 LYS 29 HE3 LYS 29 90.017 -16.881 -3.285 244 HE3 LYS 29 HE2 LYS 29 91.755 -16.751 -3.647 245 HZ1 LYS 29 HZ1 LYS 29 91.294 -18.566 -2.138 246 HZ2 LYS 29 HZ2 LYS 29 90.600 -17.541 -1.047 247 HZ3 LYS 29 HZ3 LYS 29 92.210 -17.421 -1.383 248 H LEU 30 H LEU 30 92.945 -10.561 -1.601 249 HA LEU 30 HA LEU 30 93.198 -10.503 -4.568 250 HB2 LEU 30 HB2 LEU 30 92.173 -8.388 -2.625 251 HB3 LEU 30 HB3 LEU 30 92.033 -8.333 -4.399 252 HG LEU 30 HG LEU 30 90.888 -10.551 -2.646 253 HD11 LEU 30 HD11 LEU 30 89.750 -8.383 -2.247 254 HD12 LEU 30 HD12 LEU 30 88.694 -9.506 -3.137 255 HD13 LEU 30 HD13 LEU 30 89.516 -8.184 -4.000 256 HD21 LEU 30 HD21 LEU 30 91.446 -11.216 -4.969 257 HD22 LEU 30 HD22 LEU 30 89.684 -11.159 -4.725 258 HD23 LEU 30 HD23 LEU 30 90.506 -9.837 -5.589 259 H ALA 31 H ALA 31 95.027 -9.663 -1.868 260 HA ALA 31 HA ALA 31 96.475 -7.432 -3.205 261 HB1 ALA 31 HB1 ALA 31 97.961 -7.656 -1.119 262 HB2 ALA 31 HB2 ALA 31 96.796 -8.874 -0.547 263 HB3 ALA 31 HB3 ALA 31 96.265 -7.199 -0.832 264 H ALA 32 H ALA 32 97.015 -10.857 -2.340 265 HA ALA 32 HA ALA 32 99.705 -11.238 -2.857 266 HB1 ALA 32 HB1 ALA 32 99.132 -13.437 -3.851 267 HB2 ALA 32 HB2 ALA 32 98.117 -13.091 -2.430 268 HB3 ALA 32 HB3 ALA 32 97.449 -12.898 -4.069 269 H HIS 33 H HIS 33 97.271 -10.231 -5.197 270 HA HIS 33 HA HIS 33 98.903 -10.766 -7.562 271 HB2 HIS 33 HB3 HIS 33 96.684 -8.709 -7.159 272 HB3 HIS 33 HB2 HIS 33 97.305 -9.295 -8.721 273 HD2 HIS 33 HD2 HIS 33 97.305 -12.497 -7.040 274 HE1 HIS 33 HE1 HIS 33 93.204 -12.007 -7.922 275 HE2 HIS 33 HE2 HIS 33 94.982 -13.707 -7.235 276 H ASP 34 H ASP 34 100.466 -9.522 -5.505 277 HA ASP 34 HA ASP 34 100.827 -6.753 -5.577 278 HB2 ASP 34 HB2 ASP 34 102.287 -8.780 -4.566 279 HB3 ASP 34 HB3 ASP 34 103.304 -8.400 -5.977 280 H ASN 35 H ASN 35 100.177 -5.887 -7.608 281 HA ASN 35 HA ASN 35 102.375 -5.944 -9.639 282 HB2 ASN 35 HB2 ASN 35 99.469 -6.655 -10.237 283 HB3 ASN 35 HB3 ASN 35 100.685 -6.277 -11.481 284 HD21 ASN 35 HD21 ASN 35 101.616 -8.125 -12.353 285 HD22 ASN 35 HD22 ASN 35 101.886 -9.614 -11.475 286 H LEU 36 H LEU 36 101.675 -3.896 -7.821 287 HA LEU 36 HA LEU 36 99.929 -2.020 -9.353 288 HB2 LEU 36 HB2 LEU 36 100.055 -0.581 -7.420 289 HB3 LEU 36 HB3 LEU 36 99.809 -2.241 -6.831 290 HG LEU 36 HG LEU 36 102.644 -1.309 -7.165 291 HD11 LEU 36 HD11 LEU 36 100.648 -0.184 -5.199 292 HD12 LEU 36 HD12 LEU 36 101.986 0.633 -6.042 293 HD13 LEU 36 HD13 LEU 36 102.327 -0.453 -4.673 294 HD21 LEU 36 HD21 LEU 36 101.511 -2.661 -4.728 295 HD22 LEU 36 HD22 LEU 36 101.568 -3.593 -6.244 296 HD23 LEU 36 HD23 LEU 36 103.067 -2.925 -5.553 297 H LYS 37 H LYS 37 100.691 0.223 -9.722 298 HA LYS 37 HA LYS 37 103.561 0.177 -10.665 299 HB2 LYS 37 HB2 LYS 37 101.070 1.062 -11.845 300 HB3 LYS 37 HB3 LYS 37 102.154 2.462 -11.663 301 HG2 LYS 37 HG2 LYS 37 103.955 1.241 -12.824 302 HG3 LYS 37 HG3 LYS 37 102.911 -0.194 -12.964 303 HD2 LYS 37 HD2 LYS 37 101.302 1.095 -14.326 304 HD3 LYS 37 HD3 LYS 37 102.315 2.550 -14.162 305 HE2 LYS 37 HE2 LYS 37 104.219 1.068 -15.154 306 HE3 LYS 37 HE3 LYS 37 102.904 -0.015 -15.669 307 HZ1 LYS 37 HZ1 LYS 37 103.436 1.607 -17.364 308 HZ2 LYS 37 HZ2 LYS 37 103.121 2.854 -16.332 309 HZ3 LYS 37 HZ3 LYS 37 101.902 1.851 -16.809 310 H LEU 38 H LEU 38 105.007 1.650 -9.813 311 HA LEU 38 HA LEU 38 103.843 3.828 -8.071 312 HB2 LEU 38 HB3 LEU 38 106.410 2.479 -7.260 313 HB3 LEU 38 HB2 LEU 38 105.188 3.290 -6.252 314 HG LEU 38 HG LEU 38 103.635 1.307 -7.105 315 HD11 LEU 38 HD11 LEU 38 105.802 -0.569 -6.904 316 HD12 LEU 38 HD12 LEU 38 104.693 -0.311 -8.273 317 HD13 LEU 38 HD13 LEU 38 106.215 0.608 -8.174 318 HD21 LEU 38 HD21 LEU 38 105.754 1.297 -4.937 319 HD22 LEU 38 HD22 LEU 38 104.670 -0.099 -5.145 320 HD23 LEU 38 HD23 LEU 38 103.994 1.507 -4.780 321 H THR 39 H THR 39 104.674 5.793 -8.554 322 HA THR 39 HA THR 39 107.149 5.857 -10.280 323 HB THR 39 HB THR 39 105.510 8.316 -9.736 324 HG1 THR 39 HG1 THR 39 103.868 6.874 -10.152 325 HG21 THR 39 HG21 THR 39 106.028 8.710 -12.128 326 HG22 THR 39 HG22 THR 39 107.508 8.361 -11.203 327 HG23 THR 39 HG23 THR 39 106.783 7.101 -12.230 328 H ILE 40 H ILE 40 109.028 6.375 -9.250 329 HA ILE 40 HA ILE 40 108.757 7.813 -6.605 330 HB ILE 40 HB ILE 40 110.986 6.051 -7.707 331 HG12 ILE 40 HG13 ILE 40 110.226 4.798 -5.501 332 HG13 ILE 40 HG12 ILE 40 108.717 5.710 -5.737 333 HG21 ILE 40 HG21 ILE 40 112.001 6.334 -5.460 334 HG22 ILE 40 HG22 ILE 40 111.863 7.898 -6.298 335 HG23 ILE 40 HG23 ILE 40 110.703 7.470 -5.018 336 HD11 ILE 40 HD11 ILE 40 109.324 3.278 -6.935 337 HD12 ILE 40 HD12 ILE 40 109.721 4.451 -8.214 338 HD13 ILE 40 HD13 ILE 40 108.089 4.426 -7.505 339 H THR 41 H THR 41 109.360 9.882 -6.538 340 HA THR 41 HA THR 41 111.416 10.821 -8.552 341 HB THR 41 HB THR 41 109.464 12.714 -7.251 342 HG1 THR 41 HG1 THR 41 108.053 11.195 -8.029 343 HG21 THR 41 HG21 THR 41 109.723 13.861 -9.434 344 HG22 THR 41 HG22 THR 41 111.306 13.545 -8.685 345 HG23 THR 41 HG23 THR 41 110.732 12.517 -10.019 346 H GLN 42 H GLN 42 112.963 12.385 -7.713 347 HA GLN 42 HA GLN 42 112.948 12.583 -4.695 348 HB2 GLN 42 HB2 GLN 42 115.269 11.988 -4.566 349 HB3 GLN 42 HB3 GLN 42 114.501 10.751 -5.590 350 HG2 GLN 42 HG2 GLN 42 115.189 12.140 -7.609 351 HG3 GLN 42 HG3 GLN 42 116.146 13.150 -6.498 352 HE21 GLN 42 HE21 GLN 42 117.531 11.766 -8.502 353 HE22 GLN 42 HE22 GLN 42 118.420 10.440 -7.787 354 H GLU 43 H GLU 43 113.940 14.472 -3.851 355 HA GLU 43 HA GLU 43 115.064 16.424 -5.824 356 HB2 GLU 43 HB2 GLU 43 112.609 16.961 -4.096 357 HB3 GLU 43 HB3 GLU 43 113.543 18.230 -4.924 358 HG2 GLU 43 HG3 GLU 43 113.138 17.027 -7.100 359 HG3 GLU 43 HG2 GLU 43 112.085 15.888 -6.227 360 H GLY 44 H GLY 44 116.974 15.807 -4.507 361 HA2 GLY 44 HA2 GLY 44 118.521 16.360 -2.810 362 HA3 GLY 44 HA3 GLY 44 117.489 17.759 -2.431 363 H ASN 45 H ASN 45 115.910 17.570 -0.794 364 HA ASN 45 HA ASN 45 116.072 15.004 0.806 365 HB2 ASN 45 HB2 ASN 45 115.398 16.815 2.704 366 HB3 ASN 45 HB3 ASN 45 117.088 16.410 2.317 367 HD21 ASN 45 HD21 ASN 45 117.667 18.653 3.029 368 HD22 ASN 45 HD22 ASN 45 117.387 19.989 1.934 369 H LYS 46 H LYS 46 114.168 15.889 -1.312 370 HA LYS 46 HA LYS 46 111.691 15.530 0.338 371 HB2 LYS 46 HB3 LYS 46 111.661 17.901 -0.084 372 HB3 LYS 46 HB2 LYS 46 112.228 17.679 -1.756 373 HG2 LYS 46 HG2 LYS 46 109.781 16.158 -1.253 374 HG3 LYS 46 HG3 LYS 46 109.550 17.886 -0.900 375 HD2 LYS 46 HD3 LYS 46 110.695 18.330 -3.175 376 HD3 LYS 46 HD2 LYS 46 110.453 16.598 -3.503 377 HE2 LYS 46 HE2 LYS 46 108.458 17.377 -4.357 378 HE3 LYS 46 HE3 LYS 46 107.962 17.218 -2.655 379 HZ1 LYS 46 HZ1 LYS 46 107.414 19.385 -3.544 380 HZ2 LYS 46 HZ2 LYS 46 108.533 19.533 -2.341 381 HZ3 LYS 46 HZ3 LYS 46 108.993 19.680 -3.918 382 H PHE 47 H PHE 47 111.083 13.598 -0.367 383 HA PHE 47 HA PHE 47 111.467 12.929 -3.279 384 HB2 PHE 47 HB2 PHE 47 111.056 11.263 -0.774 385 HB3 PHE 47 HB3 PHE 47 110.856 10.572 -2.402 386 HD1 PHE 47 HD1 PHE 47 113.279 12.726 -0.484 387 HD2 PHE 47 HD2 PHE 47 112.731 9.635 -3.416 388 HE1 PHE 47 HE1 PHE 47 115.739 12.472 -0.677 389 HE2 PHE 47 HE2 PHE 47 115.190 9.381 -3.609 390 HZ PHE 47 HZ PHE 47 116.694 10.798 -2.237 391 H THR 48 H THR 48 109.644 11.402 -4.106 392 HA THR 48 HA THR 48 106.971 12.030 -2.970 393 HB THR 48 HB THR 48 107.737 12.894 -5.794 394 HG1 THR 48 HG1 THR 48 108.551 14.291 -4.148 395 HG21 THR 48 HG21 THR 48 105.458 13.868 -5.811 396 HG22 THR 48 HG22 THR 48 105.167 13.215 -4.181 397 HG23 THR 48 HG23 THR 48 105.400 12.108 -5.555 398 H VAL 49 H VAL 49 106.420 9.901 -2.843 399 HA VAL 49 HA VAL 49 106.939 8.149 -5.229 400 HB VAL 49 HB VAL 49 105.897 7.483 -2.438 401 HG11 VAL 49 HG11 VAL 49 105.130 5.899 -4.186 402 HG12 VAL 49 HG12 VAL 49 106.809 5.702 -4.743 403 HG13 VAL 49 HG13 VAL 49 106.338 5.140 -3.121 404 HG21 VAL 49 HG21 VAL 49 108.251 8.264 -2.461 405 HG22 VAL 49 HG22 VAL 49 108.630 7.082 -3.737 406 HG23 VAL 49 HG23 VAL 49 108.160 6.520 -2.115 407 H LYS 50 H LYS 50 105.350 8.277 -6.743 408 HA LYS 50 HA LYS 50 102.534 8.742 -5.812 409 HB2 LYS 50 HB2 LYS 50 103.582 10.046 -7.745 410 HB3 LYS 50 HB3 LYS 50 103.553 8.528 -8.673 411 HG2 LYS 50 HG2 LYS 50 101.189 8.426 -8.663 412 HG3 LYS 50 HG3 LYS 50 101.055 9.561 -7.299 413 HD2 LYS 50 HD2 LYS 50 101.695 11.427 -8.669 414 HD3 LYS 50 HD3 LYS 50 102.215 10.362 -9.996 415 HE2 LYS 50 HE2 LYS 50 99.807 11.562 -10.000 416 HE3 LYS 50 HE3 LYS 50 100.049 9.940 -10.692 417 HZ1 LYS 50 HZ1 LYS 50 98.177 10.233 -9.043 418 HZ2 LYS 50 HZ2 LYS 50 99.193 8.959 -8.784 419 HZ3 LYS 50 HZ3 LYS 50 99.332 10.324 -7.868 420 H GLU 51 H GLU 51 101.757 6.776 -5.057 421 HA GLU 51 HA GLU 51 102.362 4.255 -6.441 422 HB2 GLU 51 HB3 GLU 51 100.239 4.986 -4.375 423 HB3 GLU 51 HB2 GLU 51 100.578 3.330 -4.933 424 HG2 GLU 51 HG2 GLU 51 101.914 3.459 -3.013 425 HG3 GLU 51 HG3 GLU 51 103.069 3.933 -4.281 426 H SER 52 H SER 52 100.676 2.909 -7.513 427 HA SER 52 HA SER 52 98.223 4.285 -8.406 428 HB2 SER 52 HB2 SER 52 100.178 3.478 -10.578 429 HB3 SER 52 HB3 SER 52 98.738 4.516 -10.704 430 HG SER 52 HG SER 52 100.882 5.606 -10.619 431 H SER 53 H SER 53 96.945 2.642 -7.936 432 HA SER 53 HA SER 53 97.582 -0.028 -9.199 433 HB2 SER 53 HB2 SER 53 97.702 -0.716 -7.009 434 HB3 SER 53 HB3 SER 53 96.792 0.693 -6.412 435 HG SER 53 HG SER 53 95.831 -1.679 -6.626 436 H ALA 54 H ALA 54 95.812 -1.039 -10.205 437 HA ALA 54 HA ALA 54 93.766 0.665 -11.262 438 HB1 ALA 54 HB1 ALA 54 92.669 -1.437 -11.989 439 HB2 ALA 54 HB2 ALA 54 94.422 -1.492 -12.289 440 HB3 ALA 54 HB3 ALA 54 93.729 -2.365 -10.902 441 H PHE 55 H PHE 55 94.103 0.063 -8.090 442 HA PHE 55 HA PHE 55 91.108 -0.081 -7.696 443 HB2 PHE 55 HB2 PHE 55 91.995 -2.160 -6.900 444 HB3 PHE 55 HB3 PHE 55 93.341 -1.346 -6.068 445 HD1 PHE 55 HD1 PHE 55 93.099 -1.406 -3.758 446 HD2 PHE 55 HD2 PHE 55 89.607 -0.834 -6.194 447 HE1 PHE 55 HE1 PHE 55 91.710 -1.192 -1.715 448 HE2 PHE 55 HE2 PHE 55 88.218 -0.616 -4.151 449 HZ PHE 55 HZ PHE 55 89.269 -0.795 -1.913 450 H ARG 56 H ARG 56 94.084 1.655 -6.942 451 HA ARG 56 HA ARG 56 92.630 3.880 -5.860 452 HB2 ARG 56 HB2 ARG 56 93.411 3.590 -3.413 453 HB3 ARG 56 HB3 ARG 56 92.019 2.612 -3.935 454 HG2 ARG 56 HG2 ARG 56 93.592 0.715 -4.415 455 HG3 ARG 56 HG3 ARG 56 94.924 1.695 -3.757 456 HD2 ARG 56 HD3 ARG 56 92.395 1.095 -2.180 457 HD3 ARG 56 HD2 ARG 56 93.832 0.046 -2.126 458 HE ARG 56 HE ARG 56 94.935 2.506 -1.562 459 HH11 ARG 56 HH11 ARG 56 94.975 3.440 0.497 460 HH12 ARG 56 HH12 ARG 56 93.760 3.007 1.677 461 HH21 ARG 56 HH21 ARG 56 92.112 0.796 -0.449 462 HH22 ARG 56 HH22 ARG 56 92.146 1.517 1.145 463 H ASN 57 H ASN 57 94.309 4.684 -7.343 464 HA ASN 57 HA ASN 57 97.127 4.397 -6.760 465 HB2 ASN 57 HB3 ASN 57 97.413 6.390 -8.193 466 HB3 ASN 57 HB2 ASN 57 96.240 5.266 -8.920 467 HD21 ASN 57 HD21 ASN 57 93.850 5.767 -7.756 468 HD22 ASN 57 HD22 ASN 57 93.404 7.453 -7.894 469 H ILE 58 H ILE 58 98.542 5.724 -5.547 470 HA ILE 58 HA ILE 58 97.205 7.822 -3.843 471 HB ILE 58 HB ILE 58 99.279 6.019 -2.622 472 HG12 ILE 58 HG12 ILE 58 96.345 5.359 -3.066 473 HG13 ILE 58 HG13 ILE 58 97.770 4.361 -3.452 474 HG21 ILE 58 HG21 ILE 58 98.129 8.210 -1.659 475 HG22 ILE 58 HG22 ILE 58 96.784 7.099 -1.307 476 HG23 ILE 58 HG23 ILE 58 98.392 6.800 -0.604 477 HD11 ILE 58 HD11 ILE 58 97.076 3.406 -1.431 478 HD12 ILE 58 HD12 ILE 58 98.267 4.601 -0.866 479 HD13 ILE 58 HD13 ILE 58 96.527 4.964 -0.768 480 H GLU 59 H GLU 59 98.962 8.996 -2.537 481 HA GLU 59 HA GLU 59 101.576 9.161 -3.985 482 HB2 GLU 59 HB3 GLU 59 101.385 11.439 -4.581 483 HB3 GLU 59 HB2 GLU 59 99.786 10.780 -5.000 484 HG2 GLU 59 HG3 GLU 59 99.194 11.447 -2.502 485 HG3 GLU 59 HG2 GLU 59 100.578 12.551 -2.688 486 H CYS 60 H CYS 60 103.236 9.940 -2.631 487 HA CYS 60 HA CYS 60 102.426 11.001 0.049 488 HB2 CYS 60 HB2 CYS 60 103.521 8.279 -0.473 489 HB3 CYS 60 HB3 CYS 60 104.305 9.181 0.846 490 HG CYS 60 HG CYS 60 101.154 9.765 1.330 491 H VAL 61 H VAL 61 103.604 12.851 0.073 492 HA VAL 61 HA VAL 61 106.344 12.858 -1.121 493 HB VAL 61 HB VAL 61 105.334 15.214 0.414 494 HG11 VAL 61 HG11 VAL 61 106.131 16.360 -1.678 495 HG12 VAL 61 HG12 VAL 61 106.535 14.763 -2.352 496 HG13 VAL 61 HG13 VAL 61 107.384 15.359 -0.906 497 HG21 VAL 61 HG21 VAL 61 103.865 15.811 -1.613 498 HG22 VAL 61 HG22 VAL 61 103.951 14.087 -2.049 499 HG23 VAL 61 HG23 VAL 61 103.217 14.578 -0.504 500 H PHE 62 H PHE 62 108.259 13.174 0.186 501 HA PHE 62 HA PHE 62 107.878 13.466 3.104 502 HB2 PHE 62 HB2 PHE 62 108.540 11.318 3.816 503 HB3 PHE 62 HB3 PHE 62 107.408 10.990 2.484 504 HD1 PHE 62 HD1 PHE 62 111.048 11.363 3.281 505 HD2 PHE 62 HD2 PHE 62 108.106 9.780 0.582 506 HE1 PHE 62 HE1 PHE 62 112.822 10.108 2.084 507 HE2 PHE 62 HE2 PHE 62 109.879 8.526 -0.617 508 HZ PHE 62 HZ PHE 62 112.237 8.691 0.134 509 H GLU 63 H GLU 63 109.824 13.752 4.268 510 HA GLU 63 HA GLU 63 112.295 14.066 2.551 511 HB2 GLU 63 HB3 GLU 63 111.606 16.312 2.870 512 HB3 GLU 63 HB2 GLU 63 111.015 15.991 4.518 513 HG2 GLU 63 HG2 GLU 63 113.161 16.019 5.439 514 HG3 GLU 63 HG3 GLU 63 113.939 15.567 3.904 515 H LEU 64 H LEU 64 113.928 12.827 3.383 516 HA LEU 64 HA LEU 64 113.639 11.309 5.793 517 HB2 LEU 64 HB2 LEU 64 115.992 10.762 5.558 518 HB3 LEU 64 HB3 LEU 64 115.283 10.854 3.929 519 HG LEU 64 HG LEU 64 116.065 13.452 4.269 520 HD11 LEU 64 HD11 LEU 64 117.098 12.962 6.473 521 HD12 LEU 64 HD12 LEU 64 118.332 13.427 5.278 522 HD13 LEU 64 HD13 LEU 64 118.118 11.715 5.717 523 HD21 LEU 64 HD21 LEU 64 116.568 11.969 2.343 524 HD22 LEU 64 HD22 LEU 64 117.809 11.136 3.309 525 HD23 LEU 64 HD23 LEU 64 118.024 12.848 2.870 526 H GLY 65 H GLY 65 113.796 11.857 7.901 527 HA2 GLY 65 HA3 GLY 65 115.175 12.993 9.665 528 HA3 GLY 65 HA2 GLY 65 115.336 14.378 8.561 529 H VAL 66 H VAL 66 112.208 13.193 8.240 530 HA VAL 66 HA VAL 66 111.166 14.773 10.573 531 HB VAL 66 HB VAL 66 110.248 15.296 7.715 532 HG11 VAL 66 HG11 VAL 66 108.577 15.709 9.500 533 HG12 VAL 66 HG12 VAL 66 109.130 17.238 8.775 534 HG13 VAL 66 HG13 VAL 66 109.753 16.730 10.363 535 HG21 VAL 66 HG21 VAL 66 111.413 17.559 8.176 536 HG22 VAL 66 HG22 VAL 66 112.466 16.172 7.810 537 HG23 VAL 66 HG23 VAL 66 112.265 16.716 9.492 538 H THR 67 H THR 67 109.811 13.340 11.542 539 HA THR 67 HA THR 67 108.710 11.012 10.311 540 HB THR 67 HB THR 67 107.179 12.467 12.467 541 HG1 THR 67 HG1 THR 67 109.245 12.744 13.190 542 HG21 THR 67 HG21 THR 67 106.661 10.291 13.214 543 HG22 THR 67 HG22 THR 67 108.081 9.575 12.414 544 HG23 THR 67 HG23 THR 67 106.684 10.103 11.444 545 H PHE 68 H PHE 68 106.734 10.528 9.430 546 HA PHE 68 HA PHE 68 104.686 12.634 9.065 547 HB2 PHE 68 HB2 PHE 68 104.818 11.941 6.456 548 HB3 PHE 68 HB3 PHE 68 105.683 13.350 7.113 549 HD1 PHE 68 HD1 PHE 68 106.151 9.629 6.754 550 HD2 PHE 68 HD2 PHE 68 107.939 13.531 6.645 551 HE1 PHE 68 HE1 PHE 68 108.316 8.620 6.078 552 HE2 PHE 68 HE2 PHE 68 110.102 12.523 5.981 553 HZ PHE 68 HZ PHE 68 110.290 10.067 5.695 554 H ASN 69 H ASN 69 103.104 11.414 7.168 555 HA ASN 69 HA ASN 69 102.937 8.563 8.135 556 HB2 ASN 69 HB2 ASN 69 100.345 9.958 7.713 557 HB3 ASN 69 HB3 ASN 69 100.826 8.800 8.976 558 HD21 ASN 69 HD21 ASN 69 101.528 12.214 7.940 559 HD22 ASN 69 HD22 ASN 69 101.674 12.822 9.573 560 H CYS 70 H CYS 70 101.848 7.131 6.698 561 HA CYS 70 HA CYS 70 100.914 8.157 4.077 562 HB2 CYS 70 HB2 CYS 70 103.446 8.003 3.872 563 HB3 CYS 70 HB3 CYS 70 103.295 6.255 4.171 564 HG CYS 70 HG CYS 70 102.460 5.571 1.750 565 H ASN 71 H ASN 71 99.312 6.792 3.366 566 HA ASN 71 HA ASN 71 98.964 4.275 4.962 567 HB2 ASN 71 HB2 ASN 71 96.702 4.289 3.661 568 HB3 ASN 71 HB3 ASN 71 96.955 5.510 4.931 569 HD21 ASN 71 HD21 ASN 71 98.690 5.731 1.837 570 HD22 ASN 71 HD22 ASN 71 97.798 7.112 1.238 571 H LEU 72 H LEU 72 98.800 2.236 4.016 572 HA LEU 72 HA LEU 72 100.019 2.079 1.275 573 HB2 LEU 72 HB2 LEU 72 99.533 0.005 3.453 574 HB3 LEU 72 HB3 LEU 72 100.186 -0.391 1.846 575 HG LEU 72 HG LEU 72 101.465 1.812 3.471 576 HD11 LEU 72 HD11 LEU 72 102.280 -1.108 3.706 577 HD12 LEU 72 HD12 LEU 72 101.173 -0.342 4.871 578 HD13 LEU 72 HD13 LEU 72 102.832 0.275 4.682 579 HD21 LEU 72 HD21 LEU 72 102.131 1.432 1.110 580 HD22 LEU 72 HD22 LEU 72 102.507 -0.265 1.490 581 HD23 LEU 72 HD23 LEU 72 103.465 1.044 2.222 582 H ALA 73 H ALA 73 99.013 0.969 -0.432 583 HA ALA 73 HA ALA 73 96.291 1.276 -0.890 584 HB1 ALA 73 HB1 ALA 73 96.451 -0.589 -2.516 585 HB2 ALA 73 HB2 ALA 73 97.974 -1.115 -1.760 586 HB3 ALA 73 HB3 ALA 73 97.891 0.455 -2.593 587 H ASP 74 H ASP 74 97.833 -1.349 0.955 588 HA ASP 74 HA ASP 74 95.549 -3.068 1.169 589 HB2 ASP 74 HB3 ASP 74 98.018 -3.358 2.032 590 HB3 ASP 74 HB2 ASP 74 97.404 -2.584 3.513 591 H GLY 75 H GLY 75 95.597 0.126 1.884 592 HA2 GLY 75 HA2 GLY 75 93.958 1.416 3.025 593 HA3 GLY 75 HA3 GLY 75 93.180 -0.095 3.554 594 H THR 76 H THR 76 96.611 0.389 4.094 595 HA THR 76 HA THR 76 96.015 0.481 7.039 596 HB THR 76 HB THR 76 98.827 0.229 6.169 597 HG1 THR 76 HG1 THR 76 97.892 -0.942 4.488 598 HG21 THR 76 HG21 THR 76 98.751 -1.635 7.799 599 HG22 THR 76 HG22 THR 76 96.984 -1.462 7.913 600 HG23 THR 76 HG23 THR 76 98.045 -0.153 8.486 601 H GLU 77 H GLU 77 97.403 1.889 8.374 602 HA GLU 77 HA GLU 77 98.389 4.314 6.873 603 HB2 GLU 77 HB3 GLU 77 96.040 4.565 7.942 604 HB3 GLU 77 HB2 GLU 77 96.886 4.500 9.506 605 HG2 GLU 77 HG3 GLU 77 98.288 6.412 8.855 606 HG3 GLU 77 HG2 GLU 77 97.518 6.453 7.251 607 H LEU 78 H LEU 78 100.509 4.661 7.418 608 HA LEU 78 HA LEU 78 101.299 4.014 10.263 609 HB2 LEU 78 HB2 LEU 78 103.177 3.431 7.963 610 HB3 LEU 78 HB3 LEU 78 103.204 2.789 9.622 611 HG LEU 78 HG LEU 78 100.786 1.858 8.858 612 HD11 LEU 78 HD11 LEU 78 100.950 2.865 6.597 613 HD12 LEU 78 HD12 LEU 78 100.919 1.088 6.505 614 HD13 LEU 78 HD13 LEU 78 102.456 1.963 6.305 615 HD21 LEU 78 HD21 LEU 78 102.688 0.523 9.728 616 HD22 LEU 78 HD22 LEU 78 103.470 0.597 8.131 617 HD23 LEU 78 HD23 LEU 78 101.933 -0.278 8.329 618 H ARG 79 H ARG 79 103.338 5.094 10.916 619 HA ARG 79 HA ARG 79 104.112 7.419 9.185 620 HB2 ARG 79 HB2 ARG 79 102.761 8.789 10.394 621 HB3 ARG 79 HB3 ARG 79 102.510 7.569 11.662 622 HG2 ARG 79 HG2 ARG 79 104.601 8.150 12.735 623 HG3 ARG 79 HG3 ARG 79 105.069 9.199 11.376 624 HD2 ARG 79 HD2 ARG 79 102.436 9.820 12.631 625 HD3 ARG 79 HD3 ARG 79 103.863 10.118 13.653 626 HE ARG 79 HE ARG 79 104.529 11.263 11.169 627 HH11 ARG 79 HH11 ARG 79 104.087 13.435 10.734 628 HH12 ARG 79 HH12 ARG 79 102.817 14.262 11.607 629 HH21 ARG 79 HH21 ARG 79 101.960 11.476 13.510 630 HH22 ARG 79 HH22 ARG 79 101.618 13.158 13.172 631 H GLY 80 H GLY 80 106.215 8.213 9.635 632 HA2 GLY 80 HA2 GLY 80 107.831 7.660 11.871 633 HA3 GLY 80 HA3 GLY 80 108.015 6.243 10.804 634 H THR 81 H THR 81 109.659 6.431 9.345 635 HA THR 81 HA THR 81 109.955 8.645 7.568 636 HB THR 81 HB THR 81 112.314 9.106 9.158 637 HG1 THR 81 HG1 THR 81 111.433 9.714 11.080 638 HG21 THR 81 HG21 THR 81 111.395 11.436 9.159 639 HG22 THR 81 HG22 THR 81 111.383 10.687 7.545 640 HG23 THR 81 HG23 THR 81 109.875 10.803 8.484 641 H TRP 82 H TRP 82 111.909 8.560 6.283 642 HA TRP 82 HA TRP 82 113.187 5.833 6.434 643 HB2 TRP 82 HB3 TRP 82 113.433 7.807 4.137 644 HB3 TRP 82 HB2 TRP 82 113.685 6.046 4.114 645 HD1 TRP 82 HD1 TRP 82 110.900 8.670 4.366 646 HE1 TRP 82 HE1 TRP 82 108.659 7.608 3.673 647 HE3 TRP 82 HE3 TRP 82 112.443 3.839 3.821 648 HZ2 TRP 82 HZ2 TRP 82 107.684 4.981 2.952 649 HZ3 TRP 82 HZ3 TRP 82 110.848 2.078 3.120 650 HH2 TRP 82 HH2 TRP 82 108.472 2.642 2.685 651 H SER 83 H SER 83 115.420 5.632 6.613 652 HA SER 83 HA SER 83 117.009 8.192 6.685 653 HB2 SER 83 HB2 SER 83 117.716 6.167 8.753 654 HB3 SER 83 HB3 SER 83 117.683 7.944 8.864 655 HG SER 83 HG SER 83 115.994 7.140 10.112 656 H LEU 84 H LEU 84 119.356 7.758 6.354 657 HA LEU 84 HA LEU 84 119.639 5.231 4.767 658 HB2 LEU 84 HB3 LEU 84 120.648 6.740 3.394 659 HB3 LEU 84 HB2 LEU 84 120.817 7.937 4.698 660 HG LEU 84 HG LEU 84 122.747 6.571 5.593 661 HD11 LEU 84 HD11 LEU 84 123.285 5.253 3.040 662 HD12 LEU 84 HD12 LEU 84 123.277 4.569 4.683 663 HD13 LEU 84 HD13 LEU 84 121.762 4.673 3.755 664 HD21 LEU 84 HD21 LEU 84 124.337 7.350 3.855 665 HD22 LEU 84 HD22 LEU 84 123.096 8.581 4.186 666 HD23 LEU 84 HD23 LEU 84 122.984 7.577 2.721 667 H GLU 85 H GLU 85 120.742 3.525 5.568 668 HA GLU 85 HA GLU 85 122.598 4.028 7.898 669 HB2 GLU 85 HB2 GLU 85 121.721 2.204 9.109 670 HB3 GLU 85 HB3 GLU 85 120.258 2.960 8.434 671 HG2 GLU 85 HG2 GLU 85 120.428 1.344 6.484 672 HG3 GLU 85 HG3 GLU 85 121.736 0.517 7.363 673 H GLY 86 H GLY 86 124.602 3.148 7.558 674 HA2 GLY 86 HA2 GLY 86 126.295 2.005 6.352 675 HA3 GLY 86 HA3 GLY 86 125.128 0.661 6.280 676 H ASN 87 H ASN 87 124.305 0.136 4.293 677 HA ASN 87 HA ASN 87 124.588 2.231 2.125 678 HB2 ASN 87 HB2 ASN 87 126.191 0.125 2.149 679 HB3 ASN 87 HB3 ASN 87 124.760 -0.718 1.509 680 HD21 ASN 87 HD21 ASN 87 127.320 -0.070 0.069 681 HD22 ASN 87 HD22 ASN 87 126.842 0.916 -1.295 682 H LYS 88 H LYS 88 122.186 1.647 3.775 683 HA LYS 88 HA LYS 88 120.417 0.904 1.460 684 HB2 LYS 88 HB2 LYS 88 119.125 -0.272 3.630 685 HB3 LYS 88 HB3 LYS 88 120.052 -1.139 2.381 686 HG2 LYS 88 HG2 LYS 88 122.028 -1.168 3.719 687 HG3 LYS 88 HG3 LYS 88 121.386 0.062 4.834 688 HD2 LYS 88 HD2 LYS 88 119.741 -1.487 5.705 689 HD3 LYS 88 HD3 LYS 88 120.143 -2.694 4.460 690 HE2 LYS 88 HE2 LYS 88 122.447 -2.862 5.384 691 HE3 LYS 88 HE3 LYS 88 122.019 -1.680 6.644 692 HZ1 LYS 88 HZ1 LYS 88 121.792 -3.941 7.430 693 HZ2 LYS 88 HZ2 LYS 88 120.715 -4.296 6.233 694 HZ3 LYS 88 HZ3 LYS 88 120.318 -3.201 7.401 695 H LEU 89 H LEU 89 118.213 1.673 1.710 696 HA LEU 89 HA LEU 89 118.105 4.076 3.517 697 HB2 LEU 89 HB3 LEU 89 116.631 3.190 1.027 698 HB3 LEU 89 HB2 LEU 89 115.889 4.390 2.112 699 HG LEU 89 HG LEU 89 118.763 4.759 1.274 700 HD11 LEU 89 HD11 LEU 89 117.541 4.287 -0.832 701 HD12 LEU 89 HD12 LEU 89 116.324 5.512 -0.399 702 HD13 LEU 89 HD13 LEU 89 118.002 6.003 -0.731 703 HD21 LEU 89 HD21 LEU 89 117.722 6.236 2.972 704 HD22 LEU 89 HD22 LEU 89 118.108 7.140 1.488 705 HD23 LEU 89 HD23 LEU 89 116.430 6.649 1.819 706 H ILE 90 H ILE 90 117.280 3.610 5.509 707 HA ILE 90 HA ILE 90 115.452 1.313 5.824 708 HB ILE 90 HB ILE 90 115.330 2.433 8.243 709 HG12 ILE 90 HG12 ILE 90 117.974 3.446 7.133 710 HG13 ILE 90 HG13 ILE 90 116.548 4.480 7.405 711 HG21 ILE 90 HG21 ILE 90 116.281 0.239 7.802 712 HG22 ILE 90 HG22 ILE 90 117.454 1.168 8.765 713 HG23 ILE 90 HG23 ILE 90 117.702 0.966 7.014 714 HD11 ILE 90 HD11 ILE 90 118.082 4.549 9.346 715 HD12 ILE 90 HD12 ILE 90 117.945 2.783 9.515 716 HD13 ILE 90 HD13 ILE 90 116.521 3.816 9.785 717 H GLY 91 H GLY 91 113.412 1.555 7.026 718 HA2 GLY 91 HA2 GLY 91 111.990 4.155 6.607 719 HA3 GLY 91 HA3 GLY 91 111.345 2.725 5.762 720 H LYS 92 H LYS 92 111.750 4.310 8.852 721 HA LYS 92 HA LYS 92 110.651 1.962 10.321 722 HB2 LYS 92 HB2 LYS 92 110.914 3.338 12.311 723 HB3 LYS 92 HB3 LYS 92 112.382 3.513 11.319 724 HG2 LYS 92 HG2 LYS 92 110.911 5.527 10.269 725 HG3 LYS 92 HG3 LYS 92 110.216 5.498 11.906 726 HD2 LYS 92 HD2 LYS 92 113.211 5.589 11.345 727 HD3 LYS 92 HD3 LYS 92 112.220 7.038 11.636 728 HE2 LYS 92 HE2 LYS 92 112.085 4.747 13.595 729 HE3 LYS 92 HE3 LYS 92 113.478 5.854 13.650 730 HZ1 LYS 92 HZ1 LYS 92 111.685 6.609 15.063 731 HZ2 LYS 92 HZ2 LYS 92 110.641 6.659 13.788 732 HZ3 LYS 92 HZ3 LYS 92 111.931 7.686 13.838 733 H PHE 93 H PHE 93 108.539 1.611 9.777 734 HA PHE 93 HA PHE 93 106.688 3.997 9.964 735 HB2 PHE 93 HB3 PHE 93 106.708 1.547 8.198 736 HB3 PHE 93 HB2 PHE 93 105.154 2.302 8.618 737 HD1 PHE 93 HD1 PHE 93 107.357 4.950 8.799 738 HD2 PHE 93 HD2 PHE 93 105.598 2.346 5.870 739 HE1 PHE 93 HE1 PHE 93 107.720 6.670 7.052 740 HE2 PHE 93 HE2 PHE 93 105.959 4.069 4.123 741 HZ PHE 93 HZ PHE 93 107.021 6.231 4.715 742 H LYS 94 H LYS 94 104.883 3.825 11.235 743 HA LYS 94 HA LYS 94 104.506 1.202 12.676 744 HB2 LYS 94 HB2 LYS 94 104.351 2.275 14.799 745 HB3 LYS 94 HB3 LYS 94 105.800 2.969 14.034 746 HG2 LYS 94 HG2 LYS 94 104.235 4.832 13.161 747 HG3 LYS 94 HG3 LYS 94 103.045 4.215 14.333 748 HD2 LYS 94 HD2 LYS 94 104.820 4.457 16.127 749 HD3 LYS 94 HD3 LYS 94 105.840 5.278 14.922 750 HE2 LYS 94 HE2 LYS 94 104.359 7.112 14.739 751 HE3 LYS 94 HE3 LYS 94 103.002 6.204 15.449 752 HZ1 LYS 94 HZ1 LYS 94 103.960 7.749 17.024 753 HZ2 LYS 94 HZ2 LYS 94 105.443 7.041 16.884 754 HZ3 LYS 94 HZ3 LYS 94 104.187 6.199 17.542 755 H ARG 95 H ARG 95 102.441 0.528 12.483 756 HA ARG 95 HA ARG 95 100.406 1.836 11.072 757 HB2 ARG 95 HB2 ARG 95 100.462 -0.246 13.218 758 HB3 ARG 95 HB3 ARG 95 98.894 0.546 12.936 759 HG2 ARG 95 HG3 ARG 95 99.134 0.037 10.487 760 HG3 ARG 95 HG2 ARG 95 100.624 -0.863 10.856 761 HD2 ARG 95 HD2 ARG 95 99.480 -2.576 11.949 762 HD3 ARG 95 HD3 ARG 95 98.112 -1.526 12.387 763 HE ARG 95 HE ARG 95 98.220 -1.782 9.507 764 HH11 ARG 95 HH11 ARG 95 96.740 -3.188 8.540 765 HH12 ARG 95 HH12 ARG 95 95.959 -4.429 9.495 766 HH21 ARG 95 HH21 ARG 95 97.576 -3.535 12.446 767 HH22 ARG 95 HH22 ARG 95 96.430 -4.624 11.696 768 H THR 96 H THR 96 99.539 3.829 11.384 769 HA THR 96 HA THR 96 99.815 5.212 13.946 770 HB THR 96 HB THR 96 97.781 6.480 12.448 771 HG1 THR 96 HG1 THR 96 99.851 5.445 10.773 772 HG21 THR 96 HG21 THR 96 99.593 8.084 11.930 773 HG22 THR 96 HG22 THR 96 99.677 7.549 13.625 774 HG23 THR 96 HG23 THR 96 100.803 6.876 12.422 775 H ASP 97 H ASP 97 97.819 2.830 12.870 776 HA ASP 97 HA ASP 97 95.402 3.670 14.388 777 HB2 ASP 97 HB2 ASP 97 95.453 2.287 12.187 778 HB3 ASP 97 HB3 ASP 97 95.927 0.917 13.222 779 H ASN 98 H ASN 98 97.950 1.151 14.589 780 HA ASN 98 HA ASN 98 97.297 0.960 17.531 781 HB2 ASN 98 HB2 ASN 98 97.981 -1.381 15.699 782 HB3 ASN 98 HB3 ASN 98 97.631 -1.470 17.441 783 HD21 ASN 98 HD21 ASN 98 95.396 0.093 17.794 784 HD22 ASN 98 HD22 ASN 98 94.076 -0.485 16.802 785 H GLY 99 H GLY 99 99.521 1.991 15.418 786 HA2 GLY 99 HA3 GLY 99 101.891 2.116 15.441 787 HA3 GLY 99 HA2 GLY 99 101.688 2.126 17.209 788 H ASN 100 H ASN 100 101.011 -0.467 14.813 789 HA ASN 100 HA ASN 100 102.285 -2.441 16.570 790 HB2 ASN 100 HB2 ASN 100 100.951 -2.451 13.887 791 HB3 ASN 100 HB3 ASN 100 102.067 -3.790 14.246 792 HD21 ASN 100 HD21 ASN 100 98.958 -3.598 14.113 793 HD22 ASN 100 HD22 ASN 100 98.451 -4.312 15.627 794 H GLU 101 H GLU 101 103.713 -0.055 15.113 795 HA GLU 101 HA GLU 101 105.852 0.328 14.199 796 HB2 GLU 101 HB2 GLU 101 106.107 -1.947 16.120 797 HB3 GLU 101 HB3 GLU 101 107.494 -1.655 15.043 798 HG2 GLU 101 HG2 GLU 101 107.609 0.685 15.767 799 HG3 GLU 101 HG3 GLU 101 106.151 0.476 16.766 800 H LEU 102 H LEU 102 107.162 -0.133 12.444 801 HA LEU 102 HA LEU 102 107.010 -2.827 11.161 802 HB2 LEU 102 HB3 LEU 102 105.076 -1.539 10.196 803 HB3 LEU 102 HB2 LEU 102 106.221 -0.289 9.653 804 HG LEU 102 HG LEU 102 106.629 -3.200 8.898 805 HD11 LEU 102 HD11 LEU 102 104.322 -2.588 8.217 806 HD12 LEU 102 HD12 LEU 102 104.952 -1.140 7.396 807 HD13 LEU 102 HD13 LEU 102 105.388 -2.760 6.802 808 HD21 LEU 102 HD21 LEU 102 107.408 -1.586 6.793 809 HD22 LEU 102 HD22 LEU 102 108.494 -2.168 8.077 810 HD23 LEU 102 HD23 LEU 102 107.764 -0.549 8.195 811 H ASN 103 H ASN 103 109.066 -3.300 10.483 812 HA ASN 103 HA ASN 103 110.918 -0.930 10.113 813 HB2 ASN 103 HB2 ASN 103 111.233 -2.943 11.904 814 HB3 ASN 103 HB3 ASN 103 112.033 -3.682 10.495 815 HD21 ASN 103 HD21 ASN 103 114.244 -3.409 10.992 816 HD22 ASN 103 HD22 ASN 103 114.971 -1.855 11.335 817 H THR 104 H THR 104 111.216 -0.521 7.979 818 HA THR 104 HA THR 104 111.481 -2.937 6.177 819 HB THR 104 HB THR 104 109.387 -1.870 5.647 820 HG1 THR 104 HG1 THR 104 110.107 -2.152 3.670 821 HG21 THR 104 HG21 THR 104 109.609 0.674 4.931 822 HG22 THR 104 HG22 THR 104 111.034 0.635 5.997 823 HG23 THR 104 HG23 THR 104 109.425 0.243 6.648 824 H VAL 105 H VAL 105 112.511 -2.177 3.992 825 HA VAL 105 HA VAL 105 114.601 -0.077 4.400 826 HB VAL 105 HB VAL 105 115.256 -2.990 3.770 827 HG11 VAL 105 HG11 VAL 105 117.654 -1.931 4.064 828 HG12 VAL 105 HG12 VAL 105 116.825 -0.407 3.666 829 HG13 VAL 105 HG13 VAL 105 116.807 -1.758 2.508 830 HG21 VAL 105 HG21 VAL 105 116.584 -2.808 5.895 831 HG22 VAL 105 HG22 VAL 105 115.877 -1.196 6.158 832 HG23 VAL 105 HG23 VAL 105 114.831 -2.636 6.156 833 H ARG 106 H ARG 106 115.596 0.556 2.352 834 HA ARG 106 HA ARG 106 114.082 -0.502 -0.049 835 HB2 ARG 106 HB2 ARG 106 114.534 2.308 0.909 836 HB3 ARG 106 HB3 ARG 106 114.600 2.018 -0.845 837 HG2 ARG 106 HG2 ARG 106 112.372 0.948 -0.762 838 HG3 ARG 106 HG3 ARG 106 112.307 1.205 0.998 839 HD2 ARG 106 HD3 ARG 106 111.172 2.941 -0.677 840 HD3 ARG 106 HD2 ARG 106 112.008 3.504 0.790 841 HE ARG 106 HE ARG 106 114.080 3.616 -0.941 842 HH11 ARG 106 HH11 ARG 106 114.468 5.191 -2.512 843 HH12 ARG 106 HH12 ARG 106 113.131 6.068 -3.222 844 HH21 ARG 106 HH21 ARG 106 110.710 4.400 -1.358 845 HH22 ARG 106 HH22 ARG 106 111.014 5.622 -2.572 846 H GLU 107 H GLU 107 115.376 -1.169 -1.690 847 HA GLU 107 HA GLU 107 118.223 -0.140 -1.715 848 HB2 GLU 107 HB2 GLU 107 117.352 -3.000 -2.321 849 HB3 GLU 107 HB3 GLU 107 119.018 -2.373 -2.323 850 HG2 GLU 107 HG3 GLU 107 119.068 -2.138 0.016 851 HG3 GLU 107 HG2 GLU 107 117.293 -2.096 0.148 852 H ILE 108 H ILE 108 119.227 -0.258 -3.884 853 HA ILE 108 HA ILE 108 117.123 -0.199 -6.056 854 HB ILE 108 HB ILE 108 119.738 1.359 -5.952 855 HG12 ILE 108 HG12 ILE 108 117.630 1.823 -4.262 856 HG13 ILE 108 HG13 ILE 108 118.707 3.098 -4.875 857 HG21 ILE 108 HG21 ILE 108 118.972 1.038 -8.199 858 HG22 ILE 108 HG22 ILE 108 117.283 1.362 -7.741 859 HG23 ILE 108 HG23 ILE 108 118.475 2.684 -7.737 860 HD11 ILE 108 HD11 ILE 108 116.201 3.544 -5.138 861 HD12 ILE 108 HD12 ILE 108 116.181 2.226 -6.334 862 HD13 ILE 108 HD13 ILE 108 117.165 3.680 -6.628 863 H ILE 109 H ILE 109 117.598 -2.496 -6.348 864 HA ILE 109 HA ILE 109 120.288 -3.421 -6.897 865 HB ILE 109 HB ILE 109 117.510 -4.469 -7.467 866 HG12 ILE 109 HG12 ILE 109 119.934 -5.608 -6.003 867 HG13 ILE 109 HG13 ILE 109 118.601 -4.723 -5.225 868 HG21 ILE 109 HG21 ILE 109 119.209 -6.540 -8.205 869 HG22 ILE 109 HG22 ILE 109 118.294 -5.513 -9.335 870 HG23 ILE 109 HG23 ILE 109 119.987 -5.121 -8.946 871 HD11 ILE 109 HD11 ILE 109 118.624 -7.476 -6.439 872 HD12 ILE 109 HD12 ILE 109 117.842 -6.901 -4.947 873 HD13 ILE 109 HD13 ILE 109 117.119 -6.530 -6.531 874 H GLY 110 H GLY 110 121.270 -1.959 -8.305 875 HA2 GLY 110 HA2 GLY 110 121.799 -1.011 -10.403 876 HA3 GLY 110 HA3 GLY 110 121.178 -2.536 -11.075 877 H ASP 111 H ASP 111 118.832 -2.654 -11.545 878 HA ASP 111 HA ASP 111 117.662 0.103 -11.984 879 HB2 ASP 111 HB2 ASP 111 116.638 -0.842 -14.081 880 HB3 ASP 111 HB3 ASP 111 118.415 -0.760 -14.130 881 H GLU 112 H GLU 112 117.226 -1.866 -9.779 882 HA GLU 112 HA GLU 112 114.242 -2.069 -10.157 883 HB2 GLU 112 HB2 GLU 112 116.057 -4.270 -9.075 884 HB3 GLU 112 HB3 GLU 112 114.277 -4.304 -9.044 885 HG2 GLU 112 HG3 GLU 112 114.310 -4.021 -11.561 886 HG3 GLU 112 HG2 GLU 112 116.078 -4.223 -11.503 887 H LEU 113 H LEU 113 113.057 -1.794 -8.176 888 HA LEU 113 HA LEU 113 114.824 -0.761 -5.943 889 HB2 LEU 113 HB2 LEU 113 113.202 0.864 -6.945 890 HB3 LEU 113 HB3 LEU 113 111.869 -0.209 -6.458 891 HG LEU 113 HG LEU 113 112.976 -0.040 -4.068 892 HD11 LEU 113 HD11 LEU 113 115.001 1.164 -4.849 893 HD12 LEU 113 HD12 LEU 113 114.071 2.159 -3.703 894 HD13 LEU 113 HD13 LEU 113 113.980 2.493 -5.448 895 HD21 LEU 113 HD21 LEU 113 111.583 1.963 -3.609 896 HD22 LEU 113 HD22 LEU 113 111.496 2.301 -5.354 897 HD23 LEU 113 HD23 LEU 113 110.737 0.832 -4.694 898 H VAL 114 H VAL 114 115.111 -2.267 -4.389 899 HA VAL 114 HA VAL 114 112.917 -4.259 -3.922 900 HB VAL 114 HB VAL 114 115.591 -4.150 -2.490 901 HG11 VAL 114 HG11 VAL 114 113.859 -5.717 -1.651 902 HG12 VAL 114 HG12 VAL 114 113.713 -6.424 -3.277 903 HG13 VAL 114 HG13 VAL 114 115.232 -6.597 -2.364 904 HG21 VAL 114 HG21 VAL 114 116.203 -5.876 -4.384 905 HG22 VAL 114 HG22 VAL 114 116.356 -4.133 -4.707 906 HG23 VAL 114 HG23 VAL 114 114.941 -5.028 -5.309 907 H GLN 115 H GLN 115 111.391 -3.688 -2.472 908 HA GLN 115 HA GLN 115 112.295 -2.003 -0.124 909 HB2 GLN 115 HB2 GLN 115 110.557 -1.024 -1.743 910 HB3 GLN 115 HB3 GLN 115 109.449 -2.294 -1.170 911 HG2 GLN 115 HG2 GLN 115 109.335 -1.403 0.994 912 HG3 GLN 115 HG3 GLN 115 110.896 -0.562 0.839 913 HE21 GLN 115 HE21 GLN 115 107.768 0.207 1.223 914 HE22 GLN 115 HE22 GLN 115 107.649 1.618 0.195 915 H THR 116 H THR 116 112.724 -3.519 1.449 916 HA THR 116 HA THR 116 110.729 -5.757 1.760 917 HB THR 116 HB THR 116 113.243 -5.612 3.394 918 HG1 THR 116 HG1 THR 116 114.080 -5.115 1.397 919 HG21 THR 116 HG21 THR 116 113.186 -8.055 2.967 920 HG22 THR 116 HG22 THR 116 111.641 -7.478 3.636 921 HG23 THR 116 HG23 THR 116 111.781 -7.831 1.897 922 H TYR 117 H TYR 117 109.675 -6.100 3.718 923 HA TYR 117 HA TYR 117 110.092 -3.942 5.790 924 HB2 TYR 117 HB3 TYR 117 107.359 -5.133 5.500 925 HB3 TYR 117 HB2 TYR 117 107.843 -3.496 6.004 926 HD1 TYR 117 HD1 TYR 117 108.113 -5.721 3.015 927 HD2 TYR 117 HD2 TYR 117 107.400 -1.772 4.516 928 HE1 TYR 117 HE1 TYR 117 107.696 -4.925 0.705 929 HE2 TYR 117 HE2 TYR 117 106.983 -0.962 2.211 930 HH TYR 117 HH TYR 117 107.520 -3.025 -0.605 931 H VAL 118 H VAL 118 109.674 -4.547 7.911 932 HA VAL 118 HA VAL 118 109.555 -7.539 8.362 933 HB VAL 118 HB VAL 118 110.847 -5.521 10.230 934 HG11 VAL 118 HG11 VAL 118 111.563 -7.368 11.437 935 HG12 VAL 118 HG12 VAL 118 111.584 -8.427 10.007 936 HG13 VAL 118 HG13 VAL 118 110.038 -8.012 10.785 937 HG21 VAL 118 HG21 VAL 118 112.028 -5.456 8.055 938 HG22 VAL 118 HG22 VAL 118 113.024 -6.236 9.307 939 HG23 VAL 118 HG23 VAL 118 112.186 -7.228 8.090 940 H TYR 119 H TYR 119 108.310 -8.207 10.135 941 HA TYR 119 HA TYR 119 106.773 -6.044 11.523 942 HB2 TYR 119 HB2 TYR 119 105.675 -7.205 9.323 943 HB3 TYR 119 HB3 TYR 119 105.128 -8.337 10.584 944 HD1 TYR 119 HD1 TYR 119 103.910 -7.456 12.579 945 HD2 TYR 119 HD2 TYR 119 104.746 -5.006 9.158 946 HE1 TYR 119 HE1 TYR 119 102.164 -5.852 13.305 947 HE2 TYR 119 HE2 TYR 119 103.010 -3.391 9.885 948 HH TYR 119 HH TYR 119 100.985 -3.350 11.281 949 H GLU 120 H GLU 120 107.198 -6.444 13.565 950 HA GLU 120 HA GLU 120 107.563 -7.625 15.570 951 HB2 GLU 120 HB2 GLU 120 105.143 -8.943 14.322 952 HB3 GLU 120 HB3 GLU 120 105.765 -9.483 15.900 953 HG2 GLU 120 HG3 GLU 120 103.958 -7.671 15.986 954 HG3 GLU 120 HG2 GLU 120 105.460 -7.302 16.867 955 H GLY 121 H GLY 121 108.888 -8.703 12.997 956 HA2 GLY 121 HA2 GLY 121 110.733 -10.367 13.334 957 HA3 GLY 121 HA3 GLY 121 109.576 -11.380 14.231 958 H VAL 122 H VAL 122 108.633 -9.641 11.338 959 HA VAL 122 HA VAL 122 108.683 -12.267 9.852 960 HB VAL 122 HB VAL 122 106.375 -11.097 10.635 961 HG11 VAL 122 HG11 VAL 122 106.725 -9.992 7.836 962 HG12 VAL 122 HG12 VAL 122 107.156 -9.020 9.264 963 HG13 VAL 122 HG13 VAL 122 105.484 -9.593 9.049 964 HG21 VAL 122 HG21 VAL 122 105.317 -12.261 8.721 965 HG22 VAL 122 HG22 VAL 122 106.899 -12.360 7.911 966 HG23 VAL 122 HG23 VAL 122 106.622 -13.240 9.433 967 H GLU 123 H GLU 123 108.376 -11.643 7.372 968 HA GLU 123 HA GLU 123 109.694 -9.051 6.786 969 HB2 GLU 123 HB2 GLU 123 111.635 -10.408 7.371 970 HB3 GLU 123 HB3 GLU 123 111.102 -11.703 6.272 971 HG2 GLU 123 HG2 GLU 123 111.385 -10.258 4.338 972 HG3 GLU 123 HG3 GLU 123 111.723 -8.855 5.380 973 H ALA 124 H ALA 124 108.842 -8.291 4.959 974 HA ALA 124 HA ALA 124 107.938 -10.300 2.879 975 HB1 ALA 124 HB1 ALA 124 106.550 -7.869 2.449 976 HB2 ALA 124 HB2 ALA 124 106.479 -8.150 4.206 977 HB3 ALA 124 HB3 ALA 124 105.874 -9.390 3.081 978 H LYS 125 H LYS 125 108.318 -9.622 0.635 979 HA LYS 125 HA LYS 125 110.174 -7.244 0.455 980 HB2 LYS 125 HB2 LYS 125 111.343 -9.550 0.487 981 HB3 LYS 125 HB3 LYS 125 110.634 -9.789 -1.128 982 HG2 LYS 125 HG2 LYS 125 111.875 -8.035 -2.077 983 HG3 LYS 125 HG3 LYS 125 112.134 -7.236 -0.508 984 HD2 LYS 125 HD3 LYS 125 114.232 -8.262 -1.177 985 HD3 LYS 125 HD2 LYS 125 113.566 -9.211 0.172 986 HE2 LYS 125 HE2 LYS 125 113.427 -11.068 -1.114 987 HE3 LYS 125 HE3 LYS 125 112.550 -10.185 -2.387 988 HZ1 LYS 125 HZ1 LYS 125 114.668 -11.011 -3.173 989 HZ2 LYS 125 HZ2 LYS 125 114.666 -9.362 -3.181 990 HZ3 LYS 125 HZ3 LYS 125 115.478 -10.180 -2.001 991 H ARG 126 H ARG 126 109.947 -5.972 -1.309 992 HA ARG 126 HA ARG 126 108.154 -6.950 -3.535 993 HB2 ARG 126 HB2 ARG 126 107.561 -4.874 -1.591 994 HB3 ARG 126 HB3 ARG 126 107.720 -4.146 -3.207 995 HG2 ARG 126 HG3 ARG 126 106.184 -6.014 -4.055 996 HG3 ARG 126 HG2 ARG 126 105.867 -6.403 -2.348 997 HD2 ARG 126 HD2 ARG 126 104.906 -4.126 -3.984 998 HD3 ARG 126 HD3 ARG 126 104.200 -4.858 -2.523 999 HE ARG 126 HE ARG 126 106.429 -3.521 -1.525 1000 HH11 ARG 126 HH11 ARG 126 106.369 -1.347 -0.905 1001 HH12 ARG 126 HH12 ARG 126 105.185 -0.269 -1.609 1002 HH21 ARG 126 HH21 ARG 126 103.761 -2.729 -3.620 1003 HH22 ARG 126 HH22 ARG 126 103.716 -1.048 -3.139 1004 H ILE 127 H ILE 127 109.447 -6.879 -5.335 1005 HA ILE 127 HA ILE 127 111.554 -4.710 -5.403 1006 HB ILE 127 HB ILE 127 111.427 -7.257 -7.063 1007 HG12 ILE 127 HG12 ILE 127 113.476 -7.138 -4.963 1008 HG13 ILE 127 HG13 ILE 127 111.829 -7.090 -4.289 1009 HG21 ILE 127 HG21 ILE 127 113.831 -6.769 -7.418 1010 HG22 ILE 127 HG22 ILE 127 112.810 -5.427 -7.988 1011 HG23 ILE 127 HG23 ILE 127 113.674 -5.292 -6.437 1012 HD11 ILE 127 HD11 ILE 127 112.773 -9.430 -4.625 1013 HD12 ILE 127 HD12 ILE 127 111.219 -9.130 -5.438 1014 HD13 ILE 127 HD13 ILE 127 112.731 -9.119 -6.377 1015 H PHE 128 H PHE 128 111.282 -3.081 -6.815 1016 HA PHE 128 HA PHE 128 109.203 -3.425 -8.964 1017 HB2 PHE 128 HB2 PHE 128 110.704 -0.891 -8.164 1018 HB3 PHE 128 HB3 PHE 128 109.236 -1.002 -9.160 1019 HD1 PHE 128 HD1 PHE 128 108.330 -3.394 -7.131 1020 HD2 PHE 128 HD2 PHE 128 109.345 0.752 -6.758 1021 HE1 PHE 128 HE1 PHE 128 106.919 -3.238 -5.102 1022 HE2 PHE 128 HE2 PHE 128 107.940 0.916 -4.721 1023 HZ PHE 128 HZ PHE 128 106.723 -1.081 -3.892 1024 H LYS 129 H LYS 129 109.833 -2.132 -11.059 1025 HA LYS 129 HA LYS 129 112.710 -2.181 -11.744 1026 HB2 LYS 129 HB2 LYS 129 112.157 -4.583 -11.957 1027 HB3 LYS 129 HB3 LYS 129 110.797 -4.180 -13.032 1028 HG2 LYS 129 HG3 LYS 129 112.259 -3.357 -14.740 1029 HG3 LYS 129 HG2 LYS 129 113.652 -3.320 -13.632 1030 HD2 LYS 129 HD2 LYS 129 113.793 -5.707 -13.568 1031 HD3 LYS 129 HD3 LYS 129 112.189 -5.896 -14.315 1032 HE2 LYS 129 HE2 LYS 129 114.676 -4.736 -15.649 1033 HE3 LYS 129 HE3 LYS 129 113.944 -6.323 -15.984 1034 HZ1 LYS 129 HZ1 LYS 129 111.876 -4.995 -16.503 1035 HZ2 LYS 129 HZ2 LYS 129 113.104 -4.903 -17.600 1036 HZ3 LYS 129 HZ3 LYS 129 112.842 -3.659 -16.550 1037 H LYS 130 H LYS 130 113.074 -1.282 -13.903 1038 HA LYS 130 HA LYS 130 111.440 0.929 -14.544 1039 HB2 LYS 130 HB3 LYS 130 112.448 0.641 -16.921 1040 HB3 LYS 130 HB2 LYS 130 113.580 0.854 -15.564 1041 HG2 LYS 130 HG2 LYS 130 114.063 -1.499 -15.480 1042 HG3 LYS 130 HG3 LYS 130 112.713 -1.883 -16.574 1043 HD2 LYS 130 HD3 LYS 130 113.846 -1.118 -18.463 1044 HD3 LYS 130 HD2 LYS 130 114.856 0.011 -17.528 1045 HE2 LYS 130 HE2 LYS 130 116.243 -1.855 -18.285 1046 HE3 LYS 130 HE3 LYS 130 116.041 -1.964 -16.520 1047 HZ1 LYS 130 HZ1 LYS 130 115.514 -3.941 -18.261 1048 HZ2 LYS 130 HZ2 LYS 130 114.907 -3.848 -16.730 1049 HZ3 LYS 130 HZ3 LYS 130 114.008 -3.318 -18.007 1050 H ASP 131 H ASP 131 109.469 1.168 -15.473 1051 HA ASP 131 HA ASP 131 108.054 -1.282 -16.385 1052 HB2 ASP 131 HB2 ASP 131 106.762 0.268 -15.066 1053 HB3 ASP 131 HB3 ASP 131 107.237 1.638 -16.099 Start of MODEL 10 1 H1 ALA 1 H1 ALA 1 117.918 7.792 -9.133 2 H2 ALA 1 H2 ALA 1 118.827 8.384 -7.891 3 H3 ALA 1 H3 ALA 1 117.267 8.885 -8.083 4 HA ALA 1 HA ALA 1 118.115 6.142 -7.395 5 HB1 ALA 1 HB1 ALA 1 117.591 6.609 -5.185 6 HB2 ALA 1 HB2 ALA 1 118.174 8.213 -5.691 7 HB3 ALA 1 HB3 ALA 1 116.426 7.883 -5.620 8 H PHE 2 H PHE 2 116.751 4.974 -8.728 9 HA PHE 2 HA PHE 2 114.696 4.324 -9.739 10 HB2 PHE 2 HB2 PHE 2 114.617 4.011 -7.000 11 HB3 PHE 2 HB3 PHE 2 113.157 4.986 -7.286 12 HD1 PHE 2 HD1 PHE 2 114.936 2.167 -9.060 13 HD2 PHE 2 HD2 PHE 2 111.234 3.736 -7.552 14 HE1 PHE 2 HE1 PHE 2 113.740 0.163 -9.906 15 HE2 PHE 2 HE2 PHE 2 110.043 1.731 -8.391 16 HZ PHE 2 HZ PHE 2 111.296 -0.052 -9.572 17 H ASP 3 H ASP 3 115.373 7.162 -10.057 18 HA ASP 3 HA ASP 3 112.881 8.684 -9.625 19 HB2 ASP 3 HB3 ASP 3 114.032 10.452 -10.921 20 HB3 ASP 3 HB2 ASP 3 115.106 9.789 -9.665 21 H SER 4 H SER 4 111.213 7.578 -10.725 22 HA SER 4 HA SER 4 110.586 8.285 -13.348 23 HB2 SER 4 HB3 SER 4 112.571 6.042 -13.258 24 HB3 SER 4 HB2 SER 4 111.221 5.879 -14.408 25 HG SER 4 HG SER 4 112.155 7.344 -15.609 26 H THR 5 H THR 5 109.409 6.029 -14.465 27 HA THR 5 HA THR 5 107.350 5.443 -12.374 28 HB THR 5 HB THR 5 107.478 4.892 -15.371 29 HG1 THR 5 HG1 THR 5 105.800 6.491 -15.331 30 HG21 THR 5 HG21 THR 5 104.969 4.380 -14.956 31 HG22 THR 5 HG22 THR 5 106.146 3.130 -14.491 32 HG23 THR 5 HG23 THR 5 105.427 4.181 -13.248 33 H TRP 6 H TRP 6 106.796 3.319 -11.736 34 HA TRP 6 HA TRP 6 108.441 1.064 -12.794 35 HB2 TRP 6 HB2 TRP 6 108.456 1.696 -9.823 36 HB3 TRP 6 HB3 TRP 6 109.438 0.493 -10.693 37 HD1 TRP 6 HD1 TRP 6 108.995 4.323 -10.415 38 HE1 TRP 6 HE1 TRP 6 111.232 5.467 -10.997 39 HE3 TRP 6 HE3 TRP 6 111.662 0.212 -11.826 40 HZ2 TRP 6 HZ2 TRP 6 113.838 4.675 -11.962 41 HZ3 TRP 6 HZ3 TRP 6 114.011 0.426 -12.568 42 HH2 TRP 6 HH2 TRP 6 115.105 2.651 -12.641 43 H LYS 7 H LYS 7 107.732 -1.048 -11.642 44 HA LYS 7 HA LYS 7 105.040 -0.860 -10.382 45 HB2 LYS 7 HB3 LYS 7 103.868 -2.111 -12.053 46 HB3 LYS 7 HB2 LYS 7 104.732 -0.826 -12.932 47 HG2 LYS 7 HG2 LYS 7 106.642 -2.547 -13.217 48 HG3 LYS 7 HG3 LYS 7 105.453 -3.770 -12.706 49 HD2 LYS 7 HD3 LYS 7 103.913 -2.856 -14.532 50 HD3 LYS 7 HD2 LYS 7 105.308 -1.920 -15.121 51 HE2 LYS 7 HE2 LYS 7 106.560 -3.902 -15.604 52 HE3 LYS 7 HE3 LYS 7 105.436 -4.927 -14.679 53 HZ1 LYS 7 HZ1 LYS 7 105.043 -5.086 -17.046 54 HZ2 LYS 7 HZ2 LYS 7 103.737 -4.411 -16.300 55 HZ3 LYS 7 HZ3 LYS 7 104.779 -3.462 -17.157 56 H VAL 8 H VAL 8 104.938 -2.397 -8.827 57 HA VAL 8 HA VAL 8 106.947 -4.105 -8.049 58 HB VAL 8 HB VAL 8 105.173 -4.249 -6.592 59 HG11 VAL 8 HG11 VAL 8 102.775 -4.632 -7.472 60 HG12 VAL 8 HG12 VAL 8 103.448 -4.316 -9.090 61 HG13 VAL 8 HG13 VAL 8 103.527 -3.059 -7.832 62 HG21 VAL 8 HG21 VAL 8 104.294 -6.471 -6.550 63 HG22 VAL 8 HG22 VAL 8 104.354 -6.611 -8.323 64 HG23 VAL 8 HG23 VAL 8 105.863 -6.610 -7.380 65 H ASP 9 H ASP 9 108.202 -5.252 -9.399 66 HA ASP 9 HA ASP 9 106.930 -6.825 -11.601 67 HB2 ASP 9 HB3 ASP 9 109.160 -5.451 -11.746 68 HB3 ASP 9 HB2 ASP 9 109.878 -6.837 -10.891 69 H ARG 10 H ARG 10 108.443 -7.190 -8.438 70 HA ARG 10 HA ARG 10 107.480 -10.014 -8.418 71 HB2 ARG 10 HB3 ARG 10 110.410 -9.322 -7.933 72 HB3 ARG 10 HB2 ARG 10 109.667 -10.923 -7.700 73 HG2 ARG 10 HG2 ARG 10 108.950 -10.824 -10.144 74 HG3 ARG 10 HG3 ARG 10 109.974 -9.377 -10.307 75 HD2 ARG 10 HD3 ARG 10 110.800 -12.228 -9.687 76 HD3 ARG 10 HD2 ARG 10 111.407 -11.143 -10.960 77 HE ARG 10 HE ARG 10 112.322 -11.225 -8.154 78 HH11 ARG 10 HH11 ARG 10 113.979 -9.766 -7.666 79 HH12 ARG 10 HH12 ARG 10 114.352 -8.464 -8.773 80 HH21 ARG 10 HH21 ARG 10 111.892 -9.367 -11.067 81 HH22 ARG 10 HH22 ARG 10 113.176 -8.240 -10.690 82 H SER 11 H SER 11 107.788 -10.997 -6.191 83 HA SER 11 HA SER 11 108.448 -9.352 -3.904 84 HB2 SER 11 HB3 SER 11 106.491 -8.021 -4.504 85 HB3 SER 11 HB2 SER 11 105.493 -9.488 -4.654 86 HG SER 11 HG SER 11 105.109 -9.183 -2.593 87 H GLU 12 H GLU 12 107.636 -10.452 -1.823 88 HA GLU 12 HA GLU 12 106.466 -13.133 -2.100 89 HB2 GLU 12 HB3 GLU 12 108.544 -14.334 -1.264 90 HB3 GLU 12 HB2 GLU 12 108.646 -13.746 -2.941 91 HG2 GLU 12 HG3 GLU 12 109.879 -11.748 -2.186 92 HG3 GLU 12 HG2 GLU 12 109.737 -12.284 -0.494 93 H ASN 13 H ASN 13 106.501 -14.313 0.031 94 HA ASN 13 HA ASN 13 106.067 -14.296 2.347 95 HB2 ASN 13 HB3 ASN 13 108.403 -12.459 2.004 96 HB3 ASN 13 HB2 ASN 13 107.539 -12.375 3.558 97 HD21 ASN 13 HD21 ASN 13 108.648 -13.644 5.037 98 HD22 ASN 13 HD22 ASN 13 109.272 -15.244 4.702 99 H TYR 14 H TYR 14 104.660 -12.345 0.411 100 HA TYR 14 HA TYR 14 104.038 -9.998 2.056 101 HB2 TYR 14 HB2 TYR 14 103.503 -10.897 -0.595 102 HB3 TYR 14 HB3 TYR 14 101.921 -10.652 0.182 103 HD1 TYR 14 HD1 TYR 14 105.134 -8.854 0.862 104 HD2 TYR 14 HD2 TYR 14 101.170 -8.625 -0.773 105 HE1 TYR 14 HE1 TYR 14 105.386 -6.401 0.600 106 HE2 TYR 14 HE2 TYR 14 101.420 -6.171 -1.034 107 HH TYR 14 HH TYR 14 103.528 -4.344 0.484 108 H ASP 15 H ASP 15 102.070 -12.903 1.168 109 HA ASP 15 HA ASP 15 99.865 -12.392 2.828 110 HB2 ASP 15 HB3 ASP 15 101.130 -15.149 2.745 111 HB3 ASP 15 HB2 ASP 15 99.403 -14.719 2.794 112 H LYS 16 H LYS 16 102.870 -14.116 3.818 113 HA LYS 16 HA LYS 16 102.180 -14.376 6.576 114 HB2 LYS 16 HB2 LYS 16 104.921 -13.815 5.353 115 HB3 LYS 16 HB3 LYS 16 104.633 -14.432 6.998 116 HG2 LYS 16 HG2 LYS 16 103.390 -15.887 4.670 117 HG3 LYS 16 HG3 LYS 16 105.129 -16.104 4.981 118 HD2 LYS 16 HD3 LYS 16 103.192 -16.313 7.286 119 HD3 LYS 16 HD2 LYS 16 103.347 -17.683 6.161 120 HE2 LYS 16 HE2 LYS 16 105.810 -17.689 6.534 121 HE3 LYS 16 HE3 LYS 16 105.625 -16.353 7.695 122 HZ1 LYS 16 HZ1 LYS 16 105.683 -18.490 8.798 123 HZ2 LYS 16 HZ2 LYS 16 104.209 -17.782 9.013 124 HZ3 LYS 16 HZ3 LYS 16 104.380 -19.020 7.936 125 H PHE 17 H PHE 17 103.671 -11.672 4.796 126 HA PHE 17 HA PHE 17 103.996 -9.967 7.134 127 HB2 PHE 17 HB2 PHE 17 105.134 -9.637 4.921 128 HB3 PHE 17 HB3 PHE 17 103.561 -9.205 4.212 129 HD1 PHE 17 HD1 PHE 17 106.007 -8.266 6.850 130 HD2 PHE 17 HD2 PHE 17 102.690 -7.006 4.442 131 HE1 PHE 17 HE1 PHE 17 106.329 -5.937 7.634 132 HE2 PHE 17 HE2 PHE 17 103.003 -4.673 5.225 133 HZ PHE 17 HZ PHE 17 104.825 -4.137 6.824 134 H MET 18 H MET 18 101.684 -9.708 4.417 135 HA MET 18 HA MET 18 99.891 -7.887 5.657 136 HB2 MET 18 HB2 MET 18 99.625 -10.014 3.545 137 HB3 MET 18 HB3 MET 18 98.132 -9.315 4.213 138 HG2 MET 18 HG2 MET 18 98.701 -7.952 2.326 139 HG3 MET 18 HG3 MET 18 99.178 -7.012 3.760 140 HE1 MET 18 HE1 MET 18 102.255 -5.781 2.183 141 HE2 MET 18 HE2 MET 18 101.108 -5.649 3.537 142 HE3 MET 18 HE3 MET 18 100.512 -5.626 1.860 143 H GLU 19 H GLU 19 100.489 -11.248 6.378 144 HA GLU 19 HA GLU 19 97.892 -11.656 7.730 145 HB2 GLU 19 HB2 GLU 19 99.146 -13.565 6.777 146 HB3 GLU 19 HB3 GLU 19 100.502 -13.231 7.880 147 HG2 GLU 19 HG3 GLU 19 99.253 -13.850 9.795 148 HG3 GLU 19 HG2 GLU 19 97.699 -13.692 8.941 149 H LYS 20 H LYS 20 101.224 -10.808 8.666 150 HA LYS 20 HA LYS 20 100.743 -10.943 11.527 151 HB2 LYS 20 HB3 LYS 20 102.727 -9.292 9.902 152 HB3 LYS 20 HB2 LYS 20 102.766 -9.461 11.674 153 HG2 LYS 20 HG2 LYS 20 102.658 -11.955 9.984 154 HG3 LYS 20 HG3 LYS 20 104.203 -11.082 10.122 155 HD2 LYS 20 HD3 LYS 20 104.320 -11.404 12.457 156 HD3 LYS 20 HD2 LYS 20 102.575 -11.725 12.595 157 HE2 LYS 20 HE2 LYS 20 104.373 -13.555 10.978 158 HE3 LYS 20 HE3 LYS 20 104.214 -13.752 12.740 159 HZ1 LYS 20 HZ1 LYS 20 102.607 -15.086 11.546 160 HZ2 LYS 20 HZ2 LYS 20 101.983 -13.752 10.805 161 HZ3 LYS 20 HZ3 LYS 20 101.834 -13.934 12.438 162 H MET 21 H MET 21 100.338 -8.381 9.087 163 HA MET 21 HA MET 21 99.724 -6.289 11.019 164 HB2 MET 21 HB2 MET 21 98.822 -6.575 8.117 165 HB3 MET 21 HB3 MET 21 98.804 -5.076 9.077 166 HG2 MET 21 HG2 MET 21 101.396 -5.797 9.427 167 HG3 MET 21 HG3 MET 21 101.106 -6.523 7.828 168 HE1 MET 21 HE1 MET 21 99.787 -3.691 5.685 169 HE2 MET 21 HE2 MET 21 99.594 -5.386 6.194 170 HE3 MET 21 HE3 MET 21 98.637 -4.106 6.978 171 H GLY 22 H GLY 22 98.071 -9.118 10.148 172 HA2 GLY 22 HA2 GLY 22 95.956 -9.855 10.964 173 HA3 GLY 22 HA3 GLY 22 95.703 -8.248 11.687 174 H VAL 23 H VAL 23 96.546 -8.769 8.284 175 HA VAL 23 HA VAL 23 94.137 -7.245 7.487 176 HB VAL 23 HB VAL 23 96.127 -8.712 5.706 177 HG11 VAL 23 HG11 VAL 23 95.446 -6.978 4.069 178 HG12 VAL 23 HG12 VAL 23 94.045 -7.928 4.619 179 HG13 VAL 23 HG13 VAL 23 94.320 -6.293 5.266 180 HG21 VAL 23 HG21 VAL 23 97.323 -7.209 7.280 181 HG22 VAL 23 HG22 VAL 23 96.245 -5.870 6.819 182 HG23 VAL 23 HG23 VAL 23 97.366 -6.562 5.622 183 H ASN 24 H ASN 24 92.279 -8.069 6.539 184 HA ASN 24 HA ASN 24 91.355 -10.651 7.113 185 HB2 ASN 24 HB3 ASN 24 90.113 -8.653 6.012 186 HB3 ASN 24 HB2 ASN 24 90.690 -9.321 4.466 187 HD21 ASN 24 HD21 ASN 24 88.680 -10.130 3.667 188 HD22 ASN 24 HD22 ASN 24 87.782 -11.389 4.484 189 H ILE 25 H ILE 25 90.871 -12.445 5.408 190 HA ILE 25 HA ILE 25 93.510 -13.192 4.253 191 HB ILE 25 HB ILE 25 90.884 -14.590 4.743 192 HG12 ILE 25 HG12 ILE 25 92.673 -14.577 6.464 193 HG13 ILE 25 HG13 ILE 25 92.380 -16.218 5.845 194 HG21 ILE 25 HG21 ILE 25 91.863 -16.580 3.498 195 HG22 ILE 25 HG22 ILE 25 91.326 -15.238 2.461 196 HG23 ILE 25 HG23 ILE 25 93.059 -15.463 2.799 197 HD11 ILE 25 HD11 ILE 25 94.864 -15.229 6.067 198 HD12 ILE 25 HD12 ILE 25 94.412 -16.307 4.725 199 HD13 ILE 25 HD13 ILE 25 94.471 -14.546 4.471 200 H VAL 26 H VAL 26 90.888 -11.443 3.279 201 HA VAL 26 HA VAL 26 90.846 -12.368 0.457 202 HB VAL 26 HB VAL 26 89.601 -9.918 1.783 203 HG11 VAL 26 HG11 VAL 26 89.901 -9.680 -0.667 204 HG12 VAL 26 HG12 VAL 26 89.094 -11.246 -0.918 205 HG13 VAL 26 HG13 VAL 26 88.182 -9.871 -0.250 206 HG21 VAL 26 HG21 VAL 26 88.150 -12.422 0.891 207 HG22 VAL 26 HG22 VAL 26 88.924 -12.356 2.492 208 HG23 VAL 26 HG23 VAL 26 87.642 -11.194 2.075 209 H LYS 27 H LYS 27 91.608 -9.238 2.065 210 HA LYS 27 HA LYS 27 92.984 -8.179 -0.255 211 HB2 LYS 27 HB3 LYS 27 93.246 -7.523 2.715 212 HB3 LYS 27 HB2 LYS 27 93.988 -6.568 1.409 213 HG2 LYS 27 HG2 LYS 27 91.656 -6.341 0.401 214 HG3 LYS 27 HG3 LYS 27 91.022 -7.051 1.905 215 HD2 LYS 27 HD2 LYS 27 92.321 -5.221 3.152 216 HD3 LYS 27 HD3 LYS 27 92.564 -4.449 1.566 217 HE2 LYS 27 HE2 LYS 27 90.595 -3.438 2.483 218 HE3 LYS 27 HE3 LYS 27 90.016 -4.601 1.266 219 HZ1 LYS 27 HZ1 LYS 27 88.802 -4.797 3.334 220 HZ2 LYS 27 HZ2 LYS 27 89.654 -6.180 3.044 221 HZ3 LYS 27 HZ3 LYS 27 90.190 -5.102 4.171 222 H ARG 28 H ARG 28 93.877 -10.400 2.282 223 HA ARG 28 HA ARG 28 96.775 -10.102 1.957 224 HB2 ARG 28 HB3 ARG 28 95.654 -11.092 3.986 225 HB3 ARG 28 HB2 ARG 28 95.193 -12.496 2.994 226 HG2 ARG 28 HG2 ARG 28 97.698 -12.707 2.420 227 HG3 ARG 28 HG3 ARG 28 97.985 -11.563 3.753 228 HD2 ARG 28 HD2 ARG 28 98.180 -13.730 4.739 229 HD3 ARG 28 HD3 ARG 28 96.562 -13.153 5.204 230 HE ARG 28 HE ARG 28 95.987 -14.527 2.895 231 HH11 ARG 28 HH11 ARG 28 95.673 -16.763 2.781 232 HH12 ARG 28 HH12 ARG 28 96.432 -17.814 3.955 233 HH21 ARG 28 HH21 ARG 28 97.973 -15.206 5.673 234 HH22 ARG 28 HH22 ARG 28 97.730 -16.936 5.586 235 H LYS 29 H LYS 29 94.344 -12.471 0.748 236 HA LYS 29 HA LYS 29 96.297 -13.973 -0.798 237 HB2 LYS 29 HB2 LYS 29 93.798 -14.525 -0.090 238 HB3 LYS 29 HB3 LYS 29 93.412 -13.763 -1.651 239 HG2 LYS 29 HG2 LYS 29 93.719 -15.984 -2.307 240 HG3 LYS 29 HG3 LYS 29 95.360 -15.335 -2.541 241 HD2 LYS 29 HD3 LYS 29 95.740 -16.052 -0.051 242 HD3 LYS 29 HD2 LYS 29 94.301 -17.071 -0.294 243 HE2 LYS 29 HE2 LYS 29 96.956 -17.172 -1.769 244 HE3 LYS 29 HE3 LYS 29 96.141 -18.473 -0.869 245 HZ1 LYS 29 HZ1 LYS 29 95.628 -18.957 -3.033 246 HZ2 LYS 29 HZ2 LYS 29 94.303 -18.074 -2.603 247 HZ3 LYS 29 HZ3 LYS 29 95.499 -17.382 -3.504 248 H LEU 30 H LEU 30 94.277 -11.132 -1.493 249 HA LEU 30 HA LEU 30 95.130 -11.165 -4.346 250 HB2 LEU 30 HB2 LEU 30 93.427 -9.237 -2.719 251 HB3 LEU 30 HB3 LEU 30 93.808 -9.007 -4.443 252 HG LEU 30 HG LEU 30 92.699 -11.661 -3.538 253 HD11 LEU 30 HD11 LEU 30 91.213 -9.966 -2.500 254 HD12 LEU 30 HD12 LEU 30 91.048 -9.149 -4.073 255 HD13 LEU 30 HD13 LEU 30 90.397 -10.791 -3.850 256 HD21 LEU 30 HD21 LEU 30 93.479 -11.321 -5.868 257 HD22 LEU 30 HD22 LEU 30 91.719 -11.582 -5.814 258 HD23 LEU 30 HD23 LEU 30 92.369 -9.940 -6.038 259 H ALA 31 H ALA 31 96.295 -10.037 -1.400 260 HA ALA 31 HA ALA 31 97.629 -7.613 -2.389 261 HB1 ALA 31 HB1 ALA 31 99.047 -8.147 -0.193 262 HB2 ALA 31 HB2 ALA 31 97.380 -7.536 -0.079 263 HB3 ALA 31 HB3 ALA 31 97.706 -9.275 0.121 264 H ALA 32 H ALA 32 98.372 -11.048 -2.330 265 HA ALA 32 HA ALA 32 101.260 -10.724 -2.682 266 HB1 ALA 32 HB1 ALA 32 101.199 -13.104 -3.376 267 HB2 ALA 32 HB2 ALA 32 99.423 -13.032 -3.464 268 HB3 ALA 32 HB3 ALA 32 100.245 -12.845 -1.897 269 H HIS 33 H HIS 33 98.719 -11.760 -5.011 270 HA HIS 33 HA HIS 33 100.473 -11.295 -7.304 271 HB2 HIS 33 HB3 HIS 33 98.635 -12.893 -7.468 272 HB3 HIS 33 HB2 HIS 33 97.449 -11.624 -7.078 273 HD2 HIS 33 HD2 HIS 33 96.521 -10.254 -9.307 274 HE1 HIS 33 HE1 HIS 33 99.444 -11.561 -12.062 275 HE2 HIS 33 HE2 HIS 33 97.286 -10.218 -11.819 276 H ASP 34 H ASP 34 100.591 -8.988 -5.751 277 HA ASP 34 HA ASP 34 98.709 -7.018 -6.968 278 HB2 ASP 34 HB3 ASP 34 99.550 -7.006 -4.516 279 HB3 ASP 34 HB2 ASP 34 101.078 -6.381 -5.181 280 H ASN 35 H ASN 35 99.180 -5.860 -8.752 281 HA ASN 35 HA ASN 35 102.088 -5.681 -9.577 282 HB2 ASN 35 HB2 ASN 35 99.582 -6.226 -11.203 283 HB3 ASN 35 HB3 ASN 35 101.035 -5.531 -11.960 284 HD21 ASN 35 HD21 ASN 35 99.696 -8.347 -12.111 285 HD22 ASN 35 HD22 ASN 35 101.030 -9.434 -11.799 286 H LEU 36 H LEU 36 100.869 -3.777 -7.905 287 HA LEU 36 HA LEU 36 99.643 -1.620 -9.429 288 HB2 LEU 36 HB2 LEU 36 99.787 -0.337 -7.425 289 HB3 LEU 36 HB3 LEU 36 99.523 -2.015 -6.898 290 HG LEU 36 HG LEU 36 102.372 -1.155 -7.226 291 HD11 LEU 36 HD11 LEU 36 101.345 0.830 -6.146 292 HD12 LEU 36 HD12 LEU 36 102.377 -0.059 -5.000 293 HD13 LEU 36 HD13 LEU 36 100.607 -0.223 -4.915 294 HD21 LEU 36 HD21 LEU 36 101.142 -2.493 -4.816 295 HD22 LEU 36 HD22 LEU 36 102.736 -2.754 -5.562 296 HD23 LEU 36 HD23 LEU 36 101.274 -3.409 -6.336 297 H LYS 37 H LYS 37 100.560 0.512 -9.776 298 HA LYS 37 HA LYS 37 103.468 0.331 -10.570 299 HB2 LYS 37 HB2 LYS 37 101.219 2.153 -11.540 300 HB3 LYS 37 HB3 LYS 37 102.908 2.238 -12.095 301 HG2 LYS 37 HG3 LYS 37 102.553 -0.347 -12.576 302 HG3 LYS 37 HG2 LYS 37 100.832 0.107 -12.599 303 HD2 LYS 37 HD2 LYS 37 103.043 1.365 -14.285 304 HD3 LYS 37 HD3 LYS 37 101.787 0.248 -14.870 305 HE2 LYS 37 HE2 LYS 37 100.040 1.885 -14.145 306 HE3 LYS 37 HE3 LYS 37 101.330 3.012 -13.662 307 HZ1 LYS 37 HZ1 LYS 37 100.532 3.472 -15.883 308 HZ2 LYS 37 HZ2 LYS 37 100.913 1.947 -16.383 309 HZ3 LYS 37 HZ3 LYS 37 102.109 2.991 -15.936 310 H LEU 38 H LEU 38 104.873 2.078 -9.999 311 HA LEU 38 HA LEU 38 103.698 4.108 -8.107 312 HB2 LEU 38 HB2 LEU 38 106.277 2.603 -7.513 313 HB3 LEU 38 HB3 LEU 38 105.389 3.710 -6.441 314 HG LEU 38 HG LEU 38 103.417 1.924 -6.925 315 HD11 LEU 38 HD11 LEU 38 104.843 0.528 -8.400 316 HD12 LEU 38 HD12 LEU 38 106.011 0.322 -7.073 317 HD13 LEU 38 HD13 LEU 38 104.375 -0.363 -6.932 318 HD21 LEU 38 HD21 LEU 38 104.286 2.617 -4.708 319 HD22 LEU 38 HD22 LEU 38 105.687 1.540 -4.921 320 HD23 LEU 38 HD23 LEU 38 104.050 0.854 -4.780 321 H THR 39 H THR 39 104.426 6.116 -8.573 322 HA THR 39 HA THR 39 106.780 6.332 -10.445 323 HB THR 39 HB THR 39 105.050 8.665 -9.607 324 HG1 THR 39 HG1 THR 39 103.495 7.210 -10.193 325 HG21 THR 39 HG21 THR 39 105.529 9.360 -11.937 326 HG22 THR 39 HG22 THR 39 106.395 7.830 -12.215 327 HG23 THR 39 HG23 THR 39 107.033 9.016 -11.050 328 H ILE 40 H ILE 40 108.654 6.412 -9.251 329 HA ILE 40 HA ILE 40 108.584 7.910 -6.650 330 HB ILE 40 HB ILE 40 110.654 6.091 -7.945 331 HG12 ILE 40 HG12 ILE 40 110.127 4.925 -5.627 332 HG13 ILE 40 HG13 ILE 40 108.635 5.891 -5.702 333 HG21 ILE 40 HG21 ILE 40 111.775 7.928 -6.711 334 HG22 ILE 40 HG22 ILE 40 111.946 6.381 -5.847 335 HG23 ILE 40 HG23 ILE 40 110.764 7.587 -5.286 336 HD11 ILE 40 HD11 ILE 40 108.964 3.411 -6.873 337 HD12 ILE 40 HD12 ILE 40 107.755 4.617 -7.376 338 HD13 ILE 40 HD13 ILE 40 109.311 4.505 -8.234 339 H THR 41 H THR 41 109.235 9.972 -6.541 340 HA THR 41 HA THR 41 111.232 10.921 -8.608 341 HB THR 41 HB THR 41 109.325 12.823 -7.261 342 HG1 THR 41 HG1 THR 41 107.881 11.318 -8.004 343 HG21 THR 41 HG21 THR 41 109.539 13.971 -9.448 344 HG22 THR 41 HG22 THR 41 110.521 12.619 -10.061 345 HG23 THR 41 HG23 THR 41 111.138 13.640 -8.740 346 H GLN 42 H GLN 42 112.807 12.457 -7.782 347 HA GLN 42 HA GLN 42 112.862 12.583 -4.758 348 HB2 GLN 42 HB2 GLN 42 114.454 10.863 -5.502 349 HB3 GLN 42 HB3 GLN 42 115.193 12.013 -6.642 350 HG2 GLN 42 HG2 GLN 42 115.892 13.457 -4.783 351 HG3 GLN 42 HG3 GLN 42 115.072 12.391 -3.616 352 HE21 GLN 42 HE21 GLN 42 117.893 12.911 -3.433 353 HE22 GLN 42 HE22 GLN 42 118.740 11.425 -3.802 354 H GLU 43 H GLU 43 113.782 14.489 -3.880 355 HA GLU 43 HA GLU 43 114.712 16.558 -5.844 356 HB2 GLU 43 HB2 GLU 43 112.418 16.970 -3.875 357 HB3 GLU 43 HB3 GLU 43 113.188 18.258 -4.833 358 HG2 GLU 43 HG2 GLU 43 112.633 16.765 -6.894 359 HG3 GLU 43 HG3 GLU 43 111.516 15.918 -5.797 360 H GLY 44 H GLY 44 116.733 15.961 -4.705 361 HA2 GLY 44 HA3 GLY 44 118.377 16.402 -3.071 362 HA3 GLY 44 HA2 GLY 44 117.464 17.891 -2.737 363 H ASN 45 H ASN 45 115.670 17.752 -1.171 364 HA ASN 45 HA ASN 45 116.054 15.446 0.753 365 HB2 ASN 45 HB2 ASN 45 115.571 17.146 2.578 366 HB3 ASN 45 HB3 ASN 45 117.124 17.374 1.739 367 HD21 ASN 45 HD21 ASN 45 114.814 19.230 3.026 368 HD22 ASN 45 HD22 ASN 45 114.716 20.513 1.841 369 H LYS 46 H LYS 46 114.023 15.914 -1.397 370 HA LYS 46 HA LYS 46 111.654 15.532 0.379 371 HB2 LYS 46 HB2 LYS 46 111.436 17.875 -0.094 372 HB3 LYS 46 HB3 LYS 46 111.935 17.654 -1.787 373 HG2 LYS 46 HG2 LYS 46 109.634 15.975 -1.166 374 HG3 LYS 46 HG3 LYS 46 109.291 17.677 -0.777 375 HD2 LYS 46 HD2 LYS 46 110.201 18.278 -3.080 376 HD3 LYS 46 HD3 LYS 46 110.233 16.535 -3.441 377 HE2 LYS 46 HE2 LYS 46 108.127 17.226 -4.267 378 HE3 LYS 46 HE3 LYS 46 107.741 16.555 -2.664 379 HZ1 LYS 46 HZ1 LYS 46 106.707 18.700 -3.004 380 HZ2 LYS 46 HZ2 LYS 46 108.171 19.413 -3.269 381 HZ3 LYS 46 HZ3 LYS 46 107.813 18.792 -1.784 382 H PHE 47 H PHE 47 111.133 13.543 -0.230 383 HA PHE 47 HA PHE 47 111.476 12.698 -3.081 384 HB2 PHE 47 HB2 PHE 47 111.282 11.377 -0.443 385 HB3 PHE 47 HB3 PHE 47 110.324 10.570 -1.707 386 HD1 PHE 47 HD1 PHE 47 113.719 11.620 -0.675 387 HD2 PHE 47 HD2 PHE 47 111.396 9.547 -3.634 388 HE1 PHE 47 HE1 PHE 47 115.792 10.637 -1.613 389 HE2 PHE 47 HE2 PHE 47 113.470 8.564 -4.574 390 HZ PHE 47 HZ PHE 47 115.669 9.113 -3.566 391 H THR 48 H THR 48 109.607 11.426 -4.056 392 HA THR 48 HA THR 48 106.918 12.118 -3.009 393 HB THR 48 HB THR 48 107.859 13.131 -5.729 394 HG1 THR 48 HG1 THR 48 108.632 14.393 -3.967 395 HG21 THR 48 HG21 THR 48 105.619 14.188 -5.800 396 HG22 THR 48 HG22 THR 48 105.489 12.418 -5.668 397 HG23 THR 48 HG23 THR 48 105.217 13.439 -4.236 398 H VAL 49 H VAL 49 106.271 10.012 -3.050 399 HA VAL 49 HA VAL 49 106.739 8.478 -5.605 400 HB VAL 49 HB VAL 49 107.552 7.451 -3.465 401 HG11 VAL 49 HG11 VAL 49 106.156 7.019 -1.665 402 HG12 VAL 49 HG12 VAL 49 104.700 6.917 -2.683 403 HG13 VAL 49 HG13 VAL 49 105.393 8.506 -2.279 404 HG21 VAL 49 HG21 VAL 49 106.869 6.037 -5.385 405 HG22 VAL 49 HG22 VAL 49 106.482 5.246 -3.838 406 HG23 VAL 49 HG23 VAL 49 105.194 6.030 -4.784 407 H LYS 50 H LYS 50 105.045 8.423 -6.970 408 HA LYS 50 HA LYS 50 102.305 8.902 -5.818 409 HB2 LYS 50 HB2 LYS 50 103.345 10.193 -7.860 410 HB3 LYS 50 HB3 LYS 50 102.939 8.720 -8.773 411 HG2 LYS 50 HG3 LYS 50 100.579 8.917 -7.838 412 HG3 LYS 50 HG2 LYS 50 101.041 10.515 -7.205 413 HD2 LYS 50 HD3 LYS 50 101.512 11.338 -9.436 414 HD3 LYS 50 HD2 LYS 50 101.316 9.712 -10.132 415 HE2 LYS 50 HE2 LYS 50 99.314 11.377 -10.316 416 HE3 LYS 50 HE3 LYS 50 98.974 9.713 -9.783 417 HZ1 LYS 50 HZ1 LYS 50 98.055 11.672 -8.435 418 HZ2 LYS 50 HZ2 LYS 50 99.579 11.794 -7.816 419 HZ3 LYS 50 HZ3 LYS 50 98.720 10.400 -7.621 420 H GLU 51 H GLU 51 101.605 6.904 -5.077 421 HA GLU 51 HA GLU 51 102.155 4.423 -6.526 422 HB2 GLU 51 HB3 GLU 51 99.975 5.039 -4.478 423 HB3 GLU 51 HB2 GLU 51 100.529 3.420 -4.969 424 HG2 GLU 51 HG2 GLU 51 101.790 3.756 -3.031 425 HG3 GLU 51 HG3 GLU 51 102.910 4.360 -4.275 426 H SER 52 H SER 52 100.547 3.111 -7.668 427 HA SER 52 HA SER 52 98.013 4.414 -8.444 428 HB2 SER 52 HB2 SER 52 99.949 3.772 -10.687 429 HB3 SER 52 HB3 SER 52 98.466 4.755 -10.741 430 HG SER 52 HG SER 52 100.569 5.925 -10.659 431 H SER 53 H SER 53 96.812 2.708 -8.012 432 HA SER 53 HA SER 53 97.452 0.144 -9.462 433 HB2 SER 53 HB2 SER 53 97.600 -0.986 -7.508 434 HB3 SER 53 HB3 SER 53 97.459 0.555 -6.627 435 HG SER 53 HG SER 53 95.772 -0.954 -6.092 436 H ALA 54 H ALA 54 95.602 -0.901 -10.294 437 HA ALA 54 HA ALA 54 93.362 0.753 -10.958 438 HB1 ALA 54 HB1 ALA 54 92.253 -1.356 -11.647 439 HB2 ALA 54 HB2 ALA 54 93.486 -2.290 -10.766 440 HB3 ALA 54 HB3 ALA 54 93.950 -1.318 -12.183 441 H PHE 55 H PHE 55 94.152 -0.011 -7.902 442 HA PHE 55 HA PHE 55 91.279 -0.498 -7.098 443 HB2 PHE 55 HB3 PHE 55 92.631 -2.286 -6.275 444 HB3 PHE 55 HB2 PHE 55 93.915 -1.173 -5.749 445 HD1 PHE 55 HD1 PHE 55 90.205 -0.864 -5.275 446 HD2 PHE 55 HD2 PHE 55 94.029 -1.498 -3.420 447 HE1 PHE 55 HE1 PHE 55 89.150 -0.692 -3.038 448 HE2 PHE 55 HE2 PHE 55 92.973 -1.325 -1.184 449 HZ PHE 55 HZ PHE 55 90.534 -0.921 -0.992 450 H ARG 56 H ARG 56 93.943 1.788 -6.907 451 HA ARG 56 HA ARG 56 92.462 3.983 -6.077 452 HB2 ARG 56 HB2 ARG 56 93.071 3.979 -3.515 453 HB3 ARG 56 HB3 ARG 56 91.621 3.109 -4.065 454 HG2 ARG 56 HG3 ARG 56 92.467 1.116 -3.393 455 HG3 ARG 56 HG2 ARG 56 94.008 1.419 -4.230 456 HD2 ARG 56 HD2 ARG 56 94.080 1.172 -1.647 457 HD3 ARG 56 HD3 ARG 56 94.928 2.565 -2.360 458 HE ARG 56 HE ARG 56 93.414 3.982 -1.216 459 HH11 ARG 56 HH11 ARG 56 91.529 4.385 -0.037 460 HH12 ARG 56 HH12 ARG 56 90.337 3.122 0.166 461 HH21 ARG 56 HH21 ARG 56 92.140 0.774 -1.668 462 HH22 ARG 56 HH22 ARG 56 90.681 1.085 -0.754 463 H ASN 57 H ASN 57 94.169 4.853 -7.322 464 HA ASN 57 HA ASN 57 96.965 4.557 -6.661 465 HB2 ASN 57 HB2 ASN 57 97.312 6.508 -8.095 466 HB3 ASN 57 HB3 ASN 57 96.063 5.472 -8.826 467 HD21 ASN 57 HD21 ASN 57 96.673 8.587 -7.240 468 HD22 ASN 57 HD22 ASN 57 95.071 9.237 -7.509 469 H ILE 58 H ILE 58 98.370 5.923 -5.465 470 HA ILE 58 HA ILE 58 97.013 7.984 -3.738 471 HB ILE 58 HB ILE 58 99.088 6.169 -2.532 472 HG12 ILE 58 HG12 ILE 58 96.127 5.544 -2.875 473 HG13 ILE 58 HG13 ILE 58 97.508 4.573 -3.445 474 HG21 ILE 58 HG21 ILE 58 97.915 8.365 -1.567 475 HG22 ILE 58 HG22 ILE 58 98.240 6.966 -0.516 476 HG23 ILE 58 HG23 ILE 58 96.608 7.220 -1.181 477 HD11 ILE 58 HD11 ILE 58 97.019 3.478 -1.449 478 HD12 ILE 58 HD12 ILE 58 96.467 4.968 -0.647 479 HD13 ILE 58 HD13 ILE 58 98.207 4.675 -0.880 480 H GLU 59 H GLU 59 98.761 9.153 -2.421 481 HA GLU 59 HA GLU 59 101.347 9.382 -3.936 482 HB2 GLU 59 HB3 GLU 59 101.133 11.698 -4.341 483 HB3 GLU 59 HB2 GLU 59 99.508 11.080 -4.721 484 HG2 GLU 59 HG2 GLU 59 99.058 11.547 -2.152 485 HG3 GLU 59 HG3 GLU 59 100.445 12.650 -2.317 486 H CYS 60 H CYS 60 103.073 10.023 -2.597 487 HA CYS 60 HA CYS 60 102.411 10.909 0.180 488 HB2 CYS 60 HB2 CYS 60 103.597 8.223 -0.540 489 HB3 CYS 60 HB3 CYS 60 104.070 9.022 0.978 490 HG CYS 60 HG CYS 60 100.782 9.276 0.727 491 H VAL 61 H VAL 61 103.758 12.599 0.494 492 HA VAL 61 HA VAL 61 106.363 12.667 -0.965 493 HB VAL 61 HB VAL 61 105.644 14.768 1.045 494 HG11 VAL 61 HG11 VAL 61 106.403 16.220 -0.858 495 HG12 VAL 61 HG12 VAL 61 107.621 15.013 -0.380 496 HG13 VAL 61 HG13 VAL 61 106.636 14.755 -1.840 497 HG21 VAL 61 HG21 VAL 61 104.108 15.792 -0.759 498 HG22 VAL 61 HG22 VAL 61 104.039 14.160 -1.465 499 HG23 VAL 61 HG23 VAL 61 103.438 14.442 0.187 500 H PHE 62 H PHE 62 108.405 12.733 0.143 501 HA PHE 62 HA PHE 62 108.245 12.126 3.090 502 HB2 PHE 62 HB3 PHE 62 109.760 10.508 1.000 503 HB3 PHE 62 HB2 PHE 62 110.020 10.360 2.754 504 HD1 PHE 62 HD1 PHE 62 108.611 8.624 0.258 505 HD2 PHE 62 HD2 PHE 62 107.366 10.501 3.917 506 HE1 PHE 62 HE1 PHE 62 106.692 7.061 0.410 507 HE2 PHE 62 HE2 PHE 62 105.448 8.940 4.065 508 HZ PHE 62 HZ PHE 62 105.111 7.218 2.313 509 H GLU 63 H GLU 63 110.417 12.265 4.137 510 HA GLU 63 HA GLU 63 112.452 13.884 2.680 511 HB2 GLU 63 HB3 GLU 63 110.883 15.609 3.499 512 HB3 GLU 63 HB2 GLU 63 110.975 14.929 5.141 513 HG2 GLU 63 HG3 GLU 63 113.150 15.695 5.485 514 HG3 GLU 63 HG2 GLU 63 113.534 15.700 3.747 515 H LEU 64 H LEU 64 114.363 14.299 4.270 516 HA LEU 64 HA LEU 64 114.657 11.779 5.891 517 HB2 LEU 64 HB2 LEU 64 116.771 13.776 4.970 518 HB3 LEU 64 HB3 LEU 64 117.072 12.203 5.747 519 HG LEU 64 HG LEU 64 115.631 12.605 3.086 520 HD11 LEU 64 HD11 LEU 64 118.054 13.112 2.955 521 HD12 LEU 64 HD12 LEU 64 118.422 11.550 3.726 522 HD13 LEU 64 HD13 LEU 64 117.673 11.591 2.112 523 HD21 LEU 64 HD21 LEU 64 116.307 10.002 3.132 524 HD22 LEU 64 HD22 LEU 64 114.779 10.585 3.833 525 HD23 LEU 64 HD23 LEU 64 116.176 10.264 4.888 526 H GLY 65 H GLY 65 114.360 11.959 8.050 527 HA2 GLY 65 HA3 GLY 65 114.935 12.854 10.222 528 HA3 GLY 65 HA2 GLY 65 115.531 14.336 9.439 529 H VAL 66 H VAL 66 112.399 13.046 8.513 530 HA VAL 66 HA VAL 66 111.031 14.965 10.376 531 HB VAL 66 HB VAL 66 110.539 14.973 7.368 532 HG11 VAL 66 HG11 VAL 66 108.616 15.617 8.793 533 HG12 VAL 66 HG12 VAL 66 109.254 17.023 7.906 534 HG13 VAL 66 HG13 VAL 66 109.637 16.810 9.632 535 HG21 VAL 66 HG21 VAL 66 111.595 17.325 7.608 536 HG22 VAL 66 HG22 VAL 66 112.255 16.736 9.152 537 HG23 VAL 66 HG23 VAL 66 112.706 15.934 7.628 538 H THR 67 H THR 67 109.821 13.403 11.421 539 HA THR 67 HA THR 67 108.781 11.027 10.203 540 HB THR 67 HB THR 67 107.189 12.402 12.348 541 HG1 THR 67 HG1 THR 67 109.239 12.891 13.039 542 HG21 THR 67 HG21 THR 67 106.936 10.188 13.180 543 HG22 THR 67 HG22 THR 67 106.866 10.004 11.411 544 HG23 THR 67 HG23 THR 67 108.361 9.601 12.289 545 H PHE 68 H PHE 68 106.896 10.542 9.211 546 HA PHE 68 HA PHE 68 104.790 12.617 8.903 547 HB2 PHE 68 HB2 PHE 68 104.927 11.917 6.294 548 HB3 PHE 68 HB3 PHE 68 105.763 13.344 6.947 549 HD1 PHE 68 HD1 PHE 68 106.321 9.631 6.630 550 HD2 PHE 68 HD2 PHE 68 108.005 13.577 6.436 551 HE1 PHE 68 HE1 PHE 68 108.505 8.668 5.943 552 HE2 PHE 68 HE2 PHE 68 110.187 12.614 5.759 553 HZ PHE 68 HZ PHE 68 110.434 10.162 5.507 554 H ASN 69 H ASN 69 103.220 11.373 7.008 555 HA ASN 69 HA ASN 69 103.120 8.511 7.930 556 HB2 ASN 69 HB2 ASN 69 100.820 8.646 8.558 557 HB3 ASN 69 HB3 ASN 69 101.601 10.050 9.323 558 HD21 ASN 69 HD21 ASN 69 101.765 11.953 7.359 559 HD22 ASN 69 HD22 ASN 69 100.183 12.312 6.704 560 H CYS 70 H CYS 70 102.084 7.098 6.504 561 HA CYS 70 HA CYS 70 100.926 8.187 3.984 562 HB2 CYS 70 HB2 CYS 70 103.357 8.084 3.488 563 HB3 CYS 70 HB3 CYS 70 103.387 6.378 3.997 564 HG CYS 70 HG CYS 70 102.350 5.334 1.782 565 H ASN 71 H ASN 71 99.343 6.779 3.243 566 HA ASN 71 HA ASN 71 99.050 4.272 4.877 567 HB2 ASN 71 HB2 ASN 71 96.735 4.287 3.657 568 HB3 ASN 71 HB3 ASN 71 97.033 5.484 4.941 569 HD21 ASN 71 HD21 ASN 71 96.351 5.057 1.533 570 HD22 ASN 71 HD22 ASN 71 96.416 6.752 1.105 571 H LEU 72 H LEU 72 98.903 2.236 3.944 572 HA LEU 72 HA LEU 72 100.025 2.075 1.172 573 HB2 LEU 72 HB2 LEU 72 99.583 0.073 3.411 574 HB3 LEU 72 HB3 LEU 72 100.001 -0.451 1.763 575 HG LEU 72 HG LEU 72 101.640 1.706 3.099 576 HD11 LEU 72 HD11 LEU 72 103.117 -0.052 4.036 577 HD12 LEU 72 HD12 LEU 72 101.971 -1.302 3.496 578 HD13 LEU 72 HD13 LEU 72 101.490 -0.136 4.752 579 HD21 LEU 72 HD21 LEU 72 101.984 1.158 0.703 580 HD22 LEU 72 HD22 LEU 72 103.405 0.704 1.673 581 HD23 LEU 72 HD23 LEU 72 102.260 -0.547 1.133 582 H ALA 73 H ALA 73 98.966 1.008 -0.537 583 HA ALA 73 HA ALA 73 96.226 1.392 -0.915 584 HB1 ALA 73 HB1 ALA 73 96.323 -0.408 -2.619 585 HB2 ALA 73 HB2 ALA 73 97.860 -0.979 -1.926 586 HB3 ALA 73 HB3 ALA 73 97.772 0.624 -2.694 587 H ASP 74 H ASP 74 97.798 -1.291 0.809 588 HA ASP 74 HA ASP 74 95.521 -3.022 1.014 589 HB2 ASP 74 HB2 ASP 74 97.390 -2.614 3.354 590 HB3 ASP 74 HB3 ASP 74 96.705 -4.126 2.711 591 H GLY 75 H GLY 75 95.594 0.153 1.834 592 HA2 GLY 75 HA3 GLY 75 93.950 1.397 3.027 593 HA3 GLY 75 HA2 GLY 75 93.214 -0.134 3.560 594 H THR 76 H THR 76 96.653 0.398 3.988 595 HA THR 76 HA THR 76 96.157 0.430 6.953 596 HB THR 76 HB THR 76 98.940 0.243 5.963 597 HG1 THR 76 HG1 THR 76 97.959 -0.950 4.330 598 HG21 THR 76 HG21 THR 76 98.977 -1.618 7.598 599 HG22 THR 76 HG22 THR 76 97.214 -1.477 7.797 600 HG23 THR 76 HG23 THR 76 98.278 -0.146 8.314 601 H GLU 77 H GLU 77 97.559 1.828 8.264 602 HA GLU 77 HA GLU 77 98.469 4.301 6.794 603 HB2 GLU 77 HB2 GLU 77 96.135 4.391 8.050 604 HB3 GLU 77 HB3 GLU 77 97.154 4.502 9.506 605 HG2 GLU 77 HG2 GLU 77 98.356 6.432 8.507 606 HG3 GLU 77 HG3 GLU 77 97.314 6.328 7.068 607 H LEU 78 H LEU 78 100.567 4.793 7.355 608 HA LEU 78 HA LEU 78 101.468 3.925 10.103 609 HB2 LEU 78 HB2 LEU 78 103.717 3.579 8.446 610 HB3 LEU 78 HB3 LEU 78 102.740 2.294 9.193 611 HG LEU 78 HG LEU 78 101.862 3.576 6.594 612 HD11 LEU 78 HD11 LEU 78 103.080 1.219 5.833 613 HD12 LEU 78 HD12 LEU 78 104.202 1.821 7.076 614 HD13 LEU 78 HD13 LEU 78 103.808 2.835 5.667 615 HD21 LEU 78 HD21 LEU 78 101.452 0.723 6.853 616 HD22 LEU 78 HD22 LEU 78 100.233 2.017 6.763 617 HD23 LEU 78 HD23 LEU 78 100.895 1.527 8.341 618 H ARG 79 H ARG 79 103.569 4.971 10.734 619 HA ARG 79 HA ARG 79 104.192 7.485 9.230 620 HB2 ARG 79 HB2 ARG 79 102.677 8.554 10.610 621 HB3 ARG 79 HB3 ARG 79 102.827 7.336 11.898 622 HG2 ARG 79 HG3 ARG 79 104.874 8.269 12.689 623 HG3 ARG 79 HG2 ARG 79 105.100 9.231 11.209 624 HD2 ARG 79 HD2 ARG 79 102.780 9.621 13.147 625 HD3 ARG 79 HD3 ARG 79 104.286 10.568 13.201 626 HE ARG 79 HE ARG 79 103.388 10.785 10.533 627 HH11 ARG 79 HH11 ARG 79 102.073 12.512 9.900 628 HH12 ARG 79 HH12 ARG 79 101.111 13.361 11.089 629 HH21 ARG 79 HH21 ARG 79 102.198 11.394 13.749 630 HH22 ARG 79 HH22 ARG 79 101.181 12.731 13.259 631 H GLY 80 H GLY 80 106.329 8.185 9.564 632 HA2 GLY 80 HA2 GLY 80 108.003 7.618 11.756 633 HA3 GLY 80 HA3 GLY 80 108.157 6.210 10.675 634 H THR 81 H THR 81 109.818 6.405 9.257 635 HA THR 81 HA THR 81 110.107 8.564 7.418 636 HB THR 81 HB THR 81 112.433 9.162 8.978 637 HG1 THR 81 HG1 THR 81 111.597 9.690 10.930 638 HG21 THR 81 HG21 THR 81 111.328 11.442 9.045 639 HG22 THR 81 HG22 THR 81 109.890 10.697 8.307 640 HG23 THR 81 HG23 THR 81 111.434 10.722 7.421 641 H TRP 82 H TRP 82 112.095 8.442 6.158 642 HA TRP 82 HA TRP 82 113.378 5.729 6.460 643 HB2 TRP 82 HB2 TRP 82 113.702 7.575 4.076 644 HB3 TRP 82 HB3 TRP 82 113.878 5.806 4.146 645 HD1 TRP 82 HD1 TRP 82 111.137 8.503 4.493 646 HE1 TRP 82 HE1 TRP 82 108.889 7.522 3.698 647 HE3 TRP 82 HE3 TRP 82 112.637 3.717 3.567 648 HZ2 TRP 82 HZ2 TRP 82 107.894 4.971 2.769 649 HZ3 TRP 82 HZ3 TRP 82 111.030 2.032 2.724 650 HH2 TRP 82 HH2 TRP 82 108.662 2.652 2.322 651 H SER 83 H SER 83 115.620 5.529 6.628 652 HA SER 83 HA SER 83 117.204 8.093 6.657 653 HB2 SER 83 HB3 SER 83 116.769 6.159 8.922 654 HB3 SER 83 HB2 SER 83 118.389 6.871 8.729 655 HG SER 83 HG SER 83 116.995 8.174 10.049 656 H LEU 84 H LEU 84 119.556 7.658 6.356 657 HA LEU 84 HA LEU 84 119.864 5.094 4.831 658 HB2 LEU 84 HB2 LEU 84 120.872 6.564 3.419 659 HB3 LEU 84 HB3 LEU 84 121.012 7.808 4.683 660 HG LEU 84 HG LEU 84 122.955 6.503 5.640 661 HD11 LEU 84 HD11 LEU 84 123.535 5.093 3.147 662 HD12 LEU 84 HD12 LEU 84 122.010 4.523 3.865 663 HD13 LEU 84 HD13 LEU 84 123.514 4.472 4.815 664 HD21 LEU 84 HD21 LEU 84 124.548 7.236 3.884 665 HD22 LEU 84 HD22 LEU 84 123.200 7.401 2.732 666 HD23 LEU 84 HD23 LEU 84 123.288 8.463 4.158 667 H GLU 85 H GLU 85 120.999 3.423 5.676 668 HA GLU 85 HA GLU 85 122.839 4.015 7.996 669 HB2 GLU 85 HB2 GLU 85 122.009 2.118 9.213 670 HB3 GLU 85 HB3 GLU 85 120.572 3.032 8.695 671 HG2 GLU 85 HG3 GLU 85 119.963 0.871 8.061 672 HG3 GLU 85 HG2 GLU 85 120.731 1.451 6.564 673 H GLY 86 H GLY 86 124.850 3.211 7.596 674 HA2 GLY 86 HA3 GLY 86 126.538 1.987 6.472 675 HA3 GLY 86 HA2 GLY 86 125.376 0.636 6.456 676 H ASN 87 H ASN 87 124.577 0.024 4.486 677 HA ASN 87 HA ASN 87 124.808 2.050 2.248 678 HB2 ASN 87 HB3 ASN 87 126.467 0.009 2.309 679 HB3 ASN 87 HB2 ASN 87 125.050 -0.926 1.772 680 HD21 ASN 87 HD21 ASN 87 123.964 -0.173 -0.284 681 HD22 ASN 87 HD22 ASN 87 124.930 0.665 -1.478 682 H LYS 88 H LYS 88 122.442 1.473 3.946 683 HA LYS 88 HA LYS 88 120.654 0.594 1.690 684 HB2 LYS 88 HB2 LYS 88 120.352 -0.425 4.547 685 HB3 LYS 88 HB3 LYS 88 119.374 -0.885 3.134 686 HG2 LYS 88 HG2 LYS 88 120.868 -2.656 3.149 687 HG3 LYS 88 HG3 LYS 88 121.787 -1.514 2.141 688 HD2 LYS 88 HD3 LYS 88 123.441 -1.966 3.676 689 HD3 LYS 88 HD2 LYS 88 122.601 -0.699 4.602 690 HE2 LYS 88 HE2 LYS 88 122.867 -2.550 6.109 691 HE3 LYS 88 HE3 LYS 88 121.162 -2.577 5.599 692 HZ1 LYS 88 HZ1 LYS 88 122.166 -4.758 5.465 693 HZ2 LYS 88 HZ2 LYS 88 123.328 -4.209 4.431 694 HZ3 LYS 88 HZ3 LYS 88 121.748 -4.234 3.958 695 H LEU 89 H LEU 89 118.446 1.366 1.915 696 HA LEU 89 HA LEU 89 118.337 3.849 3.610 697 HB2 LEU 89 HB2 LEU 89 117.106 2.934 1.057 698 HB3 LEU 89 HB3 LEU 89 116.017 3.842 2.132 699 HG LEU 89 HG LEU 89 118.818 4.830 1.494 700 HD11 LEU 89 HD11 LEU 89 117.601 4.515 -0.644 701 HD12 LEU 89 HD12 LEU 89 116.226 5.442 0.003 702 HD13 LEU 89 HD13 LEU 89 117.793 6.243 -0.265 703 HD21 LEU 89 HD21 LEU 89 117.626 5.826 3.430 704 HD22 LEU 89 HD22 LEU 89 117.808 7.008 2.112 705 HD23 LEU 89 HD23 LEU 89 116.241 6.208 2.380 706 H ILE 90 H ILE 90 117.516 3.479 5.616 707 HA ILE 90 HA ILE 90 115.717 1.177 6.057 708 HB ILE 90 HB ILE 90 115.603 2.412 8.419 709 HG12 ILE 90 HG12 ILE 90 118.221 3.412 7.241 710 HG13 ILE 90 HG13 ILE 90 116.777 4.433 7.459 711 HG21 ILE 90 HG21 ILE 90 116.616 0.198 7.944 712 HG22 ILE 90 HG22 ILE 90 117.643 1.152 9.041 713 HG23 ILE 90 HG23 ILE 90 118.077 1.002 7.321 714 HD11 ILE 90 HD11 ILE 90 118.309 4.634 9.390 715 HD12 ILE 90 HD12 ILE 90 116.761 3.898 9.869 716 HD13 ILE 90 HD13 ILE 90 118.203 2.877 9.654 717 H GLY 91 H GLY 91 113.682 1.457 7.258 718 HA2 GLY 91 HA2 GLY 91 112.238 4.026 6.732 719 HA3 GLY 91 HA3 GLY 91 111.598 2.556 5.954 720 H LYS 92 H LYS 92 112.009 4.277 8.967 721 HA LYS 92 HA LYS 92 110.927 2.002 10.556 722 HB2 LYS 92 HB2 LYS 92 111.179 3.477 12.469 723 HB3 LYS 92 HB3 LYS 92 112.640 3.635 11.465 724 HG2 LYS 92 HG2 LYS 92 111.169 5.575 10.321 725 HG3 LYS 92 HG3 LYS 92 110.413 5.595 11.932 726 HD2 LYS 92 HD2 LYS 92 113.396 5.863 11.345 727 HD3 LYS 92 HD3 LYS 92 112.306 7.177 11.849 728 HE2 LYS 92 HE2 LYS 92 111.775 5.736 13.916 729 HE3 LYS 92 HE3 LYS 92 113.171 4.736 13.445 730 HZ1 LYS 92 HZ1 LYS 92 113.799 6.472 14.987 731 HZ2 LYS 92 HZ2 LYS 92 113.240 7.642 13.967 732 HZ3 LYS 92 HZ3 LYS 92 114.534 6.716 13.531 733 H PHE 93 H PHE 93 108.817 1.600 10.042 734 HA PHE 93 HA PHE 93 106.953 3.983 10.073 735 HB2 PHE 93 HB2 PHE 93 107.027 1.471 8.393 736 HB3 PHE 93 HB3 PHE 93 105.469 2.261 8.720 737 HD1 PHE 93 HD1 PHE 93 107.602 4.929 8.896 738 HD2 PHE 93 HD2 PHE 93 106.120 2.146 5.980 739 HE1 PHE 93 HE1 PHE 93 108.057 6.571 7.096 740 HE2 PHE 93 HE2 PHE 93 106.575 3.789 4.181 741 HZ PHE 93 HZ PHE 93 107.544 6.002 4.739 742 H LYS 94 H LYS 94 105.061 3.800 11.219 743 HA LYS 94 HA LYS 94 104.680 1.236 12.760 744 HB2 LYS 94 HB2 LYS 94 104.377 2.378 14.809 745 HB3 LYS 94 HB3 LYS 94 105.789 3.184 14.087 746 HG2 LYS 94 HG3 LYS 94 104.112 4.860 13.074 747 HG3 LYS 94 HG2 LYS 94 102.912 4.162 14.187 748 HD2 LYS 94 HD2 LYS 94 104.611 4.594 16.063 749 HD3 LYS 94 HD3 LYS 94 105.516 5.572 14.883 750 HE2 LYS 94 HE2 LYS 94 102.620 6.004 15.742 751 HE3 LYS 94 HE3 LYS 94 104.013 7.016 16.191 752 HZ1 LYS 94 HZ1 LYS 94 103.239 8.129 14.390 753 HZ2 LYS 94 HZ2 LYS 94 102.652 6.788 13.629 754 HZ3 LYS 94 HZ3 LYS 94 104.271 7.104 13.612 755 H ARG 95 H ARG 95 102.682 0.464 12.366 756 HA ARG 95 HA ARG 95 100.738 1.694 10.749 757 HB2 ARG 95 HB2 ARG 95 100.328 -0.189 13.114 758 HB3 ARG 95 HB3 ARG 95 99.066 0.211 11.924 759 HG2 ARG 95 HG2 ARG 95 100.861 -0.511 10.151 760 HG3 ARG 95 HG3 ARG 95 101.643 -1.328 11.525 761 HD2 ARG 95 HD3 ARG 95 100.070 -2.831 10.289 762 HD3 ARG 95 HD2 ARG 95 99.587 -2.589 11.985 763 HE ARG 95 HE ARG 95 98.262 -0.589 10.406 764 HH11 ARG 95 HH11 ARG 95 96.109 -0.945 9.819 765 HH12 ARG 95 HH12 ARG 95 95.456 -2.567 9.829 766 HH21 ARG 95 HH21 ARG 95 98.433 -4.034 10.882 767 HH22 ARG 95 HH22 ARG 95 96.766 -4.310 10.429 768 H THR 96 H THR 96 99.804 3.659 11.007 769 HA THR 96 HA THR 96 99.704 4.995 13.596 770 HB THR 96 HB THR 96 97.805 6.250 11.987 771 HG1 THR 96 HG1 THR 96 99.914 5.294 10.325 772 HG21 THR 96 HG21 THR 96 99.646 7.830 11.497 773 HG22 THR 96 HG22 THR 96 99.692 7.302 13.196 774 HG23 THR 96 HG23 THR 96 100.832 6.609 12.017 775 H ASP 97 H ASP 97 97.921 2.575 12.204 776 HA ASP 97 HA ASP 97 95.304 3.227 13.402 777 HB2 ASP 97 HB2 ASP 97 95.746 1.771 11.316 778 HB3 ASP 97 HB3 ASP 97 96.241 0.495 12.454 779 H ASN 98 H ASN 98 97.897 0.826 14.066 780 HA ASN 98 HA ASN 98 96.921 0.812 16.925 781 HB2 ASN 98 HB3 ASN 98 97.553 -1.541 15.113 782 HB3 ASN 98 HB2 ASN 98 97.631 -1.682 16.886 783 HD21 ASN 98 HD21 ASN 98 95.713 -3.206 15.460 784 HD22 ASN 98 HD22 ASN 98 94.121 -2.562 15.792 785 H GLY 99 H GLY 99 99.343 1.779 15.028 786 HA2 GLY 99 HA2 GLY 99 101.690 1.987 15.317 787 HA3 GLY 99 HA3 GLY 99 101.297 2.028 17.052 788 H ASN 100 H ASN 100 101.002 -0.606 14.619 789 HA ASN 100 HA ASN 100 102.151 -2.503 16.570 790 HB2 ASN 100 HB2 ASN 100 100.958 -2.637 13.833 791 HB3 ASN 100 HB3 ASN 100 102.117 -3.919 14.259 792 HD21 ASN 100 HD21 ASN 100 101.597 -4.196 17.043 793 HD22 ASN 100 HD22 ASN 100 99.957 -4.770 17.248 794 H GLU 101 H GLU 101 103.636 -0.138 15.161 795 HA GLU 101 HA GLU 101 105.826 0.256 14.380 796 HB2 GLU 101 HB3 GLU 101 105.972 -2.000 16.326 797 HB3 GLU 101 HB2 GLU 101 107.405 -1.768 15.296 798 HG2 GLU 101 HG2 GLU 101 107.643 0.529 16.013 799 HG3 GLU 101 HG3 GLU 101 106.071 0.490 16.848 800 H LEU 102 H LEU 102 107.117 -0.153 12.602 801 HA LEU 102 HA LEU 102 107.001 -2.874 11.354 802 HB2 LEU 102 HB3 LEU 102 105.340 -2.093 9.960 803 HB3 LEU 102 HB2 LEU 102 105.749 -0.390 10.259 804 HG LEU 102 HG LEU 102 107.751 -0.628 8.789 805 HD11 LEU 102 HD11 LEU 102 106.885 -3.107 7.500 806 HD12 LEU 102 HD12 LEU 102 107.316 -3.378 9.205 807 HD13 LEU 102 HD13 LEU 102 108.498 -2.647 8.094 808 HD21 LEU 102 HD21 LEU 102 105.587 0.142 7.842 809 HD22 LEU 102 HD22 LEU 102 105.134 -1.547 7.511 810 HD23 LEU 102 HD23 LEU 102 106.506 -0.809 6.651 811 H ASN 103 H ASN 103 109.017 -3.403 10.563 812 HA ASN 103 HA ASN 103 110.985 -1.107 10.363 813 HB2 ASN 103 HB2 ASN 103 112.124 -3.820 10.609 814 HB3 ASN 103 HB3 ASN 103 112.507 -2.341 11.522 815 HD21 ASN 103 HD21 ASN 103 111.854 -2.342 13.677 816 HD22 ASN 103 HD22 ASN 103 110.608 -3.378 14.334 817 H THR 104 H THR 104 111.320 -0.645 8.235 818 HA THR 104 HA THR 104 111.546 -3.025 6.380 819 HB THR 104 HB THR 104 109.449 -1.934 5.889 820 HG1 THR 104 HG1 THR 104 110.165 -2.216 3.907 821 HG21 THR 104 HG21 THR 104 109.627 0.599 5.228 822 HG22 THR 104 HG22 THR 104 111.132 0.567 6.178 823 HG23 THR 104 HG23 THR 104 109.581 0.166 6.954 824 H VAL 105 H VAL 105 112.563 -2.234 4.212 825 HA VAL 105 HA VAL 105 114.658 -0.140 4.635 826 HB VAL 105 HB VAL 105 115.337 -3.012 3.855 827 HG11 VAL 105 HG11 VAL 105 117.700 -1.888 4.416 828 HG12 VAL 105 HG12 VAL 105 116.973 -1.746 2.798 829 HG13 VAL 105 HG13 VAL 105 116.832 -0.403 3.958 830 HG21 VAL 105 HG21 VAL 105 116.518 -3.076 6.037 831 HG22 VAL 105 HG22 VAL 105 114.773 -2.801 6.259 832 HG23 VAL 105 HG23 VAL 105 115.914 -1.443 6.409 833 H ARG 106 H ARG 106 115.786 0.338 2.522 834 HA ARG 106 HA ARG 106 114.140 -0.591 0.163 835 HB2 ARG 106 HB2 ARG 106 113.640 1.816 1.168 836 HB3 ARG 106 HB3 ARG 106 115.129 2.256 0.298 837 HG2 ARG 106 HG2 ARG 106 114.203 1.458 -1.808 838 HG3 ARG 106 HG3 ARG 106 112.770 0.804 -0.979 839 HD2 ARG 106 HD2 ARG 106 113.403 3.714 -0.584 840 HD3 ARG 106 HD3 ARG 106 112.740 3.219 -2.160 841 HE ARG 106 HE ARG 106 111.169 2.035 -0.023 842 HH11 ARG 106 HH11 ARG 106 109.154 2.973 0.394 843 HH12 ARG 106 HH12 ARG 106 108.812 4.594 -0.167 844 HH21 ARG 106 HH21 ARG 106 111.940 5.022 -1.636 845 HH22 ARG 106 HH22 ARG 106 110.382 5.749 -1.312 846 H GLU 107 H GLU 107 115.315 -0.976 -1.688 847 HA GLU 107 HA GLU 107 118.184 -0.073 -1.745 848 HB2 GLU 107 HB2 GLU 107 117.203 -2.947 -1.998 849 HB3 GLU 107 HB3 GLU 107 118.817 -2.413 -2.523 850 HG2 GLU 107 HG2 GLU 107 119.268 -1.577 -0.219 851 HG3 GLU 107 HG3 GLU 107 117.672 -2.173 0.295 852 H ILE 108 H ILE 108 119.103 -0.219 -3.951 853 HA ILE 108 HA ILE 108 116.915 -0.244 -6.040 854 HB ILE 108 HB ILE 108 119.520 1.336 -6.078 855 HG12 ILE 108 HG12 ILE 108 117.439 1.837 -4.356 856 HG13 ILE 108 HG13 ILE 108 118.503 3.095 -5.024 857 HG21 ILE 108 HG21 ILE 108 118.693 0.920 -8.290 858 HG22 ILE 108 HG22 ILE 108 117.017 1.258 -7.798 859 HG23 ILE 108 HG23 ILE 108 118.205 2.581 -7.877 860 HD11 ILE 108 HD11 ILE 108 115.998 3.537 -5.257 861 HD12 ILE 108 HD12 ILE 108 115.951 2.177 -6.405 862 HD13 ILE 108 HD13 ILE 108 116.932 3.617 -6.771 863 H ILE 109 H ILE 109 117.385 -2.542 -6.279 864 HA ILE 109 HA ILE 109 120.028 -3.531 -6.867 865 HB ILE 109 HB ILE 109 117.227 -4.497 -7.515 866 HG12 ILE 109 HG12 ILE 109 118.471 -4.579 -5.190 867 HG13 ILE 109 HG13 ILE 109 117.593 -6.015 -5.766 868 HG21 ILE 109 HG21 ILE 109 118.385 -5.369 -9.382 869 HG22 ILE 109 HG22 ILE 109 119.895 -5.581 -8.463 870 HG23 ILE 109 HG23 ILE 109 118.518 -6.673 -8.178 871 HD11 ILE 109 HD11 ILE 109 120.030 -6.324 -4.866 872 HD12 ILE 109 HD12 ILE 109 119.581 -7.133 -6.386 873 HD13 ILE 109 HD13 ILE 109 120.527 -5.625 -6.426 874 H GLY 110 H GLY 110 121.052 -2.116 -8.304 875 HA2 GLY 110 HA2 GLY 110 121.608 -1.230 -10.421 876 HA3 GLY 110 HA3 GLY 110 120.902 -2.728 -11.071 877 H ASP 111 H ASP 111 118.505 -2.730 -11.413 878 HA ASP 111 HA ASP 111 117.454 0.070 -11.846 879 HB2 ASP 111 HB2 ASP 111 117.488 -2.273 -13.778 880 HB3 ASP 111 HB3 ASP 111 116.349 -0.917 -13.955 881 H GLU 112 H GLU 112 116.961 -1.947 -9.702 882 HA GLU 112 HA GLU 112 113.976 -2.097 -10.109 883 HB2 GLU 112 HB3 GLU 112 115.858 -4.324 -9.260 884 HB3 GLU 112 HB2 GLU 112 114.137 -4.336 -8.807 885 HG2 GLU 112 HG2 GLU 112 113.419 -4.513 -11.037 886 HG3 GLU 112 HG3 GLU 112 114.943 -3.860 -11.683 887 H LEU 113 H LEU 113 112.774 -1.784 -8.159 888 HA LEU 113 HA LEU 113 114.502 -0.759 -5.902 889 HB2 LEU 113 HB3 LEU 113 112.681 0.713 -6.947 890 HB3 LEU 113 HB2 LEU 113 111.497 -0.398 -6.218 891 HG LEU 113 HG LEU 113 112.828 0.012 -4.002 892 HD11 LEU 113 HD11 LEU 113 114.736 1.182 -5.072 893 HD12 LEU 113 HD12 LEU 113 113.909 2.242 -3.906 894 HD13 LEU 113 HD13 LEU 113 113.631 2.451 -5.652 895 HD21 LEU 113 HD21 LEU 113 111.450 2.024 -3.544 896 HD22 LEU 113 HD22 LEU 113 110.521 0.803 -4.446 897 HD23 LEU 113 HD23 LEU 113 111.171 2.229 -5.290 898 H VAL 114 H VAL 114 114.846 -2.197 -4.299 899 HA VAL 114 HA VAL 114 112.710 -4.277 -3.828 900 HB VAL 114 HB VAL 114 115.534 -4.271 -2.703 901 HG11 VAL 114 HG11 VAL 114 115.117 -6.713 -2.576 902 HG12 VAL 114 HG12 VAL 114 113.883 -5.803 -1.672 903 HG13 VAL 114 HG13 VAL 114 113.498 -6.471 -3.276 904 HG21 VAL 114 HG21 VAL 114 115.834 -5.984 -4.696 905 HG22 VAL 114 HG22 VAL 114 116.025 -4.240 -4.995 906 HG23 VAL 114 HG23 VAL 114 114.506 -5.056 -5.435 907 H GLN 115 H GLN 115 111.296 -3.519 -2.322 908 HA GLN 115 HA GLN 115 112.473 -2.068 0.055 909 HB2 GLN 115 HB3 GLN 115 110.642 -0.949 -1.335 910 HB3 GLN 115 HB2 GLN 115 109.544 -2.233 -0.775 911 HG2 GLN 115 HG2 GLN 115 109.649 -1.522 1.469 912 HG3 GLN 115 HG3 GLN 115 111.174 -0.639 1.218 913 HE21 GLN 115 HE21 GLN 115 107.865 -0.602 -0.306 914 HE22 GLN 115 HE22 GLN 115 107.719 1.141 -0.258 915 H THR 116 H THR 116 112.897 -3.531 1.655 916 HA THR 116 HA THR 116 111.009 -5.857 1.932 917 HB THR 116 HB THR 116 113.438 -5.576 3.665 918 HG1 THR 116 HG1 THR 116 114.326 -4.989 1.711 919 HG21 THR 116 HG21 THR 116 113.557 -8.013 3.191 920 HG22 THR 116 HG22 THR 116 111.954 -7.546 3.807 921 HG23 THR 116 HG23 THR 116 112.184 -7.854 2.069 922 H TYR 117 H TYR 117 109.880 -6.239 3.831 923 HA TYR 117 HA TYR 117 110.100 -4.062 5.917 924 HB2 TYR 117 HB2 TYR 117 107.475 -5.455 5.423 925 HB3 TYR 117 HB3 TYR 117 107.789 -3.845 6.112 926 HD1 TYR 117 HD1 TYR 117 108.405 -5.745 2.965 927 HD2 TYR 117 HD2 TYR 117 107.315 -2.016 4.765 928 HE1 TYR 117 HE1 TYR 117 108.050 -4.772 0.714 929 HE2 TYR 117 HE2 TYR 117 106.965 -1.022 2.519 930 HH TYR 117 HH TYR 117 106.805 -2.911 -0.333 931 H VAL 118 H VAL 118 109.718 -4.697 8.021 932 HA VAL 118 HA VAL 118 109.672 -7.692 8.468 933 HB VAL 118 HB VAL 118 110.870 -5.649 10.370 934 HG11 VAL 118 HG11 VAL 118 111.589 -7.482 11.592 935 HG12 VAL 118 HG12 VAL 118 110.104 -8.164 10.888 936 HG13 VAL 118 HG13 VAL 118 111.685 -8.534 10.159 937 HG21 VAL 118 HG21 VAL 118 112.102 -5.543 8.223 938 HG22 VAL 118 HG22 VAL 118 112.303 -7.312 8.253 939 HG23 VAL 118 HG23 VAL 118 113.087 -6.305 9.494 940 H TYR 119 H TYR 119 108.373 -8.408 10.161 941 HA TYR 119 HA TYR 119 106.793 -6.301 11.581 942 HB2 TYR 119 HB2 TYR 119 105.767 -7.364 9.289 943 HB3 TYR 119 HB3 TYR 119 105.154 -8.528 10.489 944 HD1 TYR 119 HD1 TYR 119 103.896 -7.674 12.487 945 HD2 TYR 119 HD2 TYR 119 104.852 -5.161 9.142 946 HE1 TYR 119 HE1 TYR 119 102.153 -6.064 13.201 947 HE2 TYR 119 HE2 TYR 119 103.114 -3.543 9.859 948 HH TYR 119 HH TYR 119 101.966 -3.037 12.375 949 H GLU 120 H GLU 120 107.151 -6.800 13.618 950 HA GLU 120 HA GLU 120 107.367 -8.058 15.593 951 HB2 GLU 120 HB3 GLU 120 105.096 -9.401 14.113 952 HB3 GLU 120 HB2 GLU 120 105.636 -10.011 15.695 953 HG2 GLU 120 HG3 GLU 120 105.140 -7.940 16.779 954 HG3 GLU 120 HG2 GLU 120 104.983 -7.079 15.228 955 H GLY 121 H GLY 121 108.853 -8.969 13.024 956 HA2 GLY 121 HA2 GLY 121 110.767 -10.551 13.368 957 HA3 GLY 121 HA3 GLY 121 109.635 -11.646 14.199 958 H VAL 122 H VAL 122 108.665 -9.869 11.345 959 HA VAL 122 HA VAL 122 108.872 -12.443 9.784 960 HB VAL 122 HB VAL 122 106.504 -11.364 10.501 961 HG11 VAL 122 HG11 VAL 122 106.909 -10.147 7.760 962 HG12 VAL 122 HG12 VAL 122 107.288 -9.217 9.230 963 HG13 VAL 122 HG13 VAL 122 105.634 -9.815 8.957 964 HG21 VAL 122 HG21 VAL 122 105.557 -12.479 8.504 965 HG22 VAL 122 HG22 VAL 122 106.857 -13.450 9.234 966 HG23 VAL 122 HG23 VAL 122 107.172 -12.507 7.758 967 H GLU 123 H GLU 123 108.657 -11.770 7.315 968 HA GLU 123 HA GLU 123 109.917 -9.129 6.833 969 HB2 GLU 123 HB3 GLU 123 111.514 -11.548 7.125 970 HB3 GLU 123 HB2 GLU 123 111.680 -10.880 5.484 971 HG2 GLU 123 HG2 GLU 123 112.165 -8.637 6.477 972 HG3 GLU 123 HG3 GLU 123 112.080 -9.361 8.101 973 H ALA 124 H ALA 124 108.843 -8.396 5.097 974 HA ALA 124 HA ALA 124 108.157 -10.402 2.935 975 HB1 ALA 124 HB1 ALA 124 106.716 -8.024 2.456 976 HB2 ALA 124 HB2 ALA 124 106.069 -9.545 3.115 977 HB3 ALA 124 HB3 ALA 124 106.629 -8.265 4.218 978 H LYS 125 H LYS 125 108.176 -9.351 0.662 979 HA LYS 125 HA LYS 125 110.158 -7.105 0.523 980 HB2 LYS 125 HB2 LYS 125 111.267 -9.487 0.466 981 HB3 LYS 125 HB3 LYS 125 110.627 -9.545 -1.194 982 HG2 LYS 125 HG3 LYS 125 111.831 -7.527 -1.800 983 HG3 LYS 125 HG2 LYS 125 112.317 -7.251 -0.110 984 HD2 LYS 125 HD2 LYS 125 114.240 -8.264 -0.962 985 HD3 LYS 125 HD3 LYS 125 113.361 -9.682 -0.343 986 HE2 LYS 125 HE2 LYS 125 112.308 -9.821 -2.712 987 HE3 LYS 125 HE3 LYS 125 113.609 -8.713 -3.210 988 HZ1 LYS 125 HZ1 LYS 125 114.246 -11.015 -3.489 989 HZ2 LYS 125 HZ2 LYS 125 115.199 -10.297 -2.350 990 HZ3 LYS 125 HZ3 LYS 125 113.994 -11.325 -1.888 991 H ARG 126 H ARG 126 109.838 -5.779 -1.171 992 HA ARG 126 HA ARG 126 107.911 -6.705 -3.318 993 HB2 ARG 126 HB2 ARG 126 107.796 -4.388 -1.496 994 HB3 ARG 126 HB3 ARG 126 107.700 -3.916 -3.209 995 HG2 ARG 126 HG2 ARG 126 105.909 -5.703 -3.497 996 HG3 ARG 126 HG3 ARG 126 105.913 -5.893 -1.727 997 HD2 ARG 126 HD2 ARG 126 105.238 -3.594 -1.403 998 HD3 ARG 126 HD3 ARG 126 105.476 -3.223 -3.127 999 HE ARG 126 HE ARG 126 103.555 -5.378 -2.866 1000 HH11 ARG 126 HH11 ARG 126 101.375 -4.846 -3.140 1001 HH12 ARG 126 HH12 ARG 126 100.857 -3.181 -3.002 1002 HH21 ARG 126 HH21 ARG 126 104.054 -1.974 -2.333 1003 HH22 ARG 126 HH22 ARG 126 102.367 -1.562 -2.547 1004 H ILE 127 H ILE 127 109.091 -6.858 -5.183 1005 HA ILE 127 HA ILE 127 111.419 -4.953 -5.480 1006 HB ILE 127 HB ILE 127 110.829 -7.475 -7.080 1007 HG12 ILE 127 HG12 ILE 127 112.972 -7.406 -4.983 1008 HG13 ILE 127 HG13 ILE 127 111.290 -7.550 -4.418 1009 HG21 ILE 127 HG21 ILE 127 112.361 -5.833 -8.133 1010 HG22 ILE 127 HG22 ILE 127 113.232 -7.307 -7.645 1011 HG23 ILE 127 HG23 ILE 127 113.364 -5.829 -6.662 1012 HD11 ILE 127 HD11 ILE 127 112.295 -9.785 -4.799 1013 HD12 ILE 127 HD12 ILE 127 110.949 -9.489 -5.925 1014 HD13 ILE 127 HD13 ILE 127 112.631 -9.346 -6.490 1015 H PHE 128 H PHE 128 111.157 -3.289 -6.844 1016 HA PHE 128 HA PHE 128 108.956 -3.478 -8.895 1017 HB2 PHE 128 HB3 PHE 128 110.603 -1.053 -8.028 1018 HB3 PHE 128 HB2 PHE 128 109.167 -1.038 -9.073 1019 HD1 PHE 128 HD1 PHE 128 108.096 -3.447 -7.112 1020 HD2 PHE 128 HD2 PHE 128 109.242 0.657 -6.661 1021 HE1 PHE 128 HE1 PHE 128 106.620 -3.259 -5.130 1022 HE2 PHE 128 HE2 PHE 128 107.774 0.852 -4.672 1023 HZ PHE 128 HZ PHE 128 106.459 -1.108 -3.905 1024 H LYS 129 H LYS 129 109.490 -2.449 -11.050 1025 HA LYS 129 HA LYS 129 112.380 -2.525 -11.797 1026 HB2 LYS 129 HB2 LYS 129 111.438 -4.899 -12.005 1027 HB3 LYS 129 HB3 LYS 129 110.366 -4.266 -13.277 1028 HG2 LYS 129 HG3 LYS 129 112.679 -3.268 -14.204 1029 HG3 LYS 129 HG2 LYS 129 113.348 -4.643 -13.293 1030 HD2 LYS 129 HD3 LYS 129 111.717 -6.149 -14.489 1031 HD3 LYS 129 HD2 LYS 129 111.224 -4.755 -15.480 1032 HE2 LYS 129 HE2 LYS 129 113.679 -4.486 -16.121 1033 HE3 LYS 129 HE3 LYS 129 113.975 -6.056 -15.337 1034 HZ1 LYS 129 HZ1 LYS 129 113.552 -6.303 -17.691 1035 HZ2 LYS 129 HZ2 LYS 129 112.080 -5.574 -17.548 1036 HZ3 LYS 129 HZ3 LYS 129 112.353 -7.029 -16.821 1037 H LYS 130 H LYS 130 112.784 -1.331 -13.710 1038 HA LYS 130 HA LYS 130 111.097 0.845 -14.305 1039 HB2 LYS 130 HB2 LYS 130 113.499 -0.253 -15.353 1040 HB3 LYS 130 HB3 LYS 130 112.408 -0.049 -16.744 1041 HG2 LYS 130 HG3 LYS 130 111.970 2.310 -15.988 1042 HG3 LYS 130 HG2 LYS 130 113.183 2.084 -14.705 1043 HD2 LYS 130 HD2 LYS 130 114.030 1.365 -17.484 1044 HD3 LYS 130 HD3 LYS 130 113.798 3.097 -17.147 1045 HE2 LYS 130 HE3 LYS 130 116.150 2.186 -16.705 1046 HE3 LYS 130 HE2 LYS 130 115.392 3.053 -15.348 1047 HZ1 LYS 130 HZ1 LYS 130 116.420 0.906 -14.746 1048 HZ2 LYS 130 HZ2 LYS 130 114.819 0.994 -14.359 1049 HZ3 LYS 130 HZ3 LYS 130 115.302 0.124 -15.674 1050 H ASP 131 H ASP 131 109.289 1.171 -15.555 1051 HA ASP 131 HA ASP 131 107.623 -1.054 -16.262 1052 HB2 ASP 131 HB2 ASP 131 106.424 0.691 -17.723 1053 HB3 ASP 131 HB3 ASP 131 106.591 1.092 -15.997 Start of MODEL 11 1 H1 ALA 1 H1 ALA 1 117.149 8.939 -8.090 2 H2 ALA 1 H2 ALA 1 116.726 8.707 -6.513 3 H3 ALA 1 H3 ALA 1 118.318 8.796 -6.935 4 HA ALA 1 HA ALA 1 118.161 6.761 -8.206 5 HB1 ALA 1 HB1 ALA 1 117.834 5.232 -6.282 6 HB2 ALA 1 HB2 ALA 1 118.802 6.651 -5.815 7 HB3 ALA 1 HB3 ALA 1 117.084 6.556 -5.358 8 H PHE 2 H PHE 2 116.823 4.893 -8.751 9 HA PHE 2 HA PHE 2 114.813 4.189 -9.829 10 HB2 PHE 2 HB3 PHE 2 114.685 3.948 -7.068 11 HB3 PHE 2 HB2 PHE 2 113.178 4.816 -7.444 12 HD1 PHE 2 HD1 PHE 2 115.194 2.078 -9.090 13 HD2 PHE 2 HD2 PHE 2 111.355 3.413 -7.697 14 HE1 PHE 2 HE1 PHE 2 114.163 -0.029 -9.903 15 HE2 PHE 2 HE2 PHE 2 110.330 1.306 -8.506 16 HZ PHE 2 HZ PHE 2 111.734 -0.414 -9.606 17 H ASP 3 H ASP 3 115.427 7.073 -10.077 18 HA ASP 3 HA ASP 3 112.916 8.549 -9.739 19 HB2 ASP 3 HB2 ASP 3 115.057 9.734 -9.812 20 HB3 ASP 3 HB3 ASP 3 115.384 9.102 -11.443 21 H SER 4 H SER 4 111.216 7.496 -10.800 22 HA SER 4 HA SER 4 110.581 8.086 -13.436 23 HB2 SER 4 HB3 SER 4 112.562 5.843 -13.296 24 HB3 SER 4 HB2 SER 4 111.201 5.648 -14.427 25 HG SER 4 HG SER 4 112.104 7.096 -15.676 26 H THR 5 H THR 5 109.439 5.734 -14.456 27 HA THR 5 HA THR 5 107.423 5.195 -12.292 28 HB THR 5 HB THR 5 107.392 4.784 -15.311 29 HG1 THR 5 HG1 THR 5 105.696 6.350 -15.092 30 HG21 THR 5 HG21 THR 5 104.932 4.184 -14.835 31 HG22 THR 5 HG22 THR 5 106.145 2.945 -14.433 32 HG23 THR 5 HG23 THR 5 105.433 3.944 -13.144 33 H TRP 6 H TRP 6 106.976 3.108 -11.583 34 HA TRP 6 HA TRP 6 108.467 0.840 -12.850 35 HB2 TRP 6 HB2 TRP 6 108.656 1.275 -9.857 36 HB3 TRP 6 HB3 TRP 6 109.637 0.210 -10.892 37 HD1 TRP 6 HD1 TRP 6 108.953 4.007 -10.471 38 HE1 TRP 6 HE1 TRP 6 111.128 5.302 -10.966 39 HE3 TRP 6 HE3 TRP 6 111.938 0.095 -11.813 40 HZ2 TRP 6 HZ2 TRP 6 113.811 4.693 -11.843 41 HZ3 TRP 6 HZ3 TRP 6 114.292 0.473 -12.473 42 HH2 TRP 6 HH2 TRP 6 115.236 2.766 -12.488 43 H LYS 7 H LYS 7 107.777 -1.286 -11.715 44 HA LYS 7 HA LYS 7 105.150 -1.067 -10.321 45 HB2 LYS 7 HB2 LYS 7 103.843 -2.146 -11.954 46 HB3 LYS 7 HB3 LYS 7 104.846 -1.048 -12.931 47 HG2 LYS 7 HG2 LYS 7 106.506 -3.008 -13.142 48 HG3 LYS 7 HG3 LYS 7 105.205 -4.037 -12.495 49 HD2 LYS 7 HD2 LYS 7 103.709 -3.100 -14.342 50 HD3 LYS 7 HD3 LYS 7 105.173 -2.375 -15.047 51 HE2 LYS 7 HE2 LYS 7 104.499 -5.310 -14.676 52 HE3 LYS 7 HE3 LYS 7 104.985 -4.459 -16.162 53 HZ1 LYS 7 HZ1 LYS 7 106.903 -5.507 -15.507 54 HZ2 LYS 7 HZ2 LYS 7 106.641 -5.284 -13.894 55 HZ3 LYS 7 HZ3 LYS 7 107.118 -4.016 -14.835 56 H VAL 8 H VAL 8 104.994 -2.680 -8.839 57 HA VAL 8 HA VAL 8 107.059 -4.388 -8.139 58 HB VAL 8 HB VAL 8 105.350 -4.546 -6.612 59 HG11 VAL 8 HG11 VAL 8 102.913 -4.887 -7.386 60 HG12 VAL 8 HG12 VAL 8 103.513 -4.553 -9.028 61 HG13 VAL 8 HG13 VAL 8 103.666 -3.317 -7.757 62 HG21 VAL 8 HG21 VAL 8 104.448 -6.756 -6.568 63 HG22 VAL 8 HG22 VAL 8 105.981 -6.896 -7.461 64 HG23 VAL 8 HG23 VAL 8 104.436 -6.870 -8.344 65 H ASP 9 H ASP 9 108.249 -5.518 -9.554 66 HA ASP 9 HA ASP 9 106.837 -7.140 -11.653 67 HB2 ASP 9 HB2 ASP 9 108.836 -5.666 -12.230 68 HB3 ASP 9 HB3 ASP 9 109.833 -6.749 -11.230 69 H ARG 10 H ARG 10 108.821 -7.348 -8.737 70 HA ARG 10 HA ARG 10 108.104 -10.262 -8.615 71 HB2 ARG 10 HB3 ARG 10 110.918 -9.393 -7.912 72 HB3 ARG 10 HB2 ARG 10 110.306 -11.026 -8.270 73 HG2 ARG 10 HG2 ARG 10 109.759 -10.059 -10.633 74 HG3 ARG 10 HG3 ARG 10 110.875 -8.747 -10.187 75 HD2 ARG 10 HD3 ARG 10 111.441 -11.682 -10.604 76 HD3 ARG 10 HD2 ARG 10 112.343 -10.264 -11.190 77 HE ARG 10 HE ARG 10 112.590 -11.521 -8.495 78 HH11 ARG 10 HH11 ARG 10 114.334 -10.720 -7.301 79 HH12 ARG 10 HH12 ARG 10 115.182 -9.289 -7.843 80 HH21 ARG 10 HH21 ARG 10 113.187 -8.863 -10.664 81 HH22 ARG 10 HH22 ARG 10 114.535 -8.243 -9.739 82 H SER 11 H SER 11 108.520 -11.154 -6.376 83 HA SER 11 HA SER 11 109.000 -9.302 -4.167 84 HB2 SER 11 HB2 SER 11 106.111 -10.100 -4.742 85 HB3 SER 11 HB3 SER 11 106.677 -9.325 -3.243 86 HG SER 11 HG SER 11 105.997 -7.684 -4.588 87 H GLU 12 H GLU 12 108.089 -10.476 -2.017 88 HA GLU 12 HA GLU 12 107.957 -13.425 -2.355 89 HB2 GLU 12 HB2 GLU 12 110.019 -14.002 -1.489 90 HB3 GLU 12 HB3 GLU 12 110.473 -12.481 -2.293 91 HG2 GLU 12 HG2 GLU 12 109.810 -11.373 -0.002 92 HG3 GLU 12 HG3 GLU 12 110.004 -13.018 0.649 93 H ASN 13 H ASN 13 107.467 -14.520 -0.326 94 HA ASN 13 HA ASN 13 106.268 -14.656 1.699 95 HB2 ASN 13 HB3 ASN 13 108.009 -12.219 2.088 96 HB3 ASN 13 HB2 ASN 13 106.787 -12.631 3.314 97 HD21 ASN 13 HD21 ASN 13 108.728 -13.072 4.757 98 HD22 ASN 13 HD22 ASN 13 109.519 -14.626 4.619 99 H TYR 14 H TYR 14 105.987 -11.351 2.450 100 HA TYR 14 HA TYR 14 104.194 -9.827 2.229 101 HB2 TYR 14 HB2 TYR 14 104.345 -11.038 -0.288 102 HB3 TYR 14 HB3 TYR 14 102.645 -11.264 0.184 103 HD1 TYR 14 HD1 TYR 14 105.003 -8.481 1.073 104 HD2 TYR 14 HD2 TYR 14 101.468 -9.653 -1.074 105 HE1 TYR 14 HE1 TYR 14 104.539 -6.105 0.535 106 HE2 TYR 14 HE2 TYR 14 101.007 -7.277 -1.608 107 HH TYR 14 HH TYR 14 101.626 -4.968 -0.516 108 H ASP 15 H ASP 15 103.066 -13.221 1.714 109 HA ASP 15 HA ASP 15 100.547 -12.794 3.056 110 HB2 ASP 15 HB2 ASP 15 102.238 -15.321 2.804 111 HB3 ASP 15 HB3 ASP 15 100.551 -15.282 3.369 112 H LYS 16 H LYS 16 103.718 -13.962 4.254 113 HA LYS 16 HA LYS 16 102.852 -14.255 7.000 114 HB2 LYS 16 HB3 LYS 16 105.625 -13.501 5.968 115 HB3 LYS 16 HB2 LYS 16 105.242 -14.207 7.556 116 HG2 LYS 16 HG2 LYS 16 104.580 -15.561 4.907 117 HG3 LYS 16 HG3 LYS 16 106.069 -15.878 5.828 118 HD2 LYS 16 HD2 LYS 16 104.456 -16.318 7.839 119 HD3 LYS 16 HD3 LYS 16 103.197 -16.476 6.590 120 HE2 LYS 16 HE3 LYS 16 103.983 -18.689 6.836 121 HE3 LYS 16 HE2 LYS 16 104.891 -18.097 5.424 122 HZ1 LYS 16 HZ1 LYS 16 106.330 -19.177 7.019 123 HZ2 LYS 16 HZ2 LYS 16 106.717 -17.579 6.899 124 HZ3 LYS 16 HZ3 LYS 16 105.877 -18.128 8.207 125 H PHE 17 H PHE 17 103.990 -11.519 5.066 126 HA PHE 17 HA PHE 17 104.241 -9.677 7.324 127 HB2 PHE 17 HB2 PHE 17 105.337 -9.327 5.128 128 HB3 PHE 17 HB3 PHE 17 103.741 -9.183 4.355 129 HD1 PHE 17 HD1 PHE 17 105.919 -7.696 6.982 130 HD2 PHE 17 HD2 PHE 17 102.611 -7.104 4.317 131 HE1 PHE 17 HE1 PHE 17 105.904 -5.283 7.546 132 HE2 PHE 17 HE2 PHE 17 102.584 -4.688 4.884 133 HZ PHE 17 HZ PHE 17 104.234 -3.776 6.497 134 H MET 18 H MET 18 101.840 -9.849 4.672 135 HA MET 18 HA MET 18 99.932 -8.109 5.928 136 HB2 MET 18 HB2 MET 18 99.370 -10.448 4.051 137 HB3 MET 18 HB3 MET 18 98.308 -9.051 4.349 138 HG2 MET 18 HG2 MET 18 101.153 -8.636 3.403 139 HG3 MET 18 HG3 MET 18 99.866 -9.028 2.238 140 HE1 MET 18 HE1 MET 18 100.297 -5.239 1.656 141 HE2 MET 18 HE2 MET 18 101.550 -6.450 2.017 142 HE3 MET 18 HE3 MET 18 100.197 -6.865 0.937 143 H GLU 19 H GLU 19 100.742 -11.471 6.507 144 HA GLU 19 HA GLU 19 98.213 -12.110 7.868 145 HB2 GLU 19 HB3 GLU 19 99.574 -13.918 6.956 146 HB3 GLU 19 HB2 GLU 19 100.967 -13.419 7.945 147 HG2 GLU 19 HG2 GLU 19 99.805 -13.988 9.995 148 HG3 GLU 19 HG3 GLU 19 98.283 -14.267 9.115 149 H LYS 20 H LYS 20 101.433 -10.942 8.848 150 HA LYS 20 HA LYS 20 100.954 -11.146 11.700 151 HB2 LYS 20 HB2 LYS 20 102.757 -9.328 10.049 152 HB3 LYS 20 HB3 LYS 20 102.763 -9.354 11.829 153 HG2 LYS 20 HG3 LYS 20 103.009 -11.960 10.327 154 HG3 LYS 20 HG2 LYS 20 104.434 -10.902 10.458 155 HD2 LYS 20 HD2 LYS 20 104.193 -10.870 12.920 156 HD3 LYS 20 HD3 LYS 20 102.753 -11.909 12.799 157 HE2 LYS 20 HE2 LYS 20 104.131 -13.679 11.728 158 HE3 LYS 20 HE3 LYS 20 105.569 -12.641 11.879 159 HZ1 LYS 20 HZ1 LYS 20 105.404 -14.203 13.700 160 HZ2 LYS 20 HZ2 LYS 20 105.252 -12.660 14.262 161 HZ3 LYS 20 HZ3 LYS 20 103.919 -13.621 14.122 162 H MET 21 H MET 21 100.509 -8.462 9.361 163 HA MET 21 HA MET 21 99.506 -6.572 11.300 164 HB2 MET 21 HB2 MET 21 99.549 -6.852 8.348 165 HB3 MET 21 HB3 MET 21 98.154 -5.937 8.967 166 HG2 MET 21 HG3 MET 21 99.842 -4.609 10.384 167 HG3 MET 21 HG2 MET 21 101.113 -5.364 9.392 168 HE1 MET 21 HE1 MET 21 101.278 -3.533 6.260 169 HE2 MET 21 HE2 MET 21 101.240 -5.225 6.810 170 HE3 MET 21 HE3 MET 21 102.141 -4.006 7.743 171 H GLY 22 H GLY 22 98.214 -9.527 10.244 172 HA2 GLY 22 HA2 GLY 22 96.143 -10.523 10.856 173 HA3 GLY 22 HA3 GLY 22 95.713 -9.022 11.711 174 H VAL 23 H VAL 23 96.750 -8.985 8.347 175 HA VAL 23 HA VAL 23 94.237 -7.669 7.572 176 HB VAL 23 HB VAL 23 96.318 -8.817 5.677 177 HG11 VAL 23 HG11 VAL 23 93.988 -7.588 5.117 178 HG12 VAL 23 HG12 VAL 23 95.451 -7.318 4.141 179 HG13 VAL 23 HG13 VAL 23 94.987 -6.140 5.392 180 HG21 VAL 23 HG21 VAL 23 97.275 -6.373 5.964 181 HG22 VAL 23 HG22 VAL 23 97.729 -7.635 7.134 182 HG23 VAL 23 HG23 VAL 23 96.470 -6.447 7.550 183 H ASN 24 H ASN 24 92.432 -8.595 6.695 184 HA ASN 24 HA ASN 24 91.892 -11.361 6.886 185 HB2 ASN 24 HB2 ASN 24 90.364 -9.281 6.250 186 HB3 ASN 24 HB3 ASN 24 90.712 -9.808 4.586 187 HD21 ASN 24 HD21 ASN 24 90.479 -12.386 4.352 188 HD22 ASN 24 HD22 ASN 24 89.040 -13.048 5.096 189 H ILE 25 H ILE 25 91.489 -12.909 5.001 190 HA ILE 25 HA ILE 25 93.996 -13.046 3.422 191 HB ILE 25 HB ILE 25 91.635 -14.840 3.941 192 HG12 ILE 25 HG12 ILE 25 93.915 -14.703 5.220 193 HG13 ILE 25 HG13 ILE 25 93.280 -16.305 4.779 194 HG21 ILE 25 HG21 ILE 25 92.598 -16.430 2.208 195 HG22 ILE 25 HG22 ILE 25 91.781 -15.000 1.534 196 HG23 ILE 25 HG23 ILE 25 93.558 -15.065 1.590 197 HD11 ILE 25 HD11 ILE 25 95.793 -15.749 4.259 198 HD12 ILE 25 HD12 ILE 25 95.128 -14.822 2.894 199 HD13 ILE 25 HD13 ILE 25 94.820 -16.571 3.016 200 H VAL 26 H VAL 26 91.182 -11.428 3.093 201 HA VAL 26 HA VAL 26 90.604 -11.905 0.256 202 HB VAL 26 HB VAL 26 89.858 -9.686 2.203 203 HG11 VAL 26 HG11 VAL 26 89.974 -8.778 -0.101 204 HG12 VAL 26 HG12 VAL 26 88.947 -10.113 -0.678 205 HG13 VAL 26 HG13 VAL 26 88.286 -8.906 0.452 206 HG21 VAL 26 HG21 VAL 26 88.830 -11.912 2.577 207 HG22 VAL 26 HG22 VAL 26 87.619 -10.735 2.015 208 HG23 VAL 26 HG23 VAL 26 88.279 -11.942 0.885 209 H LYS 27 H LYS 27 91.992 -9.064 1.975 210 HA LYS 27 HA LYS 27 92.940 -7.817 -0.463 211 HB2 LYS 27 HB2 LYS 27 93.773 -7.547 2.454 212 HB3 LYS 27 HB3 LYS 27 94.466 -6.548 1.155 213 HG2 LYS 27 HG3 LYS 27 92.690 -5.205 1.892 214 HG3 LYS 27 HG2 LYS 27 91.936 -6.091 0.545 215 HD2 LYS 27 HD2 LYS 27 90.905 -7.670 2.068 216 HD3 LYS 27 HD3 LYS 27 91.817 -7.014 3.449 217 HE2 LYS 27 HE3 LYS 27 89.992 -5.237 1.804 218 HE3 LYS 27 HE2 LYS 27 89.345 -6.239 3.125 219 HZ1 LYS 27 HZ1 LYS 27 89.973 -4.050 3.894 220 HZ2 LYS 27 HZ2 LYS 27 90.925 -5.194 4.604 221 HZ3 LYS 27 HZ3 LYS 27 91.525 -4.266 3.380 222 H ARG 28 H ARG 28 94.267 -10.281 1.678 223 HA ARG 28 HA ARG 28 96.999 -10.107 0.628 224 HB2 ARG 28 HB2 ARG 28 96.352 -11.136 2.844 225 HB3 ARG 28 HB3 ARG 28 95.612 -12.483 1.946 226 HG2 ARG 28 HG2 ARG 28 98.007 -12.518 0.747 227 HG3 ARG 28 HG3 ARG 28 98.514 -11.763 2.277 228 HD2 ARG 28 HD2 ARG 28 98.740 -14.087 2.693 229 HD3 ARG 28 HD3 ARG 28 97.169 -13.678 3.422 230 HE ARG 28 HE ARG 28 96.470 -14.420 0.832 231 HH11 ARG 28 HH11 ARG 28 96.046 -16.563 0.249 232 HH12 ARG 28 HH12 ARG 28 96.753 -17.874 1.166 233 HH21 ARG 28 HH21 ARG 28 98.420 -15.768 3.382 234 HH22 ARG 28 HH22 ARG 28 98.091 -17.427 2.932 235 H LYS 29 H LYS 29 94.042 -11.817 -0.306 236 HA LYS 29 HA LYS 29 95.437 -13.643 -2.142 237 HB2 LYS 29 HB3 LYS 29 92.581 -12.921 -1.528 238 HB3 LYS 29 HB2 LYS 29 92.929 -13.722 -3.078 239 HG2 LYS 29 HG2 LYS 29 94.190 -14.849 -0.591 240 HG3 LYS 29 HG3 LYS 29 92.454 -15.139 -0.854 241 HD2 LYS 29 HD2 LYS 29 92.953 -16.052 -3.108 242 HD3 LYS 29 HD3 LYS 29 94.689 -15.773 -2.833 243 HE2 LYS 29 HE3 LYS 29 94.775 -17.392 -1.077 244 HE3 LYS 29 HE2 LYS 29 93.001 -17.455 -0.944 245 HZ1 LYS 29 HZ1 LYS 29 93.870 -19.339 -2.160 246 HZ2 LYS 29 HZ2 LYS 29 92.935 -18.408 -3.150 247 HZ3 LYS 29 HZ3 LYS 29 94.579 -18.350 -3.274 248 H LEU 30 H LEU 30 93.719 -10.522 -2.465 249 HA LEU 30 HA LEU 30 94.225 -10.539 -5.399 250 HB2 LEU 30 HB2 LEU 30 93.116 -8.295 -5.336 251 HB3 LEU 30 HB3 LEU 30 92.119 -9.586 -4.625 252 HG LEU 30 HG LEU 30 93.515 -8.757 -2.418 253 HD11 LEU 30 HD11 LEU 30 94.615 -6.929 -3.685 254 HD12 LEU 30 HD12 LEU 30 93.019 -6.288 -4.143 255 HD13 LEU 30 HD13 LEU 30 93.525 -6.278 -2.437 256 HD21 LEU 30 HD21 LEU 30 91.058 -9.056 -2.617 257 HD22 LEU 30 HD22 LEU 30 91.453 -7.517 -1.814 258 HD23 LEU 30 HD23 LEU 30 90.946 -7.527 -3.521 259 H ALA 31 H ALA 31 95.844 -9.650 -2.589 260 HA ALA 31 HA ALA 31 97.384 -7.432 -3.835 261 HB1 ALA 31 HB1 ALA 31 98.729 -7.630 -1.671 262 HB2 ALA 31 HB2 ALA 31 97.003 -7.247 -1.464 263 HB3 ALA 31 HB3 ALA 31 97.587 -8.903 -1.176 264 H ALA 32 H ALA 32 98.056 -10.778 -2.689 265 HA ALA 32 HA ALA 32 100.791 -10.876 -3.495 266 HB1 ALA 32 HB1 ALA 32 100.479 -13.333 -3.611 267 HB2 ALA 32 HB2 ALA 32 99.682 -12.653 -2.172 268 HB3 ALA 32 HB3 ALA 32 98.713 -13.108 -3.594 269 H HIS 33 H HIS 33 98.188 -10.185 -5.457 270 HA HIS 33 HA HIS 33 99.781 -11.017 -7.874 271 HB2 HIS 33 HB2 HIS 33 96.798 -11.508 -7.459 272 HB3 HIS 33 HB3 HIS 33 97.662 -11.731 -8.999 273 HD2 HIS 33 HD2 HIS 33 97.539 -13.412 -5.409 274 HE1 HIS 33 HE1 HIS 33 99.602 -15.994 -8.038 275 HE2 HIS 33 HE2 HIS 33 98.641 -15.778 -5.682 276 H ASP 34 H ASP 34 99.758 -8.453 -6.784 277 HA ASP 34 HA ASP 34 98.014 -6.998 -8.784 278 HB2 ASP 34 HB2 ASP 34 97.318 -6.747 -6.337 279 HB3 ASP 34 HB3 ASP 34 98.867 -5.911 -6.072 280 H ASN 35 H ASN 35 99.639 -6.741 -10.340 281 HA ASN 35 HA ASN 35 102.351 -5.892 -9.634 282 HB2 ASN 35 HB3 ASN 35 102.538 -5.443 -12.108 283 HB3 ASN 35 HB2 ASN 35 101.945 -7.078 -11.731 284 HD21 ASN 35 HD21 ASN 35 101.057 -3.918 -13.085 285 HD22 ASN 35 HD22 ASN 35 99.484 -4.414 -13.667 286 H LEU 36 H LEU 36 100.538 -4.197 -8.306 287 HA LEU 36 HA LEU 36 99.695 -1.843 -9.544 288 HB2 LEU 36 HB2 LEU 36 99.736 -0.803 -7.445 289 HB3 LEU 36 HB3 LEU 36 99.665 -2.529 -7.027 290 HG LEU 36 HG LEU 36 102.426 -1.523 -7.365 291 HD11 LEU 36 HD11 LEU 36 101.379 0.525 -6.433 292 HD12 LEU 36 HD12 LEU 36 102.439 -0.254 -5.234 293 HD13 LEU 36 HD13 LEU 36 100.673 -0.438 -5.113 294 HD21 LEU 36 HD21 LEU 36 101.228 -2.691 -4.850 295 HD22 LEU 36 HD22 LEU 36 102.834 -2.965 -5.567 296 HD23 LEU 36 HD23 LEU 36 101.395 -3.718 -6.295 297 H LYS 37 H LYS 37 100.606 0.265 -9.817 298 HA LYS 37 HA LYS 37 103.521 0.137 -10.596 299 HB2 LYS 37 HB3 LYS 37 101.117 1.240 -11.831 300 HB3 LYS 37 HB2 LYS 37 102.338 2.513 -11.597 301 HG2 LYS 37 HG2 LYS 37 104.037 1.027 -12.689 302 HG3 LYS 37 HG3 LYS 37 102.752 -0.163 -13.003 303 HD2 LYS 37 HD3 LYS 37 102.253 2.665 -13.875 304 HD3 LYS 37 HD2 LYS 37 103.434 1.719 -14.811 305 HE2 LYS 37 HE2 LYS 37 101.152 1.474 -15.749 306 HE3 LYS 37 HE3 LYS 37 101.754 -0.077 -15.118 307 HZ1 LYS 37 HZ1 LYS 37 99.425 0.640 -14.474 308 HZ2 LYS 37 HZ2 LYS 37 100.406 0.108 -13.260 309 HZ3 LYS 37 HZ3 LYS 37 100.138 1.724 -13.456 310 H LEU 38 H LEU 38 104.923 1.836 -9.935 311 HA LEU 38 HA LEU 38 103.762 3.798 -7.966 312 HB2 LEU 38 HB2 LEU 38 106.329 2.247 -7.434 313 HB3 LEU 38 HB3 LEU 38 105.460 3.330 -6.321 314 HG LEU 38 HG LEU 38 103.462 1.584 -6.872 315 HD11 LEU 38 HD11 LEU 38 104.886 0.217 -8.376 316 HD12 LEU 38 HD12 LEU 38 104.394 -0.711 -6.939 317 HD13 LEU 38 HD13 LEU 38 106.039 -0.042 -7.045 318 HD21 LEU 38 HD21 LEU 38 104.318 2.206 -4.626 319 HD22 LEU 38 HD22 LEU 38 105.709 1.119 -4.857 320 HD23 LEU 38 HD23 LEU 38 104.063 0.449 -4.750 321 H THR 39 H THR 39 104.467 5.815 -8.438 322 HA THR 39 HA THR 39 106.822 6.061 -10.297 323 HB THR 39 HB THR 39 105.076 8.363 -9.394 324 HG1 THR 39 HG1 THR 39 103.546 6.929 -10.072 325 HG21 THR 39 HG21 THR 39 105.592 9.156 -11.685 326 HG22 THR 39 HG22 THR 39 106.484 7.650 -12.005 327 HG23 THR 39 HG23 THR 39 107.083 8.796 -10.782 328 H ILE 40 H ILE 40 108.748 6.275 -9.239 329 HA ILE 40 HA ILE 40 108.705 7.676 -6.572 330 HB ILE 40 HB ILE 40 110.828 5.957 -7.927 331 HG12 ILE 40 HG12 ILE 40 110.253 4.543 -5.814 332 HG13 ILE 40 HG13 ILE 40 108.779 5.535 -5.727 333 HG21 ILE 40 HG21 ILE 40 111.834 7.724 -6.506 334 HG22 ILE 40 HG22 ILE 40 112.013 6.122 -5.751 335 HG23 ILE 40 HG23 ILE 40 110.769 7.250 -5.161 336 HD11 ILE 40 HD11 ILE 40 109.022 3.221 -7.208 337 HD12 ILE 40 HD12 ILE 40 107.839 4.510 -7.537 338 HD13 ILE 40 HD13 ILE 40 109.379 4.465 -8.429 339 H THR 41 H THR 41 109.265 9.768 -6.519 340 HA THR 41 HA THR 41 111.221 10.745 -8.611 341 HB THR 41 HB THR 41 109.291 12.605 -7.233 342 HG1 THR 41 HG1 THR 41 107.875 11.072 -7.973 343 HG21 THR 41 HG21 THR 41 109.460 13.769 -9.414 344 HG22 THR 41 HG22 THR 41 110.469 12.445 -10.042 345 HG23 THR 41 HG23 THR 41 111.072 13.473 -8.720 346 H GLN 42 H GLN 42 112.769 12.325 -7.846 347 HA GLN 42 HA GLN 42 112.900 12.509 -4.829 348 HB2 GLN 42 HB3 GLN 42 115.249 12.025 -4.843 349 HB3 GLN 42 HB2 GLN 42 114.487 10.771 -5.851 350 HG2 GLN 42 HG2 GLN 42 115.980 13.256 -6.782 351 HG3 GLN 42 HG3 GLN 42 116.414 11.554 -7.068 352 HE21 GLN 42 HE21 GLN 42 115.409 14.064 -8.819 353 HE22 GLN 42 HE22 GLN 42 114.262 13.291 -9.891 354 H GLU 43 H GLU 43 113.778 14.457 -4.018 355 HA GLU 43 HA GLU 43 114.668 16.479 -6.053 356 HB2 GLU 43 HB2 GLU 43 112.228 16.675 -4.280 357 HB3 GLU 43 HB3 GLU 43 113.136 18.148 -4.699 358 HG2 GLU 43 HG2 GLU 43 112.176 16.141 -6.779 359 HG3 GLU 43 HG3 GLU 43 111.217 17.555 -6.281 360 H GLY 44 H GLY 44 116.713 15.938 -4.926 361 HA2 GLY 44 HA3 GLY 44 118.385 16.510 -3.365 362 HA3 GLY 44 HA2 GLY 44 117.397 17.937 -2.982 363 H ASN 45 H ASN 45 115.735 17.724 -1.319 364 HA ASN 45 HA ASN 45 116.278 15.392 0.535 365 HB2 ASN 45 HB2 ASN 45 115.938 16.969 2.430 366 HB3 ASN 45 HB3 ASN 45 117.318 17.447 1.411 367 HD21 ASN 45 HD21 ASN 45 114.724 18.109 -0.526 368 HD22 ASN 45 HD22 ASN 45 114.411 19.763 -0.047 369 H LYS 46 H LYS 46 114.130 15.821 -1.507 370 HA LYS 46 HA LYS 46 111.866 15.298 0.361 371 HB2 LYS 46 HB3 LYS 46 111.532 17.644 0.011 372 HB3 LYS 46 HB2 LYS 46 111.981 17.527 -1.707 373 HG2 LYS 46 HG2 LYS 46 109.762 15.736 -1.099 374 HG3 LYS 46 HG3 LYS 46 109.374 17.404 -0.616 375 HD2 LYS 46 HD2 LYS 46 110.263 18.106 -2.940 376 HD3 LYS 46 HD3 LYS 46 110.185 16.378 -3.362 377 HE2 LYS 46 HE2 LYS 46 108.070 17.144 -4.040 378 HE3 LYS 46 HE3 LYS 46 107.735 16.533 -2.402 379 HZ1 LYS 46 HZ1 LYS 46 106.821 18.732 -2.736 380 HZ2 LYS 46 HZ2 LYS 46 107.998 18.779 -1.583 381 HZ3 LYS 46 HZ3 LYS 46 108.308 19.344 -3.101 382 H PHE 47 H PHE 47 111.378 13.316 -0.315 383 HA PHE 47 HA PHE 47 111.580 12.652 -3.232 384 HB2 PHE 47 HB2 PHE 47 111.536 11.130 -0.661 385 HB3 PHE 47 HB3 PHE 47 110.742 10.344 -2.046 386 HD1 PHE 47 HD1 PHE 47 113.879 12.287 -1.284 387 HD2 PHE 47 HD2 PHE 47 112.069 9.046 -3.446 388 HE1 PHE 47 HE1 PHE 47 116.097 11.658 -2.198 389 HE2 PHE 47 HE2 PHE 47 114.286 8.419 -4.361 390 HZ PHE 47 HZ PHE 47 116.300 9.723 -3.737 391 H THR 48 H THR 48 109.705 11.198 -4.055 392 HA THR 48 HA THR 48 107.075 11.803 -2.816 393 HB THR 48 HB THR 48 107.791 12.822 -5.603 394 HG1 THR 48 HG1 THR 48 108.581 14.154 -3.914 395 HG21 THR 48 HG21 THR 48 105.494 13.749 -5.566 396 HG22 THR 48 HG22 THR 48 105.472 11.976 -5.414 397 HG23 THR 48 HG23 THR 48 105.216 12.995 -3.977 398 H VAL 49 H VAL 49 106.509 9.681 -2.768 399 HA VAL 49 HA VAL 49 106.884 8.055 -5.271 400 HB VAL 49 HB VAL 49 105.940 7.167 -2.510 401 HG11 VAL 49 HG11 VAL 49 105.324 5.669 -4.388 402 HG12 VAL 49 HG12 VAL 49 106.567 4.922 -3.355 403 HG13 VAL 49 HG13 VAL 49 107.022 5.638 -4.920 404 HG21 VAL 49 HG21 VAL 49 108.342 8.208 -2.796 405 HG22 VAL 49 HG22 VAL 49 108.702 6.689 -3.651 406 HG23 VAL 49 HG23 VAL 49 108.165 6.649 -1.955 407 H LYS 50 H LYS 50 105.189 8.082 -6.656 408 HA LYS 50 HA LYS 50 102.449 8.570 -5.501 409 HB2 LYS 50 HB2 LYS 50 103.589 9.833 -7.567 410 HB3 LYS 50 HB3 LYS 50 102.977 8.421 -8.461 411 HG2 LYS 50 HG2 LYS 50 100.730 8.894 -7.204 412 HG3 LYS 50 HG3 LYS 50 101.424 10.505 -6.902 413 HD2 LYS 50 HD2 LYS 50 100.359 10.897 -8.933 414 HD3 LYS 50 HD3 LYS 50 101.958 10.379 -9.518 415 HE2 LYS 50 HE2 LYS 50 100.524 9.027 -10.790 416 HE3 LYS 50 HE3 LYS 50 100.898 7.961 -9.414 417 HZ1 LYS 50 HZ1 LYS 50 98.535 8.053 -9.852 418 HZ2 LYS 50 HZ2 LYS 50 98.861 8.702 -8.372 419 HZ3 LYS 50 HZ3 LYS 50 98.515 9.689 -9.647 420 H GLU 51 H GLU 51 101.729 6.555 -4.807 421 HA GLU 51 HA GLU 51 102.263 4.110 -6.317 422 HB2 GLU 51 HB2 GLU 51 101.766 3.766 -4.028 423 HB3 GLU 51 HB3 GLU 51 100.369 4.867 -4.071 424 HG2 GLU 51 HG3 GLU 51 99.009 3.297 -5.194 425 HG3 GLU 51 HG2 GLU 51 100.407 2.356 -5.767 426 H SER 52 H SER 52 100.612 2.835 -7.476 427 HA SER 52 HA SER 52 98.128 4.215 -8.273 428 HB2 SER 52 HB2 SER 52 100.087 3.581 -10.500 429 HB3 SER 52 HB3 SER 52 98.628 4.600 -10.554 430 HG SER 52 HG SER 52 100.754 5.720 -10.413 431 H SER 53 H SER 53 96.885 2.519 -7.904 432 HA SER 53 HA SER 53 97.459 0.009 -9.462 433 HB2 SER 53 HB2 SER 53 97.826 0.166 -6.711 434 HB3 SER 53 HB3 SER 53 96.153 -0.428 -6.845 435 HG SER 53 HG SER 53 96.858 -2.195 -7.937 436 H ALA 54 H ALA 54 95.555 -0.972 -10.259 437 HA ALA 54 HA ALA 54 93.288 0.729 -10.677 438 HB1 ALA 54 HB1 ALA 54 92.123 -1.328 -11.427 439 HB2 ALA 54 HB2 ALA 54 93.401 -2.321 -10.686 440 HB3 ALA 54 HB3 ALA 54 93.783 -1.265 -12.067 441 H PHE 55 H PHE 55 94.297 -0.233 -7.757 442 HA PHE 55 HA PHE 55 91.513 -0.818 -6.747 443 HB2 PHE 55 HB3 PHE 55 94.273 -1.418 -5.628 444 HB3 PHE 55 HB2 PHE 55 92.794 -1.548 -4.645 445 HD1 PHE 55 HD1 PHE 55 94.927 -3.215 -6.987 446 HD2 PHE 55 HD2 PHE 55 90.853 -2.968 -5.649 447 HE1 PHE 55 HE1 PHE 55 94.470 -5.447 -7.966 448 HE2 PHE 55 HE2 PHE 55 90.395 -5.200 -6.630 449 HZ PHE 55 HZ PHE 55 92.205 -6.440 -7.787 450 H ARG 56 H ARG 56 94.188 1.496 -6.577 451 HA ARG 56 HA ARG 56 92.680 3.634 -5.584 452 HB2 ARG 56 HB2 ARG 56 93.342 3.601 -3.098 453 HB3 ARG 56 HB3 ARG 56 92.041 2.489 -3.580 454 HG2 ARG 56 HG2 ARG 56 94.294 0.939 -3.996 455 HG3 ARG 56 HG3 ARG 56 94.768 1.896 -2.573 456 HD2 ARG 56 HD2 ARG 56 92.188 0.287 -2.844 457 HD3 ARG 56 HD3 ARG 56 93.621 -0.210 -1.913 458 HE ARG 56 HE ARG 56 92.985 2.326 -0.888 459 HH11 ARG 56 HH11 ARG 56 91.588 2.566 0.874 460 HH12 ARG 56 HH12 ARG 56 90.413 1.321 1.233 461 HH21 ARG 56 HH21 ARG 56 91.368 -0.711 -1.426 462 HH22 ARG 56 HH22 ARG 56 90.289 -0.525 -0.062 463 H ASN 57 H ASN 57 94.304 4.542 -6.965 464 HA ASN 57 HA ASN 57 97.138 4.337 -6.433 465 HB2 ASN 57 HB3 ASN 57 97.356 6.302 -7.878 466 HB3 ASN 57 HB2 ASN 57 96.123 5.214 -8.559 467 HD21 ASN 57 HD21 ASN 57 96.079 7.961 -9.259 468 HD22 ASN 57 HD22 ASN 57 94.693 8.712 -8.501 469 H ILE 58 H ILE 58 98.540 5.711 -5.256 470 HA ILE 58 HA ILE 58 97.211 7.787 -3.530 471 HB ILE 58 HB ILE 58 99.245 5.942 -2.303 472 HG12 ILE 58 HG13 ILE 58 96.300 5.358 -2.767 473 HG13 ILE 58 HG12 ILE 58 97.701 4.318 -3.128 474 HG21 ILE 58 HG21 ILE 58 98.160 8.160 -1.339 475 HG22 ILE 58 HG22 ILE 58 98.370 6.741 -0.285 476 HG23 ILE 58 HG23 ILE 58 96.777 7.093 -0.996 477 HD11 ILE 58 HD11 ILE 58 96.946 3.399 -1.111 478 HD12 ILE 58 HD12 ILE 58 96.442 4.979 -0.465 479 HD13 ILE 58 HD13 ILE 58 98.169 4.558 -0.538 480 H GLU 59 H GLU 59 98.985 8.933 -2.210 481 HA GLU 59 HA GLU 59 101.601 9.058 -3.664 482 HB2 GLU 59 HB2 GLU 59 101.445 11.328 -4.265 483 HB3 GLU 59 HB3 GLU 59 99.815 10.721 -4.639 484 HG2 GLU 59 HG3 GLU 59 99.258 11.413 -2.171 485 HG3 GLU 59 HG2 GLU 59 100.729 12.407 -2.295 486 H CYS 60 H CYS 60 103.285 9.749 -2.318 487 HA CYS 60 HA CYS 60 102.569 10.894 0.349 488 HB2 CYS 60 HB2 CYS 60 103.903 8.180 -0.024 489 HB3 CYS 60 HB3 CYS 60 103.948 9.094 1.503 490 HG CYS 60 HG CYS 60 100.803 9.082 0.512 491 H VAL 61 H VAL 61 104.041 12.445 0.787 492 HA VAL 61 HA VAL 61 106.580 12.489 -0.774 493 HB VAL 61 HB VAL 61 106.039 14.468 1.415 494 HG11 VAL 61 HG11 VAL 61 106.839 16.023 -0.361 495 HG12 VAL 61 HG12 VAL 61 107.984 14.687 -0.091 496 HG13 VAL 61 HG13 VAL 61 106.905 14.662 -1.506 497 HG21 VAL 61 HG21 VAL 61 104.500 15.684 -0.272 498 HG22 VAL 61 HG22 VAL 61 104.330 14.103 -1.072 499 HG23 VAL 61 HG23 VAL 61 103.797 14.309 0.614 500 H PHE 62 H PHE 62 108.689 12.462 0.240 501 HA PHE 62 HA PHE 62 108.648 11.569 3.121 502 HB2 PHE 62 HB3 PHE 62 110.169 10.206 0.855 503 HB3 PHE 62 HB2 PHE 62 110.328 9.813 2.584 504 HD1 PHE 62 HD1 PHE 62 107.804 9.637 3.740 505 HD2 PHE 62 HD2 PHE 62 108.841 8.716 -0.325 506 HE1 PHE 62 HE1 PHE 62 105.835 8.138 3.577 507 HE2 PHE 62 HE2 PHE 62 106.875 7.216 -0.487 508 HZ PHE 62 HZ PHE 62 105.370 6.928 1.463 509 H GLU 63 H GLU 63 110.152 12.566 4.330 510 HA GLU 63 HA GLU 63 112.417 13.955 2.873 511 HB2 GLU 63 HB3 GLU 63 110.434 15.277 4.143 512 HB3 GLU 63 HB2 GLU 63 111.477 14.945 5.547 513 HG2 GLU 63 HG2 GLU 63 113.404 15.809 3.965 514 HG3 GLU 63 HG3 GLU 63 112.069 16.572 3.070 515 H LEU 64 H LEU 64 114.312 14.368 4.483 516 HA LEU 64 HA LEU 64 114.686 11.799 6.017 517 HB2 LEU 64 HB2 LEU 64 116.777 13.827 5.117 518 HB3 LEU 64 HB3 LEU 64 117.081 12.209 5.795 519 HG LEU 64 HG LEU 64 115.657 12.832 3.169 520 HD11 LEU 64 HD11 LEU 64 118.122 13.097 3.098 521 HD12 LEU 64 HD12 LEU 64 118.317 11.470 3.792 522 HD13 LEU 64 HD13 LEU 64 117.607 11.667 2.172 523 HD21 LEU 64 HD21 LEU 64 116.043 10.185 3.069 524 HD22 LEU 64 HD22 LEU 64 115.959 10.347 4.840 525 HD23 LEU 64 HD23 LEU 64 114.591 10.876 3.832 526 H GLY 65 H GLY 65 114.446 11.937 8.190 527 HA2 GLY 65 HA2 GLY 65 115.043 12.790 10.363 528 HA3 GLY 65 HA3 GLY 65 115.662 14.272 9.600 529 H VAL 66 H VAL 66 112.495 13.108 8.659 530 HA VAL 66 HA VAL 66 111.191 14.989 10.605 531 HB VAL 66 HB VAL 66 110.635 15.120 7.614 532 HG11 VAL 66 HG11 VAL 66 108.811 15.840 9.132 533 HG12 VAL 66 HG12 VAL 66 109.936 16.943 9.959 534 HG13 VAL 66 HG13 VAL 66 109.501 17.228 8.257 535 HG21 VAL 66 HG21 VAL 66 112.604 16.610 9.359 536 HG22 VAL 66 HG22 VAL 66 111.821 17.450 8.000 537 HG23 VAL 66 HG23 VAL 66 112.808 16.000 7.700 538 H THR 67 H THR 67 109.872 13.503 11.595 539 HA THR 67 HA THR 67 108.813 11.148 10.357 540 HB THR 67 HB THR 67 107.178 12.573 12.434 541 HG1 THR 67 HG1 THR 67 109.212 13.034 13.189 542 HG21 THR 67 HG21 THR 67 107.130 10.289 13.399 543 HG22 THR 67 HG22 THR 67 108.255 9.733 12.136 544 HG23 THR 67 HG23 THR 67 106.618 10.277 11.694 545 H PHE 68 H PHE 68 106.973 10.700 9.284 546 HA PHE 68 HA PHE 68 104.921 12.825 8.889 547 HB2 PHE 68 HB2 PHE 68 105.097 12.039 6.306 548 HB3 PHE 68 HB3 PHE 68 105.963 13.460 6.936 549 HD1 PHE 68 HD1 PHE 68 106.380 9.731 6.638 550 HD2 PHE 68 HD2 PHE 68 108.250 13.596 6.587 551 HE1 PHE 68 HE1 PHE 68 108.548 8.677 6.040 552 HE2 PHE 68 HE2 PHE 68 110.415 12.543 5.999 553 HZ PHE 68 HZ PHE 68 110.561 10.085 5.721 554 H ASN 69 H ASN 69 103.347 11.567 7.004 555 HA ASN 69 HA ASN 69 103.161 8.733 7.996 556 HB2 ASN 69 HB2 ASN 69 100.582 10.217 7.764 557 HB3 ASN 69 HB3 ASN 69 101.078 8.964 8.927 558 HD21 ASN 69 HD21 ASN 69 100.120 12.086 8.937 559 HD22 ASN 69 HD22 ASN 69 101.126 12.722 10.218 560 H CYS 70 H CYS 70 101.948 7.340 6.646 561 HA CYS 70 HA CYS 70 100.907 8.396 4.068 562 HB2 CYS 70 HB2 CYS 70 103.301 8.115 3.550 563 HB3 CYS 70 HB3 CYS 70 103.264 6.459 4.202 564 HG CYS 70 HG CYS 70 102.143 5.272 2.097 565 H ASN 71 H ASN 71 99.229 7.064 3.382 566 HA ASN 71 HA ASN 71 98.710 4.715 5.168 567 HB2 ASN 71 HB2 ASN 71 96.483 4.740 3.803 568 HB3 ASN 71 HB3 ASN 71 96.777 6.047 4.975 569 HD21 ASN 71 HD21 ASN 71 95.939 7.923 4.030 570 HD22 ASN 71 HD22 ASN 71 96.283 8.435 2.393 571 H LEU 72 H LEU 72 98.512 2.608 4.428 572 HA LEU 72 HA LEU 72 99.766 2.117 1.752 573 HB2 LEU 72 HB2 LEU 72 99.113 0.367 4.150 574 HB3 LEU 72 HB3 LEU 72 99.609 -0.328 2.589 575 HG LEU 72 HG LEU 72 101.252 1.892 3.809 576 HD11 LEU 72 HD11 LEU 72 101.772 -1.027 4.442 577 HD12 LEU 72 HD12 LEU 72 100.742 -0.034 5.500 578 HD13 LEU 72 HD13 LEU 72 102.442 0.422 5.229 579 HD21 LEU 72 HD21 LEU 72 101.718 1.085 1.509 580 HD22 LEU 72 HD22 LEU 72 103.058 0.684 2.610 581 HD23 LEU 72 HD23 LEU 72 101.895 -0.575 2.128 582 H ALA 73 H ALA 73 98.730 0.934 0.106 583 HA ALA 73 HA ALA 73 96.042 1.405 -0.456 584 HB1 ALA 73 HB1 ALA 73 96.111 -0.579 -1.942 585 HB2 ALA 73 HB2 ALA 73 97.619 0.360 -2.053 586 HB3 ALA 73 HB3 ALA 73 97.578 -1.149 -1.109 587 H ASP 74 H ASP 74 97.361 -1.168 1.618 588 HA ASP 74 HA ASP 74 94.934 -2.692 1.890 589 HB2 ASP 74 HB2 ASP 74 97.311 -3.253 2.735 590 HB3 ASP 74 HB3 ASP 74 96.925 -2.230 4.139 591 H GLY 75 H GLY 75 95.129 0.498 2.349 592 HA2 GLY 75 HA2 GLY 75 93.647 1.974 3.468 593 HA3 GLY 75 HA3 GLY 75 92.771 0.556 4.091 594 H THR 76 H THR 76 96.239 0.882 4.551 595 HA THR 76 HA THR 76 95.708 1.121 7.499 596 HB THR 76 HB THR 76 98.489 0.714 6.577 597 HG1 THR 76 HG1 THR 76 97.465 -0.499 4.982 598 HG21 THR 76 HG21 THR 76 98.384 -1.063 8.300 599 HG22 THR 76 HG22 THR 76 96.629 -0.810 8.452 600 HG23 THR 76 HG23 THR 76 97.758 0.480 8.929 601 H GLU 77 H GLU 77 97.194 2.510 8.746 602 HA GLU 77 HA GLU 77 98.234 4.844 7.135 603 HB2 GLU 77 HB2 GLU 77 95.961 5.290 8.233 604 HB3 GLU 77 HB3 GLU 77 96.787 5.115 9.801 605 HG2 GLU 77 HG3 GLU 77 98.322 6.937 9.241 606 HG3 GLU 77 HG2 GLU 77 97.622 7.064 7.609 607 H LEU 78 H LEU 78 100.392 5.082 7.587 608 HA LEU 78 HA LEU 78 101.256 4.413 10.409 609 HB2 LEU 78 HB2 LEU 78 103.061 3.788 8.074 610 HB3 LEU 78 HB3 LEU 78 103.030 3.069 9.702 611 HG LEU 78 HG LEU 78 100.588 2.301 8.936 612 HD11 LEU 78 HD11 LEU 78 100.896 3.583 6.740 613 HD12 LEU 78 HD12 LEU 78 102.095 2.347 6.292 614 HD13 LEU 78 HD13 LEU 78 100.401 1.881 6.576 615 HD21 LEU 78 HD21 LEU 78 102.459 0.803 9.581 616 HD22 LEU 78 HD22 LEU 78 101.595 0.170 8.160 617 HD23 LEU 78 HD23 LEU 78 103.164 0.985 7.957 618 H ARG 79 H ARG 79 103.371 5.389 10.990 619 HA ARG 79 HA ARG 79 104.194 7.701 9.263 620 HB2 ARG 79 HB2 ARG 79 104.027 9.290 11.147 621 HB3 ARG 79 HB3 ARG 79 102.432 8.595 10.772 622 HG2 ARG 79 HG2 ARG 79 102.809 6.894 12.590 623 HG3 ARG 79 HG3 ARG 79 104.316 7.742 13.014 624 HD2 ARG 79 HD3 ARG 79 103.053 9.803 13.479 625 HD3 ARG 79 HD2 ARG 79 101.539 9.008 12.986 626 HE ARG 79 HE ARG 79 102.405 7.319 14.978 627 HH11 ARG 79 HH11 ARG 79 102.047 7.661 17.184 628 HH12 ARG 79 HH12 ARG 79 101.832 9.287 17.792 629 HH21 ARG 79 HH21 ARG 79 102.188 10.780 14.667 630 HH22 ARG 79 HH22 ARG 79 101.911 11.045 16.374 631 H GLY 80 H GLY 80 106.350 8.370 9.636 632 HA2 GLY 80 HA2 GLY 80 107.961 7.760 11.877 633 HA3 GLY 80 HA3 GLY 80 108.085 6.349 10.795 634 H THR 81 H THR 81 109.773 6.488 9.406 635 HA THR 81 HA THR 81 110.162 8.635 7.574 636 HB THR 81 HB THR 81 112.484 9.180 9.138 637 HG1 THR 81 HG1 THR 81 111.685 9.667 11.109 638 HG21 THR 81 HG21 THR 81 111.384 11.475 9.267 639 HG22 THR 81 HG22 THR 81 109.961 10.749 8.481 640 HG23 THR 81 HG23 THR 81 111.523 10.792 7.629 641 H TRP 82 H TRP 82 112.110 8.420 6.308 642 HA TRP 82 HA TRP 82 113.364 5.698 6.666 643 HB2 TRP 82 HB2 TRP 82 113.667 7.466 4.221 644 HB3 TRP 82 HB3 TRP 82 113.805 5.696 4.340 645 HD1 TRP 82 HD1 TRP 82 111.148 8.477 4.613 646 HE1 TRP 82 HE1 TRP 82 108.854 7.523 3.932 647 HE3 TRP 82 HE3 TRP 82 112.483 3.603 3.921 648 HZ2 TRP 82 HZ2 TRP 82 107.761 4.957 3.170 649 HZ3 TRP 82 HZ3 TRP 82 110.805 1.924 3.213 650 HH2 TRP 82 HH2 TRP 82 108.447 2.594 2.834 651 H SER 83 H SER 83 115.631 5.489 6.806 652 HA SER 83 HA SER 83 117.207 8.053 6.670 653 HB2 SER 83 HB2 SER 83 117.690 6.166 8.977 654 HB3 SER 83 HB3 SER 83 118.051 7.904 8.846 655 HG SER 83 HG SER 83 116.241 7.769 10.114 656 H LEU 84 H LEU 84 118.987 7.650 5.397 657 HA LEU 84 HA LEU 84 119.573 4.961 4.539 658 HB2 LEU 84 HB2 LEU 84 120.547 7.619 3.995 659 HB3 LEU 84 HB3 LEU 84 121.939 6.547 4.284 660 HG LEU 84 HG LEU 84 119.791 5.341 2.638 661 HD11 LEU 84 HD11 LEU 84 119.678 7.681 1.824 662 HD12 LEU 84 HD12 LEU 84 120.393 6.606 0.598 663 HD13 LEU 84 HD13 LEU 84 121.439 7.674 1.565 664 HD21 LEU 84 HD21 LEU 84 122.008 4.301 3.035 665 HD22 LEU 84 HD22 LEU 84 121.753 4.633 1.305 666 HD23 LEU 84 HD23 LEU 84 122.799 5.701 2.272 667 H GLU 85 H GLU 85 120.422 3.382 5.678 668 HA GLU 85 HA GLU 85 122.321 4.088 7.919 669 HB2 GLU 85 HB3 GLU 85 120.766 2.871 9.089 670 HB3 GLU 85 HB2 GLU 85 120.111 2.116 7.618 671 HG2 GLU 85 HG2 GLU 85 121.834 0.466 7.570 672 HG3 GLU 85 HG3 GLU 85 122.828 1.358 8.747 673 H GLY 86 H GLY 86 124.407 3.712 7.323 674 HA2 GLY 86 HA2 GLY 86 126.234 2.701 6.202 675 HA3 GLY 86 HA3 GLY 86 125.309 1.182 6.314 676 H ASN 87 H ASN 87 124.354 0.380 4.462 677 HA ASN 87 HA ASN 87 124.333 2.242 2.074 678 HB2 ASN 87 HB3 ASN 87 126.125 0.322 2.182 679 HB3 ASN 87 HB2 ASN 87 124.749 -0.741 1.802 680 HD21 ASN 87 HD21 ASN 87 123.408 1.532 0.243 681 HD22 ASN 87 HD22 ASN 87 124.284 1.585 -1.270 682 H LYS 88 H LYS 88 122.104 1.653 3.939 683 HA LYS 88 HA LYS 88 120.265 0.477 1.865 684 HB2 LYS 88 HB3 LYS 88 119.097 -0.634 3.954 685 HB3 LYS 88 HB2 LYS 88 120.504 -1.431 3.208 686 HG2 LYS 88 HG2 LYS 88 121.995 -0.363 4.873 687 HG3 LYS 88 HG3 LYS 88 120.593 0.442 5.616 688 HD2 LYS 88 HD3 LYS 88 120.764 -1.437 6.978 689 HD3 LYS 88 HD2 LYS 88 119.652 -2.049 5.730 690 HE2 LYS 88 HE2 LYS 88 121.818 -2.791 4.478 691 HE3 LYS 88 HE3 LYS 88 122.621 -2.573 6.051 692 HZ1 LYS 88 HZ1 LYS 88 121.820 -4.823 5.765 693 HZ2 LYS 88 HZ2 LYS 88 121.018 -4.090 7.006 694 HZ3 LYS 88 HZ3 LYS 88 120.273 -4.292 5.548 695 H LEU 89 H LEU 89 118.213 1.406 1.851 696 HA LEU 89 HA LEU 89 117.934 3.876 3.514 697 HB2 LEU 89 HB2 LEU 89 116.427 2.678 1.165 698 HB3 LEU 89 HB3 LEU 89 115.743 4.026 2.103 699 HG LEU 89 HG LEU 89 118.589 4.233 1.134 700 HD11 LEU 89 HD11 LEU 89 117.305 3.480 -0.850 701 HD12 LEU 89 HD12 LEU 89 116.109 4.767 -0.563 702 HD13 LEU 89 HD13 LEU 89 117.780 5.188 -1.007 703 HD21 LEU 89 HD21 LEU 89 116.272 6.088 1.774 704 HD22 LEU 89 HD22 LEU 89 117.896 6.043 2.502 705 HD23 LEU 89 HD23 LEU 89 117.680 6.658 0.846 706 H ILE 90 H ILE 90 117.254 3.368 5.608 707 HA ILE 90 HA ILE 90 115.348 1.125 5.971 708 HB ILE 90 HB ILE 90 115.337 2.235 8.401 709 HG12 ILE 90 HG13 ILE 90 118.064 3.049 7.404 710 HG13 ILE 90 HG12 ILE 90 116.692 4.182 7.325 711 HG21 ILE 90 HG21 ILE 90 116.214 -0.005 7.802 712 HG22 ILE 90 HG22 ILE 90 117.309 0.834 8.927 713 HG23 ILE 90 HG23 ILE 90 117.710 0.745 7.195 714 HD11 ILE 90 HD11 ILE 90 117.948 4.451 9.442 715 HD12 ILE 90 HD12 ILE 90 116.294 3.868 9.747 716 HD13 ILE 90 HD13 ILE 90 117.666 2.736 9.826 717 H GLY 91 H GLY 91 113.328 1.438 7.192 718 HA2 GLY 91 HA3 GLY 91 112.051 4.125 6.858 719 HA3 GLY 91 HA2 GLY 91 111.307 2.751 6.001 720 H LYS 92 H LYS 92 111.854 4.267 9.089 721 HA LYS 92 HA LYS 92 110.670 1.985 10.590 722 HB2 LYS 92 HB2 LYS 92 111.846 4.673 11.271 723 HB3 LYS 92 HB3 LYS 92 110.720 3.928 12.430 724 HG2 LYS 92 HG3 LYS 92 112.091 1.952 12.617 725 HG3 LYS 92 HG2 LYS 92 113.109 2.457 11.247 726 HD2 LYS 92 HD2 LYS 92 113.680 4.545 12.638 727 HD3 LYS 92 HD3 LYS 92 112.937 3.700 14.017 728 HE2 LYS 92 HE3 LYS 92 115.412 2.959 12.437 729 HE3 LYS 92 HE2 LYS 92 115.207 3.094 14.200 730 HZ1 LYS 92 HZ1 LYS 92 115.167 0.839 13.821 731 HZ2 LYS 92 HZ2 LYS 92 114.319 0.952 12.411 732 HZ3 LYS 92 HZ3 LYS 92 113.556 1.191 13.854 733 H PHE 93 H PHE 93 108.522 1.715 10.101 734 HA PHE 93 HA PHE 93 106.809 4.207 10.210 735 HB2 PHE 93 HB3 PHE 93 106.694 1.707 8.528 736 HB3 PHE 93 HB2 PHE 93 105.175 2.531 8.942 737 HD1 PHE 93 HD1 PHE 93 107.519 5.079 9.008 738 HD2 PHE 93 HD2 PHE 93 105.541 2.501 6.200 739 HE1 PHE 93 HE1 PHE 93 107.920 6.733 7.207 740 HE2 PHE 93 HE2 PHE 93 105.945 4.154 4.398 741 HZ PHE 93 HZ PHE 93 107.135 6.271 4.901 742 H LYS 94 H LYS 94 104.884 4.122 11.352 743 HA LYS 94 HA LYS 94 104.460 1.641 13.012 744 HB2 LYS 94 HB2 LYS 94 104.582 4.525 13.969 745 HB3 LYS 94 HB3 LYS 94 103.850 3.213 14.923 746 HG2 LYS 94 HG3 LYS 94 105.880 2.397 15.531 747 HG3 LYS 94 HG2 LYS 94 106.497 2.488 13.863 748 HD2 LYS 94 HD2 LYS 94 107.131 4.765 14.104 749 HD3 LYS 94 HD3 LYS 94 106.144 4.971 15.571 750 HE2 LYS 94 HE3 LYS 94 107.647 3.257 16.700 751 HE3 LYS 94 HE2 LYS 94 108.703 3.346 15.270 752 HZ1 LYS 94 HZ1 LYS 94 109.413 4.863 16.997 753 HZ2 LYS 94 HZ2 LYS 94 107.950 5.625 16.990 754 HZ3 LYS 94 HZ3 LYS 94 108.929 5.707 15.665 755 H ARG 95 H ARG 95 102.454 0.920 12.688 756 HA ARG 95 HA ARG 95 100.467 2.263 11.161 757 HB2 ARG 95 HB2 ARG 95 100.483 -0.013 13.112 758 HB3 ARG 95 HB3 ARG 95 98.902 0.711 12.733 759 HG2 ARG 95 HG3 ARG 95 99.172 0.286 10.380 760 HG3 ARG 95 HG2 ARG 95 100.888 -0.137 10.588 761 HD2 ARG 95 HD3 ARG 95 99.170 -2.081 10.349 762 HD3 ARG 95 HD2 ARG 95 100.379 -2.189 11.651 763 HE ARG 95 HE ARG 95 98.639 -1.853 13.268 764 HH11 ARG 95 HH11 ARG 95 96.438 -1.769 13.778 765 HH12 ARG 95 HH12 ARG 95 95.256 -1.510 12.514 766 HH21 ARG 95 HH21 ARG 95 97.632 -1.324 9.977 767 HH22 ARG 95 HH22 ARG 95 95.929 -1.259 10.372 768 H THR 96 H THR 96 99.522 4.181 11.611 769 HA THR 96 HA THR 96 99.551 5.340 14.276 770 HB THR 96 HB THR 96 97.599 6.745 13.005 771 HG1 THR 96 HG1 THR 96 99.242 5.776 10.897 772 HG21 THR 96 HG21 THR 96 99.422 8.197 12.168 773 HG22 THR 96 HG22 THR 96 99.776 7.610 13.811 774 HG23 THR 96 HG23 THR 96 100.588 6.873 12.408 775 H ASP 97 H ASP 97 97.659 3.021 12.794 776 HA ASP 97 HA ASP 97 95.153 3.539 14.253 777 HB2 ASP 97 HB2 ASP 97 95.252 2.333 12.054 778 HB3 ASP 97 HB3 ASP 97 96.110 0.998 12.862 779 H ASN 98 H ASN 98 97.793 1.109 14.514 780 HA ASN 98 HA ASN 98 97.005 0.821 17.417 781 HB2 ASN 98 HB2 ASN 98 97.346 -1.298 15.305 782 HB3 ASN 98 HB3 ASN 98 97.860 -1.668 16.968 783 HD21 ASN 98 HD21 ASN 98 95.142 0.509 16.063 784 HD22 ASN 98 HD22 ASN 98 93.899 -0.499 16.769 785 H GLY 99 H GLY 99 99.292 2.020 15.512 786 HA2 GLY 99 HA3 GLY 99 101.661 2.181 15.644 787 HA3 GLY 99 HA2 GLY 99 101.367 2.110 17.398 788 H ASN 100 H ASN 100 100.808 -0.426 14.926 789 HA ASN 100 HA ASN 100 102.159 -2.399 16.646 790 HB2 ASN 100 HB3 ASN 100 100.964 -2.460 13.860 791 HB3 ASN 100 HB2 ASN 100 101.854 -3.853 14.521 792 HD21 ASN 100 HD21 ASN 100 98.824 -3.311 13.951 793 HD22 ASN 100 HD22 ASN 100 98.057 -3.780 15.452 794 H GLU 101 H GLU 101 103.569 0.010 15.386 795 HA GLU 101 HA GLU 101 105.624 0.478 14.327 796 HB2 GLU 101 HB2 GLU 101 107.485 -0.742 15.231 797 HB3 GLU 101 HB3 GLU 101 106.248 -0.669 16.506 798 HG2 GLU 101 HG3 GLU 101 105.618 -2.940 16.180 799 HG3 GLU 101 HG2 GLU 101 106.428 -3.025 14.596 800 H LEU 102 H LEU 102 107.304 -0.270 12.779 801 HA LEU 102 HA LEU 102 106.863 -2.746 11.267 802 HB2 LEU 102 HB2 LEU 102 105.064 -1.754 10.141 803 HB3 LEU 102 HB3 LEU 102 105.741 -0.116 10.288 804 HG LEU 102 HG LEU 102 107.539 -0.764 8.656 805 HD11 LEU 102 HD11 LEU 102 107.485 -3.211 9.066 806 HD12 LEU 102 HD12 LEU 102 107.232 -2.845 7.343 807 HD13 LEU 102 HD13 LEU 102 105.849 -3.291 8.370 808 HD21 LEU 102 HD21 LEU 102 106.051 -0.753 6.668 809 HD22 LEU 102 HD22 LEU 102 105.475 0.387 7.907 810 HD23 LEU 102 HD23 LEU 102 104.669 -1.187 7.702 811 H ASN 103 H ASN 103 108.878 -3.262 10.493 812 HA ASN 103 HA ASN 103 110.813 -0.950 10.197 813 HB2 ASN 103 HB3 ASN 103 110.988 -3.471 11.632 814 HB3 ASN 103 HB2 ASN 103 112.244 -3.404 10.373 815 HD21 ASN 103 HD21 ASN 103 111.074 -1.900 13.375 816 HD22 ASN 103 HD22 ASN 103 112.477 -0.883 13.615 817 H THR 104 H THR 104 111.211 -0.518 8.081 818 HA THR 104 HA THR 104 111.282 -2.903 6.221 819 HB THR 104 HB THR 104 109.261 -1.701 5.716 820 HG1 THR 104 HG1 THR 104 109.975 -1.974 3.733 821 HG21 THR 104 HG21 THR 104 109.696 0.859 5.051 822 HG22 THR 104 HG22 THR 104 111.040 0.676 6.204 823 HG23 THR 104 HG23 THR 104 109.366 0.385 6.734 824 H VAL 105 H VAL 105 112.353 -2.165 4.051 825 HA VAL 105 HA VAL 105 114.562 -0.199 4.470 826 HB VAL 105 HB VAL 105 115.086 -3.127 3.784 827 HG11 VAL 105 HG11 VAL 105 117.511 -2.165 4.252 828 HG12 VAL 105 HG12 VAL 105 116.756 -1.942 2.655 829 HG13 VAL 105 HG13 VAL 105 116.752 -0.610 3.835 830 HG21 VAL 105 HG21 VAL 105 116.291 -3.143 5.966 831 HG22 VAL 105 HG22 VAL 105 115.730 -1.482 6.273 832 HG23 VAL 105 HG23 VAL 105 114.554 -2.814 6.173 833 H ARG 106 H ARG 106 115.554 0.417 2.430 834 HA ARG 106 HA ARG 106 113.996 -0.571 0.027 835 HB2 ARG 106 HB2 ARG 106 114.229 2.120 1.136 836 HB3 ARG 106 HB3 ARG 106 114.868 2.064 -0.524 837 HG2 ARG 106 HG2 ARG 106 112.745 0.867 -1.215 838 HG3 ARG 106 HG3 ARG 106 112.110 1.168 0.421 839 HD2 ARG 106 HD2 ARG 106 112.527 3.632 0.053 840 HD3 ARG 106 HD3 ARG 106 112.962 3.257 -1.632 841 HE ARG 106 HE ARG 106 110.326 2.184 -0.847 842 HH11 ARG 106 HH11 ARG 106 108.570 3.160 -1.882 843 HH12 ARG 106 HH12 ARG 106 108.789 4.671 -2.737 844 HH21 ARG 106 HH21 ARG 106 112.184 4.892 -2.002 845 HH22 ARG 106 HH22 ARG 106 110.825 5.646 -2.805 846 H GLU 107 H GLU 107 115.212 -1.100 -1.744 847 HA GLU 107 HA GLU 107 118.102 -0.244 -1.766 848 HB2 GLU 107 HB2 GLU 107 116.993 -3.049 -1.735 849 HB3 GLU 107 HB3 GLU 107 118.459 -2.714 -2.688 850 HG2 GLU 107 HG3 GLU 107 118.349 -1.613 0.100 851 HG3 GLU 107 HG2 GLU 107 118.566 -3.371 -0.074 852 H ILE 108 H ILE 108 119.060 -0.427 -3.951 853 HA ILE 108 HA ILE 108 116.924 -0.447 -6.092 854 HB ILE 108 HB ILE 108 119.489 1.192 -6.088 855 HG12 ILE 108 HG12 ILE 108 117.420 1.624 -4.332 856 HG13 ILE 108 HG13 ILE 108 118.455 2.913 -4.990 857 HG21 ILE 108 HG21 ILE 108 118.643 0.801 -8.296 858 HG22 ILE 108 HG22 ILE 108 118.131 2.446 -7.847 859 HG23 ILE 108 HG23 ILE 108 116.966 1.102 -7.779 860 HD11 ILE 108 HD11 ILE 108 115.939 3.316 -5.184 861 HD12 ILE 108 HD12 ILE 108 115.900 1.978 -6.357 862 HD13 ILE 108 HD13 ILE 108 116.852 3.441 -6.707 863 H ILE 109 H ILE 109 117.466 -2.732 -6.348 864 HA ILE 109 HA ILE 109 120.171 -3.601 -6.896 865 HB ILE 109 HB ILE 109 117.425 -4.719 -7.527 866 HG12 ILE 109 HG13 ILE 109 119.772 -5.774 -5.887 867 HG13 ILE 109 HG12 ILE 109 118.418 -4.837 -5.212 868 HG21 ILE 109 HG21 ILE 109 119.251 -6.764 -8.058 869 HG22 ILE 109 HG22 ILE 109 118.328 -5.852 -9.276 870 HG23 ILE 109 HG23 ILE 109 119.980 -5.346 -8.851 871 HD11 ILE 109 HD11 ILE 109 118.461 -7.647 -6.278 872 HD12 ILE 109 HD12 ILE 109 116.977 -6.691 -6.504 873 HD13 ILE 109 HD13 ILE 109 117.607 -6.981 -4.865 874 H GLY 110 H GLY 110 121.126 -2.141 -8.334 875 HA2 GLY 110 HA3 GLY 110 121.663 -1.263 -10.459 876 HA3 GLY 110 HA2 GLY 110 120.981 -2.773 -11.106 877 H ASP 111 H ASP 111 118.621 -2.827 -11.518 878 HA ASP 111 HA ASP 111 117.495 -0.046 -11.899 879 HB2 ASP 111 HB2 ASP 111 116.366 -1.144 -13.988 880 HB3 ASP 111 HB3 ASP 111 118.072 -0.650 -14.101 881 H GLU 112 H GLU 112 117.066 -2.094 -9.770 882 HA GLU 112 HA GLU 112 114.077 -2.313 -10.147 883 HB2 GLU 112 HB2 GLU 112 115.539 -4.458 -8.620 884 HB3 GLU 112 HB3 GLU 112 114.016 -4.558 -9.535 885 HG2 GLU 112 HG3 GLU 112 115.359 -4.261 -11.658 886 HG3 GLU 112 HG2 GLU 112 116.839 -4.378 -10.675 887 H LEU 113 H LEU 113 112.887 -1.909 -8.215 888 HA LEU 113 HA LEU 113 114.634 -0.881 -5.969 889 HB2 LEU 113 HB2 LEU 113 113.056 0.759 -6.964 890 HB3 LEU 113 HB3 LEU 113 111.697 -0.319 -6.572 891 HG LEU 113 HG LEU 113 112.667 -0.205 -4.122 892 HD11 LEU 113 HD11 LEU 113 114.746 0.991 -4.762 893 HD12 LEU 113 HD12 LEU 113 113.774 2.344 -5.390 894 HD13 LEU 113 HD13 LEU 113 113.762 1.973 -3.649 895 HD21 LEU 113 HD21 LEU 113 111.273 1.805 -3.700 896 HD22 LEU 113 HD22 LEU 113 110.478 0.708 -4.854 897 HD23 LEU 113 HD23 LEU 113 111.288 2.180 -5.440 898 H VAL 114 H VAL 114 114.892 -2.346 -4.374 899 HA VAL 114 HA VAL 114 112.659 -4.308 -3.911 900 HB VAL 114 HB VAL 114 115.429 -4.303 -2.649 901 HG11 VAL 114 HG11 VAL 114 113.818 -5.741 -1.529 902 HG12 VAL 114 HG12 VAL 114 113.262 -6.402 -3.085 903 HG13 VAL 114 HG13 VAL 114 114.901 -6.771 -2.496 904 HG21 VAL 114 HG21 VAL 114 115.638 -4.303 -5.121 905 HG22 VAL 114 HG22 VAL 114 116.069 -5.891 -4.443 906 HG23 VAL 114 HG23 VAL 114 114.484 -5.654 -5.219 907 H GLN 115 H GLN 115 111.177 -3.517 -2.513 908 HA GLN 115 HA GLN 115 112.201 -1.953 -0.140 909 HB2 GLN 115 HB2 GLN 115 110.431 -0.885 -1.574 910 HB3 GLN 115 HB3 GLN 115 109.348 -2.244 -1.190 911 HG2 GLN 115 HG2 GLN 115 109.359 -1.689 1.162 912 HG3 GLN 115 HG3 GLN 115 110.662 -0.498 0.933 913 HE21 GLN 115 HE21 GLN 115 109.731 0.837 -1.411 914 HE22 GLN 115 HE22 GLN 115 108.233 1.652 -1.023 915 H THR 116 H THR 116 112.652 -3.402 1.477 916 HA THR 116 HA THR 116 110.777 -5.737 1.779 917 HB THR 116 HB THR 116 113.224 -5.390 3.489 918 HG1 THR 116 HG1 THR 116 114.091 -4.919 1.502 919 HG21 THR 116 HG21 THR 116 113.315 -7.840 3.178 920 HG22 THR 116 HG22 THR 116 111.704 -7.335 3.742 921 HG23 THR 116 HG23 THR 116 111.957 -7.750 2.030 922 H TYR 117 H TYR 117 109.674 -6.123 3.692 923 HA TYR 117 HA TYR 117 109.787 -3.862 5.700 924 HB2 TYR 117 HB2 TYR 117 107.325 -5.564 5.203 925 HB3 TYR 117 HB3 TYR 117 107.443 -4.011 6.062 926 HD1 TYR 117 HD1 TYR 117 108.269 -5.474 2.736 927 HD2 TYR 117 HD2 TYR 117 106.746 -2.112 4.909 928 HE1 TYR 117 HE1 TYR 117 107.799 -4.313 0.597 929 HE2 TYR 117 HE2 TYR 117 106.277 -0.935 2.777 930 HH TYR 117 HH TYR 117 106.204 -1.122 0.526 931 H VAL 118 H VAL 118 109.322 -4.464 7.856 932 HA VAL 118 HA VAL 118 109.663 -7.417 8.417 933 HB VAL 118 HB VAL 118 110.777 -5.197 10.166 934 HG11 VAL 118 HG11 VAL 118 111.708 -6.906 11.429 935 HG12 VAL 118 HG12 VAL 118 111.795 -8.024 10.046 936 HG13 VAL 118 HG13 VAL 118 110.236 -7.724 10.852 937 HG21 VAL 118 HG21 VAL 118 112.732 -6.823 8.687 938 HG22 VAL 118 HG22 VAL 118 111.729 -5.809 7.622 939 HG23 VAL 118 HG23 VAL 118 112.672 -5.061 8.934 940 H TYR 119 H TYR 119 108.518 -8.161 10.218 941 HA TYR 119 HA TYR 119 106.845 -6.135 11.644 942 HB2 TYR 119 HB3 TYR 119 105.775 -7.317 9.442 943 HB3 TYR 119 HB2 TYR 119 105.330 -8.511 10.686 944 HD1 TYR 119 HD1 TYR 119 104.122 -7.731 12.748 945 HD2 TYR 119 HD2 TYR 119 104.671 -5.207 9.322 946 HE1 TYR 119 HE1 TYR 119 102.291 -6.259 13.541 947 HE2 TYR 119 HE2 TYR 119 102.848 -3.725 10.119 948 HH TYR 119 HH TYR 119 100.789 -3.963 11.617 949 H GLU 120 H GLU 120 107.347 -6.548 13.669 950 HA GLU 120 HA GLU 120 107.823 -7.747 15.642 951 HB2 GLU 120 HB2 GLU 120 105.465 -9.223 14.435 952 HB3 GLU 120 HB3 GLU 120 106.127 -9.652 16.031 953 HG2 GLU 120 HG2 GLU 120 105.672 -7.459 16.906 954 HG3 GLU 120 HG3 GLU 120 105.318 -6.813 15.286 955 H GLY 121 H GLY 121 109.140 -8.712 13.023 956 HA2 GLY 121 HA3 GLY 121 111.069 -10.295 13.290 957 HA3 GLY 121 HA2 GLY 121 109.979 -11.378 14.188 958 H VAL 122 H VAL 122 108.897 -9.623 11.357 959 HA VAL 122 HA VAL 122 109.028 -12.210 9.808 960 HB VAL 122 HB VAL 122 106.692 -11.117 10.662 961 HG11 VAL 122 HG11 VAL 122 106.962 -10.022 7.848 962 HG12 VAL 122 HG12 VAL 122 105.707 -9.677 9.063 963 HG13 VAL 122 HG13 VAL 122 107.350 -9.024 9.270 964 HG21 VAL 122 HG21 VAL 122 105.635 -12.338 8.785 965 HG22 VAL 122 HG22 VAL 122 106.987 -13.263 9.481 966 HG23 VAL 122 HG23 VAL 122 107.202 -12.392 7.943 967 H GLU 123 H GLU 123 108.649 -11.542 7.353 968 HA GLU 123 HA GLU 123 109.843 -8.885 6.805 969 HB2 GLU 123 HB3 GLU 123 111.821 -10.276 7.348 970 HB3 GLU 123 HB2 GLU 123 111.342 -11.439 6.088 971 HG2 GLU 123 HG2 GLU 123 111.519 -9.673 4.374 972 HG3 GLU 123 HG3 GLU 123 111.962 -8.489 5.626 973 H ALA 124 H ALA 124 108.904 -8.118 5.011 974 HA ALA 124 HA ALA 124 107.953 -10.133 2.956 975 HB1 ALA 124 HB1 ALA 124 106.696 -7.604 2.537 976 HB2 ALA 124 HB2 ALA 124 106.592 -7.941 4.281 977 HB3 ALA 124 HB3 ALA 124 105.939 -9.110 3.108 978 H LYS 125 H LYS 125 108.289 -9.490 0.680 979 HA LYS 125 HA LYS 125 110.238 -7.198 0.418 980 HB2 LYS 125 HB2 LYS 125 111.225 -9.656 0.449 981 HB3 LYS 125 HB3 LYS 125 110.632 -9.690 -1.228 982 HG2 LYS 125 HG2 LYS 125 112.001 -7.840 -1.862 983 HG3 LYS 125 HG3 LYS 125 112.331 -7.402 -0.169 984 HD2 LYS 125 HD2 LYS 125 114.311 -8.507 -0.796 985 HD3 LYS 125 HD3 LYS 125 113.379 -9.811 -0.023 986 HE2 LYS 125 HE2 LYS 125 113.864 -10.923 -1.974 987 HE3 LYS 125 HE3 LYS 125 112.454 -10.020 -2.579 988 HZ1 LYS 125 HZ1 LYS 125 115.239 -9.059 -2.746 989 HZ2 LYS 125 HZ2 LYS 125 114.439 -9.802 -3.982 990 HZ3 LYS 125 HZ3 LYS 125 113.910 -8.347 -3.413 991 H ARG 126 H ARG 126 109.945 -5.924 -1.323 992 HA ARG 126 HA ARG 126 108.082 -6.909 -3.492 993 HB2 ARG 126 HB2 ARG 126 107.589 -4.802 -1.581 994 HB3 ARG 126 HB3 ARG 126 107.797 -4.067 -3.188 995 HG2 ARG 126 HG2 ARG 126 106.052 -5.421 -4.135 996 HG3 ARG 126 HG3 ARG 126 105.998 -6.474 -2.701 997 HD2 ARG 126 HD3 ARG 126 104.221 -4.501 -3.044 998 HD3 ARG 126 HD2 ARG 126 104.843 -4.913 -1.428 999 HE ARG 126 HE ARG 126 106.629 -2.975 -2.547 1000 HH11 ARG 126 HH11 ARG 126 106.377 -0.806 -1.961 1001 HH12 ARG 126 HH12 ARG 126 104.843 -0.240 -1.339 1002 HH21 ARG 126 HH21 ARG 126 103.308 -3.356 -1.568 1003 HH22 ARG 126 HH22 ARG 126 103.114 -1.677 -1.118 1004 H ILE 127 H ILE 127 109.321 -6.943 -5.322 1005 HA ILE 127 HA ILE 127 111.499 -4.857 -5.532 1006 HB ILE 127 HB ILE 127 111.186 -7.425 -7.138 1007 HG12 ILE 127 HG12 ILE 127 113.303 -7.263 -5.064 1008 HG13 ILE 127 HG13 ILE 127 111.645 -7.329 -4.419 1009 HG21 ILE 127 HG21 ILE 127 113.591 -7.047 -7.623 1010 HG22 ILE 127 HG22 ILE 127 113.547 -5.549 -6.664 1011 HG23 ILE 127 HG23 ILE 127 112.602 -5.671 -8.167 1012 HD11 ILE 127 HD11 ILE 127 112.573 -9.610 -4.723 1013 HD12 ILE 127 HD12 ILE 127 112.845 -9.269 -6.449 1014 HD13 ILE 127 HD13 ILE 127 111.187 -9.335 -5.805 1015 H PHE 128 H PHE 128 111.162 -3.223 -6.925 1016 HA PHE 128 HA PHE 128 109.065 -3.608 -9.058 1017 HB2 PHE 128 HB2 PHE 128 110.461 -1.021 -8.242 1018 HB3 PHE 128 HB3 PHE 128 108.992 -1.188 -9.227 1019 HD1 PHE 128 HD1 PHE 128 108.194 -3.619 -7.201 1020 HD2 PHE 128 HD2 PHE 128 109.052 0.561 -6.821 1021 HE1 PHE 128 HE1 PHE 128 106.794 -3.524 -5.159 1022 HE2 PHE 128 HE2 PHE 128 107.657 0.664 -4.773 1023 HZ PHE 128 HZ PHE 128 106.521 -1.378 -3.943 1024 H LYS 129 H LYS 129 109.688 -2.222 -11.131 1025 HA LYS 129 HA LYS 129 112.554 -2.132 -11.779 1026 HB2 LYS 129 HB3 LYS 129 112.346 -4.531 -11.982 1027 HB3 LYS 129 HB2 LYS 129 110.817 -4.380 -12.881 1028 HG2 LYS 129 HG2 LYS 129 111.883 -3.630 -14.829 1029 HG3 LYS 129 HG3 LYS 129 113.316 -3.055 -13.944 1030 HD2 LYS 129 HD2 LYS 129 114.134 -5.274 -13.619 1031 HD3 LYS 129 HD3 LYS 129 112.573 -5.999 -14.072 1032 HE2 LYS 129 HE2 LYS 129 114.092 -6.247 -15.954 1033 HE3 LYS 129 HE3 LYS 129 112.879 -5.018 -16.385 1034 HZ1 LYS 129 HZ1 LYS 129 114.696 -3.831 -16.869 1035 HZ2 LYS 129 HZ2 LYS 129 115.704 -4.717 -15.910 1036 HZ3 LYS 129 HZ3 LYS 129 114.762 -3.536 -15.248 1037 H LYS 130 H LYS 130 112.896 -1.273 -13.957 1038 HA LYS 130 HA LYS 130 111.139 0.798 -14.702 1039 HB2 LYS 130 HB2 LYS 130 112.299 0.871 -16.827 1040 HB3 LYS 130 HB3 LYS 130 113.482 0.379 -15.591 1041 HG2 LYS 130 HG2 LYS 130 112.834 -2.056 -16.224 1042 HG3 LYS 130 HG3 LYS 130 112.096 -1.338 -17.677 1043 HD2 LYS 130 HD3 LYS 130 114.371 -0.130 -18.000 1044 HD3 LYS 130 HD2 LYS 130 115.008 -1.297 -16.816 1045 HE2 LYS 130 HE2 LYS 130 113.925 -3.119 -18.310 1046 HE3 LYS 130 HE3 LYS 130 113.797 -1.845 -19.547 1047 HZ1 LYS 130 HZ1 LYS 130 115.852 -3.078 -19.747 1048 HZ2 LYS 130 HZ2 LYS 130 116.170 -1.508 -19.351 1049 HZ3 LYS 130 HZ3 LYS 130 116.288 -2.689 -18.205 1050 H ASP 131 H ASP 131 109.164 0.889 -15.650 1051 HA ASP 131 HA ASP 131 107.752 -1.591 -16.292 1052 HB2 ASP 131 HB3 ASP 131 106.067 0.151 -17.302 1053 HB3 ASP 131 HB2 ASP 131 106.345 0.144 -15.544 Start of MODEL 12 1 H1 ALA 1 H1 ALA 1 116.326 9.396 -5.189 2 H2 ALA 1 H2 ALA 1 117.804 8.899 -4.650 3 H3 ALA 1 H3 ALA 1 116.458 8.010 -4.305 4 HA ALA 1 HA ALA 1 117.585 8.438 -7.000 5 HB1 ALA 1 HB1 ALA 1 118.813 6.888 -5.323 6 HB2 ALA 1 HB2 ALA 1 118.366 6.192 -6.899 7 HB3 ALA 1 HB3 ALA 1 117.389 5.829 -5.456 8 H PHE 2 H PHE 2 116.593 5.831 -7.795 9 HA PHE 2 HA PHE 2 114.634 5.038 -8.865 10 HB2 PHE 2 HB2 PHE 2 114.274 4.876 -6.165 11 HB3 PHE 2 HB3 PHE 2 112.903 5.923 -6.597 12 HD1 PHE 2 HD1 PHE 2 114.539 3.068 -8.450 13 HD2 PHE 2 HD2 PHE 2 110.987 4.617 -6.594 14 HE1 PHE 2 HE1 PHE 2 113.259 1.101 -9.250 15 HE2 PHE 2 HE2 PHE 2 109.713 2.647 -7.391 16 HZ PHE 2 HZ PHE 2 110.848 0.893 -8.719 17 H ASP 3 H ASP 3 115.295 7.530 -9.773 18 HA ASP 3 HA ASP 3 112.834 9.225 -9.582 19 HB2 ASP 3 HB3 ASP 3 115.341 10.041 -9.634 20 HB3 ASP 3 HB2 ASP 3 115.189 9.800 -11.391 21 H SER 4 H SER 4 111.304 7.908 -10.701 22 HA SER 4 HA SER 4 110.902 8.348 -13.427 23 HB2 SER 4 HB3 SER 4 112.945 6.209 -12.944 24 HB3 SER 4 HB2 SER 4 111.718 5.886 -14.193 25 HG SER 4 HG SER 4 112.713 7.274 -15.434 26 H THR 5 H THR 5 109.987 5.851 -14.387 27 HA THR 5 HA THR 5 107.800 5.341 -12.376 28 HB THR 5 HB THR 5 107.972 4.743 -15.363 29 HG1 THR 5 HG1 THR 5 106.374 6.421 -15.411 30 HG21 THR 5 HG21 THR 5 105.421 4.395 -14.942 31 HG22 THR 5 HG22 THR 5 106.535 3.087 -14.478 32 HG23 THR 5 HG23 THR 5 105.885 4.184 -13.236 33 H TRP 6 H TRP 6 107.344 3.257 -11.660 34 HA TRP 6 HA TRP 6 108.952 0.988 -12.768 35 HB2 TRP 6 HB2 TRP 6 108.980 1.581 -9.786 36 HB3 TRP 6 HB3 TRP 6 109.954 0.388 -10.678 37 HD1 TRP 6 HD1 TRP 6 109.482 4.228 -10.475 38 HE1 TRP 6 HE1 TRP 6 111.728 5.374 -11.013 39 HE3 TRP 6 HE3 TRP 6 112.252 0.092 -11.607 40 HZ2 TRP 6 HZ2 TRP 6 114.380 4.578 -11.825 41 HZ3 TRP 6 HZ3 TRP 6 114.633 0.311 -12.255 42 HH2 TRP 6 HH2 TRP 6 115.701 2.546 -12.364 43 H LYS 7 H LYS 7 108.216 -1.125 -11.640 44 HA LYS 7 HA LYS 7 105.527 -0.914 -10.374 45 HB2 LYS 7 HB2 LYS 7 104.323 -2.088 -12.060 46 HB3 LYS 7 HB3 LYS 7 105.253 -0.856 -12.945 47 HG2 LYS 7 HG3 LYS 7 107.088 -2.724 -13.120 48 HG3 LYS 7 HG2 LYS 7 105.752 -3.836 -12.736 49 HD2 LYS 7 HD2 LYS 7 104.449 -2.911 -14.642 50 HD3 LYS 7 HD3 LYS 7 105.809 -1.833 -15.037 51 HE2 LYS 7 HE3 LYS 7 105.652 -4.852 -15.238 52 HE3 LYS 7 HE2 LYS 7 106.156 -3.674 -16.473 53 HZ1 LYS 7 HZ1 LYS 7 108.134 -4.532 -15.713 54 HZ2 LYS 7 HZ2 LYS 7 107.645 -4.634 -14.141 55 HZ3 LYS 7 HZ3 LYS 7 108.006 -3.165 -14.799 56 H VAL 8 H VAL 8 105.310 -2.538 -8.905 57 HA VAL 8 HA VAL 8 107.326 -4.242 -8.102 58 HB VAL 8 HB VAL 8 105.536 -4.450 -6.688 59 HG11 VAL 8 HG11 VAL 8 103.148 -4.731 -7.611 60 HG12 VAL 8 HG12 VAL 8 103.847 -4.383 -9.210 61 HG13 VAL 8 HG13 VAL 8 103.943 -3.168 -7.913 62 HG21 VAL 8 HG21 VAL 8 106.193 -6.787 -7.613 63 HG22 VAL 8 HG22 VAL 8 104.663 -6.709 -8.518 64 HG23 VAL 8 HG23 VAL 8 104.648 -6.652 -6.739 65 H ASP 9 H ASP 9 108.621 -5.357 -9.440 66 HA ASP 9 HA ASP 9 107.436 -6.874 -11.722 67 HB2 ASP 9 HB2 ASP 9 109.703 -5.555 -11.711 68 HB3 ASP 9 HB3 ASP 9 110.338 -6.971 -10.840 69 H ARG 10 H ARG 10 108.675 -7.324 -8.471 70 HA ARG 10 HA ARG 10 107.667 -10.121 -8.546 71 HB2 ARG 10 HB2 ARG 10 110.598 -9.490 -8.000 72 HB3 ARG 10 HB3 ARG 10 109.823 -11.056 -7.661 73 HG2 ARG 10 HG2 ARG 10 109.104 -11.067 -10.127 74 HG3 ARG 10 HG3 ARG 10 110.231 -9.709 -10.357 75 HD2 ARG 10 HD2 ARG 10 110.843 -12.562 -9.529 76 HD3 ARG 10 HD3 ARG 10 111.536 -11.620 -10.871 77 HE ARG 10 HE ARG 10 112.276 -10.178 -8.581 78 HH11 ARG 10 HH11 ARG 10 114.217 -10.595 -7.498 79 HH12 ARG 10 HH12 ARG 10 114.975 -12.165 -7.636 80 HH21 ARG 10 HH21 ARG 10 112.512 -13.454 -9.733 81 HH22 ARG 10 HH22 ARG 10 114.013 -13.777 -8.896 82 H SER 11 H SER 11 107.871 -11.140 -6.310 83 HA SER 11 HA SER 11 108.460 -9.538 -3.979 84 HB2 SER 11 HB3 SER 11 106.560 -8.154 -4.666 85 HB3 SER 11 HB2 SER 11 105.534 -9.598 -4.843 86 HG SER 11 HG SER 11 105.088 -9.271 -2.798 87 H GLU 12 H GLU 12 107.595 -10.667 -1.951 88 HA GLU 12 HA GLU 12 106.320 -13.289 -2.316 89 HB2 GLU 12 HB3 GLU 12 108.316 -14.617 -1.519 90 HB3 GLU 12 HB2 GLU 12 108.503 -13.938 -3.154 91 HG2 GLU 12 HG3 GLU 12 110.018 -12.295 -2.441 92 HG3 GLU 12 HG2 GLU 12 109.451 -12.362 -0.755 93 H ASN 13 H ASN 13 106.285 -14.539 -0.233 94 HA ASN 13 HA ASN 13 105.935 -14.630 2.094 95 HB2 ASN 13 HB3 ASN 13 108.246 -12.878 1.755 96 HB3 ASN 13 HB2 ASN 13 107.272 -12.385 3.160 97 HD21 ASN 13 HD21 ASN 13 108.214 -13.318 4.981 98 HD22 ASN 13 HD22 ASN 13 108.726 -14.987 5.083 99 H TYR 14 H TYR 14 104.990 -12.060 0.137 100 HA TYR 14 HA TYR 14 103.924 -10.104 1.848 101 HB2 TYR 14 HB2 TYR 14 103.628 -10.754 -0.823 102 HB3 TYR 14 HB3 TYR 14 101.987 -11.028 -0.194 103 HD1 TYR 14 HD1 TYR 14 104.651 -8.559 0.766 104 HD2 TYR 14 HD2 TYR 14 100.681 -9.168 -0.755 105 HE1 TYR 14 HE1 TYR 14 104.262 -6.109 0.801 106 HE2 TYR 14 HE2 TYR 14 100.291 -6.721 -0.720 107 HH TYR 14 HH TYR 14 101.628 -4.646 0.896 108 H ASP 15 H ASP 15 102.065 -13.017 0.775 109 HA ASP 15 HA ASP 15 99.842 -12.697 2.450 110 HB2 ASP 15 HB3 ASP 15 99.516 -15.080 2.341 111 HB3 ASP 15 HB2 ASP 15 100.301 -14.607 0.815 112 H LYS 16 H LYS 16 103.007 -14.126 3.342 113 HA LYS 16 HA LYS 16 102.267 -14.713 6.075 114 HB2 LYS 16 HB3 LYS 16 105.001 -13.948 4.950 115 HB3 LYS 16 HB2 LYS 16 104.700 -14.756 6.507 116 HG2 LYS 16 HG2 LYS 16 103.562 -15.979 3.999 117 HG3 LYS 16 HG3 LYS 16 105.299 -16.175 4.332 118 HD2 LYS 16 HD2 LYS 16 103.093 -16.832 6.333 119 HD3 LYS 16 HD3 LYS 16 103.858 -18.033 5.266 120 HE2 LYS 16 HE2 LYS 16 105.319 -18.289 7.010 121 HE3 LYS 16 HE3 LYS 16 106.069 -16.816 6.350 122 HZ1 LYS 16 HZ1 LYS 16 105.593 -16.597 8.698 123 HZ2 LYS 16 HZ2 LYS 16 104.685 -15.525 7.834 124 HZ3 LYS 16 HZ3 LYS 16 103.990 -16.890 8.445 125 H PHE 17 H PHE 17 103.667 -11.825 4.512 126 HA PHE 17 HA PHE 17 103.932 -10.322 6.994 127 HB2 PHE 17 HB2 PHE 17 105.201 -9.530 5.165 128 HB3 PHE 17 HB3 PHE 17 103.821 -9.626 4.047 129 HD1 PHE 17 HD1 PHE 17 104.995 -7.859 7.138 130 HD2 PHE 17 HD2 PHE 17 102.519 -7.723 3.634 131 HE1 PHE 17 HE1 PHE 17 104.456 -5.486 7.610 132 HE2 PHE 17 HE2 PHE 17 101.976 -5.351 4.107 133 HZ PHE 17 HZ PHE 17 102.946 -4.231 6.096 134 H MET 18 H MET 18 101.520 -10.161 4.330 135 HA MET 18 HA MET 18 99.746 -8.346 5.670 136 HB2 MET 18 HB2 MET 18 99.393 -10.457 3.536 137 HB3 MET 18 HB3 MET 18 97.963 -9.651 4.223 138 HG2 MET 18 HG2 MET 18 100.309 -7.979 3.323 139 HG3 MET 18 HG3 MET 18 99.180 -8.620 2.106 140 HE1 MET 18 HE1 MET 18 100.303 -6.257 4.175 141 HE2 MET 18 HE2 MET 18 99.334 -4.967 3.425 142 HE3 MET 18 HE3 MET 18 99.029 -5.442 5.114 143 H GLU 19 H GLU 19 100.219 -11.842 5.996 144 HA GLU 19 HA GLU 19 97.771 -12.228 7.580 145 HB2 GLU 19 HB3 GLU 19 98.675 -14.165 6.475 146 HB3 GLU 19 HB2 GLU 19 100.290 -13.890 7.171 147 HG2 GLU 19 HG2 GLU 19 99.532 -14.455 9.381 148 HG3 GLU 19 HG3 GLU 19 97.825 -14.411 8.880 149 H LYS 20 H LYS 20 101.061 -11.191 8.205 150 HA LYS 20 HA LYS 20 101.002 -11.740 11.076 151 HB2 LYS 20 HB2 LYS 20 102.972 -11.034 9.340 152 HB3 LYS 20 HB3 LYS 20 102.622 -9.445 10.060 153 HG2 LYS 20 HG2 LYS 20 104.215 -10.297 11.554 154 HG3 LYS 20 HG3 LYS 20 102.694 -10.784 12.339 155 HD2 LYS 20 HD3 LYS 20 102.856 -13.022 11.379 156 HD3 LYS 20 HD2 LYS 20 104.283 -12.550 10.426 157 HE2 LYS 20 HE2 LYS 20 105.283 -13.593 12.266 158 HE3 LYS 20 HE3 LYS 20 105.276 -11.892 12.789 159 HZ1 LYS 20 HZ1 LYS 20 104.411 -13.351 14.494 160 HZ2 LYS 20 HZ2 LYS 20 103.234 -13.908 13.483 161 HZ3 LYS 20 HZ3 LYS 20 103.226 -12.331 13.967 162 H MET 21 H MET 21 100.431 -8.784 9.109 163 HA MET 21 HA MET 21 99.776 -7.085 11.337 164 HB2 MET 21 HB3 MET 21 99.688 -6.950 8.463 165 HB3 MET 21 HB2 MET 21 98.114 -6.403 9.088 166 HG2 MET 21 HG2 MET 21 99.416 -4.929 10.726 167 HG3 MET 21 HG3 MET 21 100.875 -5.324 9.786 168 HE1 MET 21 HE1 MET 21 100.705 -3.486 6.599 169 HE2 MET 21 HE2 MET 21 101.693 -3.995 7.989 170 HE3 MET 21 HE3 MET 21 100.777 -5.204 7.057 171 H GLY 22 H GLY 22 98.188 -9.861 10.167 172 HA2 GLY 22 HA2 GLY 22 96.215 -10.841 11.105 173 HA3 GLY 22 HA3 GLY 22 95.907 -9.330 11.994 174 H VAL 23 H VAL 23 96.546 -9.472 8.516 175 HA VAL 23 HA VAL 23 94.033 -8.022 7.996 176 HB VAL 23 HB VAL 23 95.904 -9.314 5.969 177 HG11 VAL 23 HG11 VAL 23 93.735 -8.473 5.114 178 HG12 VAL 23 HG12 VAL 23 95.084 -7.467 4.534 179 HG13 VAL 23 HG13 VAL 23 94.053 -6.891 5.865 180 HG21 VAL 23 HG21 VAL 23 96.139 -6.431 6.806 181 HG22 VAL 23 HG22 VAL 23 96.867 -7.674 7.852 182 HG23 VAL 23 HG23 VAL 23 97.381 -7.527 6.154 183 H ASN 24 H ASN 24 92.096 -8.881 7.370 184 HA ASN 24 HA ASN 24 91.442 -11.604 7.704 185 HB2 ASN 24 HB2 ASN 24 89.956 -9.474 7.158 186 HB3 ASN 24 HB3 ASN 24 90.114 -10.050 5.482 187 HD21 ASN 24 HD21 ASN 24 89.314 -11.334 8.789 188 HD22 ASN 24 HD22 ASN 24 88.105 -12.458 8.209 189 H ILE 25 H ILE 25 90.554 -13.000 5.705 190 HA ILE 25 HA ILE 25 92.974 -13.476 4.040 191 HB ILE 25 HB ILE 25 90.412 -14.951 4.621 192 HG12 ILE 25 HG13 ILE 25 92.737 -15.136 5.825 193 HG13 ILE 25 HG12 ILE 25 91.868 -16.628 5.396 194 HG21 ILE 25 HG21 ILE 25 91.113 -16.618 2.831 195 HG22 ILE 25 HG22 ILE 25 92.223 -15.373 2.208 196 HG23 ILE 25 HG23 ILE 25 90.467 -15.081 2.209 197 HD11 ILE 25 HD11 ILE 25 94.412 -16.430 4.786 198 HD12 ILE 25 HD12 ILE 25 93.841 -15.394 3.457 199 HD13 ILE 25 HD13 ILE 25 93.288 -17.082 3.570 200 H VAL 26 H VAL 26 90.351 -11.515 3.859 201 HA VAL 26 HA VAL 26 89.797 -11.841 0.962 202 HB VAL 26 HB VAL 26 88.998 -9.562 2.823 203 HG11 VAL 26 HG11 VAL 26 88.759 -9.118 0.394 204 HG12 VAL 26 HG12 VAL 26 87.830 -10.625 0.211 205 HG13 VAL 26 HG13 VAL 26 87.167 -9.282 1.174 206 HG21 VAL 26 HG21 VAL 26 88.269 -11.752 3.731 207 HG22 VAL 26 HG22 VAL 26 86.881 -10.819 3.120 208 HG23 VAL 26 HG23 VAL 26 87.544 -12.161 2.158 209 H LYS 27 H LYS 27 91.058 -9.141 2.982 210 HA LYS 27 HA LYS 27 92.136 -7.717 0.691 211 HB2 LYS 27 HB2 LYS 27 92.309 -7.537 3.662 212 HB3 LYS 27 HB3 LYS 27 93.698 -6.864 2.776 213 HG2 LYS 27 HG2 LYS 27 92.029 -5.104 3.086 214 HG3 LYS 27 HG3 LYS 27 92.089 -5.543 1.362 215 HD2 LYS 27 HD2 LYS 27 90.157 -7.150 1.827 216 HD3 LYS 27 HD3 LYS 27 90.019 -6.389 3.430 217 HE2 LYS 27 HE3 LYS 27 89.994 -4.774 0.853 218 HE3 LYS 27 HE2 LYS 27 88.508 -5.429 1.583 219 HZ1 LYS 27 HZ1 LYS 27 88.955 -3.188 2.334 220 HZ2 LYS 27 HZ2 LYS 27 90.430 -3.633 2.924 221 HZ3 LYS 27 HZ3 LYS 27 89.054 -4.240 3.601 222 H ARG 28 H ARG 28 93.270 -10.370 2.676 223 HA ARG 28 HA ARG 28 96.088 -10.128 1.899 224 HB2 ARG 28 HB3 ARG 28 95.138 -11.402 3.920 225 HB3 ARG 28 HB2 ARG 28 94.652 -12.667 2.767 226 HG2 ARG 28 HG2 ARG 28 97.030 -12.805 1.981 227 HG3 ARG 28 HG3 ARG 28 97.481 -11.628 3.238 228 HD2 ARG 28 HD3 ARG 28 97.876 -13.561 4.435 229 HD3 ARG 28 HD2 ARG 28 96.138 -13.397 4.780 230 HE ARG 28 HE ARG 28 96.282 -14.873 2.370 231 HH11 ARG 28 HH11 ARG 28 96.277 -17.133 2.415 232 HH12 ARG 28 HH12 ARG 28 96.782 -17.981 3.859 233 HH21 ARG 28 HH21 ARG 28 97.447 -15.067 5.645 234 HH22 ARG 28 HH22 ARG 28 97.442 -16.816 5.680 235 H LYS 29 H LYS 29 93.293 -12.065 0.745 236 HA LYS 29 HA LYS 29 94.866 -13.434 -1.305 237 HB2 LYS 29 HB3 LYS 29 92.812 -14.471 -0.634 238 HB3 LYS 29 HB2 LYS 29 91.885 -12.976 -0.905 239 HG2 LYS 29 HG2 LYS 29 91.831 -13.261 -3.198 240 HG3 LYS 29 HG3 LYS 29 93.405 -14.092 -3.239 241 HD2 LYS 29 HD3 LYS 29 91.087 -15.440 -1.859 242 HD3 LYS 29 HD2 LYS 29 91.146 -15.445 -3.638 243 HE2 LYS 29 HE2 LYS 29 93.487 -16.355 -3.505 244 HE3 LYS 29 HE3 LYS 29 93.304 -16.465 -1.738 245 HZ1 LYS 29 HZ1 LYS 29 92.768 -18.545 -2.819 246 HZ2 LYS 29 HZ2 LYS 29 91.596 -17.822 -3.727 247 HZ3 LYS 29 HZ3 LYS 29 91.426 -17.924 -2.090 248 H LEU 30 H LEU 30 93.043 -10.397 -1.160 249 HA LEU 30 HA LEU 30 93.365 -9.991 -4.092 250 HB2 LEU 30 HB3 LEU 30 92.322 -8.086 -1.954 251 HB3 LEU 30 HB2 LEU 30 92.186 -7.871 -3.716 252 HG LEU 30 HG LEU 30 91.033 -10.236 -2.173 253 HD11 LEU 30 HD11 LEU 30 89.898 -8.111 -1.583 254 HD12 LEU 30 HD12 LEU 30 88.843 -9.146 -2.575 255 HD13 LEU 30 HD13 LEU 30 89.671 -7.753 -3.311 256 HD21 LEU 30 HD21 LEU 30 91.596 -10.689 -4.546 257 HD22 LEU 30 HD22 LEU 30 89.834 -10.649 -4.304 258 HD23 LEU 30 HD23 LEU 30 90.662 -9.257 -5.040 259 H ALA 31 H ALA 31 95.129 -9.497 -1.271 260 HA ALA 31 HA ALA 31 96.623 -7.132 -2.286 261 HB1 ALA 31 HB1 ALA 31 98.071 -7.683 -0.209 262 HB2 ALA 31 HB2 ALA 31 96.823 -8.890 0.181 263 HB3 ALA 31 HB3 ALA 31 96.392 -7.166 0.081 264 H ALA 32 H ALA 32 97.264 -10.609 -1.640 265 HA ALA 32 HA ALA 32 99.952 -10.811 -2.333 266 HB1 ALA 32 HB1 ALA 32 99.447 -13.051 -3.268 267 HB2 ALA 32 HB2 ALA 32 98.527 -12.760 -1.773 268 HB3 ALA 32 HB3 ALA 32 97.720 -12.626 -3.354 269 H HIS 33 H HIS 33 97.326 -9.825 -4.414 270 HA HIS 33 HA HIS 33 98.676 -10.363 -6.947 271 HB2 HIS 33 HB2 HIS 33 96.217 -9.919 -6.722 272 HB3 HIS 33 HB3 HIS 33 96.590 -8.231 -6.300 273 HD2 HIS 33 HD2 HIS 33 99.015 -9.333 -9.015 274 HE1 HIS 33 HE1 HIS 33 95.770 -7.570 -11.062 275 HE2 HIS 33 HE2 HIS 33 98.168 -8.408 -11.321 276 H ASP 34 H ASP 34 100.449 -9.159 -5.006 277 HA ASP 34 HA ASP 34 100.841 -6.370 -5.244 278 HB2 ASP 34 HB2 ASP 34 103.342 -6.967 -5.055 279 HB3 ASP 34 HB3 ASP 34 102.275 -7.589 -3.774 280 H ASN 35 H ASN 35 100.222 -5.668 -7.338 281 HA ASN 35 HA ASN 35 102.413 -5.949 -9.363 282 HB2 ASN 35 HB2 ASN 35 100.441 -7.678 -9.698 283 HB3 ASN 35 HB3 ASN 35 99.549 -6.255 -10.286 284 HD21 ASN 35 HD21 ASN 35 102.614 -5.384 -11.014 285 HD22 ASN 35 HD22 ASN 35 102.775 -6.096 -12.603 286 H LEU 36 H LEU 36 101.799 -3.753 -7.704 287 HA LEU 36 HA LEU 36 100.095 -1.935 -9.358 288 HB2 LEU 36 HB2 LEU 36 100.277 -0.380 -7.502 289 HB3 LEU 36 HB3 LEU 36 99.925 -1.994 -6.841 290 HG LEU 36 HG LEU 36 102.819 -1.321 -7.163 291 HD11 LEU 36 HD11 LEU 36 101.897 0.830 -6.338 292 HD12 LEU 36 HD12 LEU 36 101.070 -0.032 -5.018 293 HD13 LEU 36 HD13 LEU 36 102.849 0.014 -5.074 294 HD21 LEU 36 HD21 LEU 36 102.013 -3.445 -6.162 295 HD22 LEU 36 HD22 LEU 36 101.138 -2.524 -4.915 296 HD23 LEU 36 HD23 LEU 36 102.917 -2.478 -4.971 297 H LYS 37 H LYS 37 100.925 0.327 -9.688 298 HA LYS 37 HA LYS 37 103.791 0.205 -10.643 299 HB2 LYS 37 HB2 LYS 37 101.303 1.175 -11.822 300 HB3 LYS 37 HB3 LYS 37 102.494 2.492 -11.713 301 HG2 LYS 37 HG2 LYS 37 104.164 1.129 -12.881 302 HG3 LYS 37 HG3 LYS 37 103.053 -0.262 -12.901 303 HD2 LYS 37 HD2 LYS 37 101.409 1.336 -14.135 304 HD3 LYS 37 HD3 LYS 37 102.839 2.359 -14.414 305 HE2 LYS 37 HE3 LYS 37 102.873 1.003 -16.320 306 HE3 LYS 37 HE2 LYS 37 103.932 0.084 -15.224 307 HZ1 LYS 37 HZ1 LYS 37 102.266 -1.323 -16.238 308 HZ2 LYS 37 HZ2 LYS 37 102.029 -1.249 -14.608 309 HZ3 LYS 37 HZ3 LYS 37 101.047 -0.398 -15.623 310 H LEU 38 H LEU 38 105.159 2.040 -10.159 311 HA LEU 38 HA LEU 38 103.994 3.989 -8.177 312 HB2 LEU 38 HB2 LEU 38 106.692 2.676 -7.709 313 HB3 LEU 38 HB3 LEU 38 105.707 3.619 -6.567 314 HG LEU 38 HG LEU 38 103.923 1.688 -7.057 315 HD11 LEU 38 HD11 LEU 38 105.936 -0.328 -7.008 316 HD12 LEU 38 HD12 LEU 38 104.737 -0.022 -8.287 317 HD13 LEU 38 HD13 LEU 38 106.337 0.754 -8.363 318 HD21 LEU 38 HD21 LEU 38 104.471 1.814 -4.825 319 HD22 LEU 38 HD22 LEU 38 106.217 1.922 -5.154 320 HD23 LEU 38 HD23 LEU 38 105.397 0.343 -5.208 321 H THR 39 H THR 39 104.439 5.987 -8.912 322 HA THR 39 HA THR 39 106.898 6.358 -10.623 323 HB THR 39 HB THR 39 104.783 8.473 -10.150 324 HG1 THR 39 HG1 THR 39 103.525 6.775 -10.782 325 HG21 THR 39 HG21 THR 39 105.418 9.086 -12.467 326 HG22 THR 39 HG22 THR 39 106.846 9.032 -11.405 327 HG23 THR 39 HG23 THR 39 106.524 7.692 -12.532 328 H ILE 40 H ILE 40 108.658 6.947 -9.408 329 HA ILE 40 HA ILE 40 108.100 8.692 -7.002 330 HB ILE 40 HB ILE 40 110.450 6.843 -7.585 331 HG12 ILE 40 HG13 ILE 40 109.399 5.765 -5.435 332 HG13 ILE 40 HG12 ILE 40 107.936 6.661 -5.906 333 HG21 ILE 40 HG21 ILE 40 110.833 7.361 -5.056 334 HG22 ILE 40 HG22 ILE 40 111.325 8.590 -6.246 335 HG23 ILE 40 HG23 ILE 40 109.802 8.783 -5.345 336 HD11 ILE 40 HD11 ILE 40 108.654 4.153 -6.855 337 HD12 ILE 40 HD12 ILE 40 107.506 5.261 -7.644 338 HD13 ILE 40 HD13 ILE 40 109.211 5.234 -8.155 339 H THR 41 H THR 41 109.240 10.542 -6.668 340 HA THR 41 HA THR 41 111.269 11.334 -8.756 341 HB THR 41 HB THR 41 109.335 13.348 -7.599 342 HG1 THR 41 HG1 THR 41 107.918 11.909 -8.489 343 HG21 THR 41 HG21 THR 41 109.815 14.476 -9.754 344 HG22 THR 41 HG22 THR 41 111.319 14.099 -8.879 345 HG23 THR 41 HG23 THR 41 110.814 13.091 -10.256 346 H GLN 42 H GLN 42 112.861 12.849 -7.908 347 HA GLN 42 HA GLN 42 112.767 13.080 -4.889 348 HB2 GLN 42 HB2 GLN 42 114.369 11.352 -5.328 349 HB3 GLN 42 HB3 GLN 42 115.073 12.252 -6.693 350 HG2 GLN 42 HG3 GLN 42 116.173 13.777 -5.290 351 HG3 GLN 42 HG2 GLN 42 115.058 13.487 -3.933 352 HE21 GLN 42 HE21 GLN 42 115.197 11.210 -2.925 353 HE22 GLN 42 HE22 GLN 42 116.774 10.454 -2.881 354 H GLU 43 H GLU 43 113.620 15.017 -4.022 355 HA GLU 43 HA GLU 43 114.726 16.991 -5.999 356 HB2 GLU 43 HB2 GLU 43 112.252 17.396 -4.273 357 HB3 GLU 43 HB3 GLU 43 113.183 18.753 -4.951 358 HG2 GLU 43 HG3 GLU 43 112.065 16.470 -6.632 359 HG3 GLU 43 HG2 GLU 43 111.212 18.010 -6.371 360 H GLY 44 H GLY 44 116.671 16.399 -4.729 361 HA2 GLY 44 HA3 GLY 44 118.256 16.983 -3.084 362 HA3 GLY 44 HA2 GLY 44 117.228 18.384 -2.709 363 H ASN 45 H ASN 45 115.596 18.170 -1.076 364 HA ASN 45 HA ASN 45 115.978 15.728 0.674 365 HB2 ASN 45 HB3 ASN 45 115.226 18.428 1.802 366 HB3 ASN 45 HB2 ASN 45 116.037 17.059 2.600 367 HD21 ASN 45 HD21 ASN 45 118.271 17.249 2.807 368 HD22 ASN 45 HD22 ASN 45 119.269 18.304 1.832 369 H LYS 46 H LYS 46 113.921 16.312 -1.425 370 HA LYS 46 HA LYS 46 111.585 15.716 0.321 371 HB2 LYS 46 HB3 LYS 46 111.860 18.200 -1.384 372 HB3 LYS 46 HB2 LYS 46 110.266 17.431 -1.206 373 HG2 LYS 46 HG2 LYS 46 110.077 18.632 0.716 374 HG3 LYS 46 HG3 LYS 46 111.236 17.474 1.409 375 HD2 LYS 46 HD2 LYS 46 113.113 18.924 0.773 376 HD3 LYS 46 HD3 LYS 46 111.998 20.057 -0.027 377 HE2 LYS 46 HE2 LYS 46 111.146 20.856 1.987 378 HE3 LYS 46 HE3 LYS 46 111.508 19.347 2.860 379 HZ1 LYS 46 HZ1 LYS 46 113.012 21.117 3.482 380 HZ2 LYS 46 HZ2 LYS 46 113.506 21.306 1.920 381 HZ3 LYS 46 HZ3 LYS 46 113.842 19.908 2.728 382 H PHE 47 H PHE 47 111.048 13.844 -0.549 383 HA PHE 47 HA PHE 47 111.244 13.505 -3.531 384 HB2 PHE 47 HB3 PHE 47 110.494 11.264 -1.666 385 HB3 PHE 47 HB2 PHE 47 111.462 11.221 -3.159 386 HD1 PHE 47 HD1 PHE 47 113.288 13.575 -2.510 387 HD2 PHE 47 HD2 PHE 47 112.034 10.198 -0.170 388 HE1 PHE 47 HE1 PHE 47 115.365 13.736 -1.166 389 HE2 PHE 47 HE2 PHE 47 114.112 10.358 1.173 390 HZ PHE 47 HZ PHE 47 115.779 12.126 0.674 391 H THR 48 H THR 48 109.427 11.981 -4.398 392 HA THR 48 HA THR 48 106.797 12.491 -3.078 393 HB THR 48 HB THR 48 107.456 13.411 -5.916 394 HG1 THR 48 HG1 THR 48 106.908 15.464 -4.990 395 HG21 THR 48 HG21 THR 48 105.098 14.179 -5.948 396 HG22 THR 48 HG22 THR 48 104.848 13.477 -4.332 397 HG23 THR 48 HG23 THR 48 105.193 12.416 -5.718 398 H VAL 49 H VAL 49 106.318 10.370 -2.891 399 HA VAL 49 HA VAL 49 106.792 8.558 -5.236 400 HB VAL 49 HB VAL 49 105.948 8.058 -2.351 401 HG11 VAL 49 HG11 VAL 49 104.844 6.449 -3.881 402 HG12 VAL 49 HG12 VAL 49 106.113 5.651 -2.922 403 HG13 VAL 49 HG13 VAL 49 106.418 6.075 -4.623 404 HG21 VAL 49 HG21 VAL 49 108.153 6.926 -2.240 405 HG22 VAL 49 HG22 VAL 49 108.333 8.633 -2.709 406 HG23 VAL 49 HG23 VAL 49 108.457 7.354 -3.941 407 H LYS 50 H LYS 50 105.163 8.583 -6.709 408 HA LYS 50 HA LYS 50 102.354 8.938 -5.683 409 HB2 LYS 50 HB2 LYS 50 103.723 9.335 -8.345 410 HB3 LYS 50 HB3 LYS 50 101.971 9.022 -8.306 411 HG2 LYS 50 HG3 LYS 50 101.716 10.908 -6.672 412 HG3 LYS 50 HG2 LYS 50 103.453 11.255 -6.848 413 HD2 LYS 50 HD2 LYS 50 103.204 11.832 -9.159 414 HD3 LYS 50 HD3 LYS 50 101.565 11.142 -9.231 415 HE2 LYS 50 HE2 LYS 50 101.986 13.785 -8.936 416 HE3 LYS 50 HE3 LYS 50 100.605 12.962 -8.173 417 HZ1 LYS 50 HZ1 LYS 50 102.048 14.405 -6.710 418 HZ2 LYS 50 HZ2 LYS 50 101.720 12.889 -6.150 419 HZ3 LYS 50 HZ3 LYS 50 103.195 13.223 -6.809 420 H GLU 51 H GLU 51 101.706 6.898 -4.995 421 HA GLU 51 HA GLU 51 102.426 4.478 -6.498 422 HB2 GLU 51 HB2 GLU 51 100.663 5.152 -4.155 423 HB3 GLU 51 HB3 GLU 51 100.384 3.610 -4.998 424 HG2 GLU 51 HG2 GLU 51 102.481 2.763 -4.429 425 HG3 GLU 51 HG3 GLU 51 103.207 4.381 -4.271 426 H SER 52 H SER 52 100.818 3.076 -7.588 427 HA SER 52 HA SER 52 98.235 4.269 -8.347 428 HB2 SER 52 HB3 SER 52 100.229 3.815 -10.593 429 HB3 SER 52 HB2 SER 52 98.656 4.647 -10.660 430 HG SER 52 HG SER 52 100.583 6.047 -10.547 431 H SER 53 H SER 53 97.132 2.482 -7.961 432 HA SER 53 HA SER 53 97.889 0.015 -9.515 433 HB2 SER 53 HB3 SER 53 97.943 -1.313 -7.657 434 HB3 SER 53 HB2 SER 53 98.218 0.207 -6.772 435 HG SER 53 HG SER 53 96.436 -0.589 -5.805 436 H ALA 54 H ALA 54 96.076 -1.104 -10.333 437 HA ALA 54 HA ALA 54 93.689 0.434 -10.767 438 HB1 ALA 54 HB1 ALA 54 92.701 -1.694 -11.568 439 HB2 ALA 54 HB2 ALA 54 94.044 -2.597 -10.827 440 HB3 ALA 54 HB3 ALA 54 94.358 -1.489 -12.184 441 H PHE 55 H PHE 55 94.746 -0.494 -7.856 442 HA PHE 55 HA PHE 55 91.988 -1.257 -6.883 443 HB2 PHE 55 HB3 PHE 55 94.705 -1.719 -5.580 444 HB3 PHE 55 HB2 PHE 55 93.133 -2.230 -4.919 445 HD1 PHE 55 HD1 PHE 55 95.603 -2.762 -7.631 446 HD2 PHE 55 HD2 PHE 55 91.921 -4.101 -5.868 447 HE1 PHE 55 HE1 PHE 55 95.705 -4.834 -8.990 448 HE2 PHE 55 HE2 PHE 55 92.022 -6.171 -7.231 449 HZ PHE 55 HZ PHE 55 93.915 -6.538 -8.792 450 H ARG 56 H ARG 56 94.494 1.206 -6.715 451 HA ARG 56 HA ARG 56 92.915 3.171 -5.517 452 HB2 ARG 56 HB2 ARG 56 93.677 1.106 -3.554 453 HB3 ARG 56 HB3 ARG 56 94.181 2.741 -3.064 454 HG2 ARG 56 HG2 ARG 56 91.399 2.356 -4.161 455 HG3 ARG 56 HG3 ARG 56 91.736 1.839 -2.492 456 HD2 ARG 56 HD2 ARG 56 92.407 4.041 -1.839 457 HD3 ARG 56 HD3 ARG 56 92.515 4.590 -3.529 458 HE ARG 56 HE ARG 56 89.857 3.919 -3.370 459 HH11 ARG 56 HH11 ARG 56 88.241 5.255 -2.532 460 HH12 ARG 56 HH12 ARG 56 88.640 6.464 -1.332 461 HH21 ARG 56 HH21 ARG 56 92.025 5.653 -1.268 462 HH22 ARG 56 HH22 ARG 56 90.774 6.689 -0.620 463 H ASN 57 H ASN 57 94.413 4.244 -6.941 464 HA ASN 57 HA ASN 57 97.276 4.221 -6.526 465 HB2 ASN 57 HB3 ASN 57 97.287 6.264 -7.893 466 HB3 ASN 57 HB2 ASN 57 96.141 5.090 -8.583 467 HD21 ASN 57 HD21 ASN 57 93.810 5.359 -7.291 468 HD22 ASN 57 HD22 ASN 57 93.244 7.015 -7.282 469 H ILE 58 H ILE 58 98.625 5.718 -5.399 470 HA ILE 58 HA ILE 58 97.211 7.603 -3.535 471 HB ILE 58 HB ILE 58 99.420 5.878 -2.444 472 HG12 ILE 58 HG12 ILE 58 96.509 5.085 -2.812 473 HG13 ILE 58 HG13 ILE 58 97.967 4.177 -3.287 474 HG21 ILE 58 HG21 ILE 58 98.197 7.974 -1.366 475 HG22 ILE 58 HG22 ILE 58 98.569 6.545 -0.372 476 HG23 ILE 58 HG23 ILE 58 96.923 6.783 -1.007 477 HD11 ILE 58 HD11 ILE 58 97.400 3.115 -1.282 478 HD12 ILE 58 HD12 ILE 58 98.549 4.350 -0.714 479 HD13 ILE 58 HD13 ILE 58 96.798 4.617 -0.540 480 H GLU 59 H GLU 59 98.939 8.837 -2.239 481 HA GLU 59 HA GLU 59 101.493 9.203 -3.757 482 HB2 GLU 59 HB2 GLU 59 101.151 11.483 -4.268 483 HB3 GLU 59 HB3 GLU 59 99.576 10.750 -4.655 484 HG2 GLU 59 HG2 GLU 59 99.037 11.299 -2.119 485 HG3 GLU 59 HG3 GLU 59 100.357 12.479 -2.306 486 H CYS 60 H CYS 60 103.148 10.020 -2.428 487 HA CYS 60 HA CYS 60 102.407 11.017 0.284 488 HB2 CYS 60 HB3 CYS 60 103.749 8.348 -0.234 489 HB3 CYS 60 HB2 CYS 60 104.053 9.249 1.270 490 HG CYS 60 HG CYS 60 100.813 9.362 0.895 491 H VAL 61 H VAL 61 103.706 12.760 0.526 492 HA VAL 61 HA VAL 61 106.238 12.965 -0.980 493 HB VAL 61 HB VAL 61 105.622 14.794 1.325 494 HG11 VAL 61 HG11 VAL 61 106.353 16.483 -0.348 495 HG12 VAL 61 HG12 VAL 61 106.477 15.201 -1.576 496 HG13 VAL 61 HG13 VAL 61 107.557 15.186 -0.162 497 HG21 VAL 61 HG21 VAL 61 104.033 16.023 -0.314 498 HG22 VAL 61 HG22 VAL 61 103.393 14.584 0.515 499 HG23 VAL 61 HG23 VAL 61 103.931 14.470 -1.178 500 H PHE 62 H PHE 62 108.372 13.026 -0.000 501 HA PHE 62 HA PHE 62 108.450 12.001 2.829 502 HB2 PHE 62 HB2 PHE 62 109.801 10.738 0.412 503 HB3 PHE 62 HB3 PHE 62 110.273 10.384 2.091 504 HD1 PHE 62 HD1 PHE 62 108.473 9.066 -0.502 505 HD2 PHE 62 HD2 PHE 62 107.930 10.112 3.628 506 HE1 PHE 62 HE1 PHE 62 106.621 7.424 -0.327 507 HE2 PHE 62 HE2 PHE 62 106.078 8.474 3.800 508 HZ PHE 62 HZ PHE 62 105.424 7.130 1.824 509 H GLU 63 H GLU 63 110.479 12.351 3.896 510 HA GLU 63 HA GLU 63 112.501 14.031 2.475 511 HB2 GLU 63 HB3 GLU 63 110.979 15.750 3.259 512 HB3 GLU 63 HB2 GLU 63 110.866 14.989 4.864 513 HG2 GLU 63 HG2 GLU 63 113.095 15.581 5.429 514 HG3 GLU 63 HG3 GLU 63 113.529 15.907 3.734 515 H LEU 64 H LEU 64 114.397 14.457 4.054 516 HA LEU 64 HA LEU 64 114.757 11.930 5.648 517 HB2 LEU 64 HB3 LEU 64 116.746 14.001 4.622 518 HB3 LEU 64 HB2 LEU 64 117.185 12.576 5.594 519 HG LEU 64 HG LEU 64 115.518 12.189 3.111 520 HD11 LEU 64 HD11 LEU 64 117.389 13.652 2.399 521 HD12 LEU 64 HD12 LEU 64 117.593 12.001 1.767 522 HD13 LEU 64 HD13 LEU 64 118.549 12.542 3.167 523 HD21 LEU 64 HD21 LEU 64 115.976 10.304 4.658 524 HD22 LEU 64 HD22 LEU 64 117.724 10.588 4.486 525 HD23 LEU 64 HD23 LEU 64 116.769 10.046 3.086 526 H GLY 65 H GLY 65 114.616 12.016 7.826 527 HA2 GLY 65 HA3 GLY 65 115.025 12.893 10.013 528 HA3 GLY 65 HA2 GLY 65 115.692 14.368 9.277 529 H VAL 66 H VAL 66 112.528 13.110 8.344 530 HA VAL 66 HA VAL 66 111.200 15.129 10.128 531 HB VAL 66 HB VAL 66 110.771 15.024 7.108 532 HG11 VAL 66 HG11 VAL 66 108.761 15.631 8.430 533 HG12 VAL 66 HG12 VAL 66 109.385 17.037 7.534 534 HG13 VAL 66 HG13 VAL 66 109.698 16.884 9.279 535 HG21 VAL 66 HG21 VAL 66 112.474 16.738 8.908 536 HG22 VAL 66 HG22 VAL 66 111.670 17.507 7.518 537 HG23 VAL 66 HG23 VAL 66 112.800 16.156 7.258 538 H THR 67 H THR 67 109.977 13.629 11.240 539 HA THR 67 HA THR 67 108.903 11.218 10.128 540 HB THR 67 HB THR 67 107.335 12.691 12.222 541 HG1 THR 67 HG1 THR 67 109.392 13.204 12.875 542 HG21 THR 67 HG21 THR 67 107.359 10.440 13.261 543 HG22 THR 67 HG22 THR 67 108.441 9.858 11.973 544 HG23 THR 67 HG23 THR 67 106.780 10.364 11.579 545 H PHE 68 H PHE 68 107.042 10.717 9.134 546 HA PHE 68 HA PHE 68 104.920 12.773 8.781 547 HB2 PHE 68 HB2 PHE 68 105.040 12.017 6.196 548 HB3 PHE 68 HB3 PHE 68 105.912 13.442 6.807 549 HD1 PHE 68 HD1 PHE 68 106.395 9.709 6.605 550 HD2 PHE 68 HD2 PHE 68 108.149 13.614 6.245 551 HE1 PHE 68 HE1 PHE 68 108.550 8.682 5.925 552 HE2 PHE 68 HE2 PHE 68 110.302 12.586 5.570 553 HZ PHE 68 HZ PHE 68 110.498 10.121 5.408 554 H ASN 69 H ASN 69 103.331 11.465 6.950 555 HA ASN 69 HA ASN 69 103.279 8.625 7.945 556 HB2 ASN 69 HB2 ASN 69 100.969 8.755 8.585 557 HB3 ASN 69 HB3 ASN 69 101.776 10.147 9.346 558 HD21 ASN 69 HD21 ASN 69 99.432 9.158 6.881 559 HD22 ASN 69 HD22 ASN 69 98.913 10.777 6.469 560 H CYS 70 H CYS 70 102.200 7.168 6.595 561 HA CYS 70 HA CYS 70 101.001 8.176 4.061 562 HB2 CYS 70 HB3 CYS 70 103.466 8.008 3.589 563 HB3 CYS 70 HB2 CYS 70 103.401 6.289 4.048 564 HG CYS 70 HG CYS 70 102.348 5.376 1.791 565 H ASN 71 H ASN 71 99.407 6.744 3.386 566 HA ASN 71 HA ASN 71 99.069 4.355 5.166 567 HB2 ASN 71 HB2 ASN 71 96.796 4.263 3.916 568 HB3 ASN 71 HB3 ASN 71 97.068 5.619 5.036 569 HD21 ASN 71 HD21 ASN 71 98.982 5.798 2.146 570 HD22 ASN 71 HD22 ASN 71 97.990 6.969 1.307 571 H LEU 72 H LEU 72 98.921 2.252 4.391 572 HA LEU 72 HA LEU 72 100.143 1.863 1.682 573 HB2 LEU 72 HB3 LEU 72 99.542 -0.062 3.971 574 HB3 LEU 72 HB2 LEU 72 100.286 -0.541 2.427 575 HG LEU 72 HG LEU 72 101.417 1.611 4.268 576 HD11 LEU 72 HD11 LEU 72 101.464 -0.617 5.358 577 HD12 LEU 72 HD12 LEU 72 102.239 -1.307 3.912 578 HD13 LEU 72 HD13 LEU 72 103.102 -0.098 4.893 579 HD21 LEU 72 HD21 LEU 72 102.038 1.800 1.872 580 HD22 LEU 72 HD22 LEU 72 102.574 0.103 1.878 581 HD23 LEU 72 HD23 LEU 72 103.437 1.312 2.858 582 H ALA 73 H ALA 73 99.131 0.653 0.042 583 HA ALA 73 HA ALA 73 96.419 1.001 -0.468 584 HB1 ALA 73 HB1 ALA 73 96.548 -0.973 -1.964 585 HB2 ALA 73 HB2 ALA 73 98.050 -1.484 -1.157 586 HB3 ALA 73 HB3 ALA 73 98.014 0.028 -2.095 587 H ASP 74 H ASP 74 97.879 -1.549 1.549 588 HA ASP 74 HA ASP 74 95.540 -3.178 1.861 589 HB2 ASP 74 HB3 ASP 74 97.935 -3.612 2.708 590 HB3 ASP 74 HB2 ASP 74 97.513 -2.579 4.094 591 H GLY 75 H GLY 75 95.668 0.047 2.380 592 HA2 GLY 75 HA2 GLY 75 94.071 1.445 3.453 593 HA3 GLY 75 HA3 GLY 75 93.265 -0.012 4.083 594 H THR 76 H THR 76 96.713 0.458 4.546 595 HA THR 76 HA THR 76 96.167 0.708 7.492 596 HB THR 76 HB THR 76 98.964 0.393 6.597 597 HG1 THR 76 HG1 THR 76 97.997 -0.839 4.975 598 HG21 THR 76 HG21 THR 76 98.895 -1.402 8.303 599 HG22 THR 76 HG22 THR 76 97.129 -1.214 8.429 600 HG23 THR 76 HG23 THR 76 98.204 0.111 8.936 601 H GLU 77 H GLU 77 97.593 2.169 8.727 602 HA GLU 77 HA GLU 77 98.566 4.511 7.090 603 HB2 GLU 77 HB2 GLU 77 96.268 4.893 8.162 604 HB3 GLU 77 HB3 GLU 77 97.089 4.778 9.738 605 HG2 GLU 77 HG3 GLU 77 98.657 6.600 8.985 606 HG3 GLU 77 HG2 GLU 77 97.680 6.770 7.506 607 H LEU 78 H LEU 78 100.702 4.887 7.580 608 HA LEU 78 HA LEU 78 101.560 4.259 10.413 609 HB2 LEU 78 HB2 LEU 78 103.419 3.711 8.099 610 HB3 LEU 78 HB3 LEU 78 103.420 3.012 9.735 611 HG LEU 78 HG LEU 78 101.007 2.125 8.920 612 HD11 LEU 78 HD11 LEU 78 101.180 3.220 6.700 613 HD12 LEU 78 HD12 LEU 78 102.680 2.319 6.375 614 HD13 LEU 78 HD13 LEU 78 101.137 1.448 6.538 615 HD21 LEU 78 HD21 LEU 78 102.900 0.743 9.737 616 HD22 LEU 78 HD22 LEU 78 102.138 0.005 8.307 617 HD23 LEU 78 HD23 LEU 78 103.682 0.876 8.143 618 H ARG 79 H ARG 79 103.665 5.323 10.991 619 HA ARG 79 HA ARG 79 104.350 7.681 9.268 620 HB2 ARG 79 HB2 ARG 79 103.960 9.313 10.959 621 HB3 ARG 79 HB3 ARG 79 102.502 8.294 10.968 622 HG2 ARG 79 HG2 ARG 79 103.451 6.980 12.861 623 HG3 ARG 79 HG3 ARG 79 104.881 8.040 12.864 624 HD2 ARG 79 HD3 ARG 79 103.513 9.980 13.408 625 HD3 ARG 79 HD2 ARG 79 102.019 9.029 13.225 626 HE ARG 79 HE ARG 79 102.408 8.042 15.373 627 HH11 ARG 79 HH11 ARG 79 103.539 7.991 17.330 628 HH12 ARG 79 HH12 ARG 79 105.101 8.768 17.457 629 HH21 ARG 79 HH21 ARG 79 105.114 9.861 14.152 630 HH22 ARG 79 HH22 ARG 79 105.989 9.822 15.666 631 H GLY 80 H GLY 80 106.498 8.340 9.501 632 HA2 GLY 80 HA2 GLY 80 108.174 7.903 11.744 633 HA3 GLY 80 HA3 GLY 80 108.318 6.446 10.728 634 H THR 81 H THR 81 109.914 6.558 9.226 635 HA THR 81 HA THR 81 110.209 8.660 7.331 636 HB THR 81 HB THR 81 112.586 9.276 8.778 637 HG1 THR 81 HG1 THR 81 111.874 9.794 10.772 638 HG21 THR 81 HG21 THR 81 111.450 11.557 8.907 639 HG22 THR 81 HG22 THR 81 111.537 10.839 7.280 640 HG23 THR 81 HG23 THR 81 110.011 10.788 8.196 641 H TRP 82 H TRP 82 112.128 8.438 6.007 642 HA TRP 82 HA TRP 82 113.386 5.721 6.373 643 HB2 TRP 82 HB2 TRP 82 113.623 7.468 3.903 644 HB3 TRP 82 HB3 TRP 82 113.799 5.702 4.036 645 HD1 TRP 82 HD1 TRP 82 111.055 8.376 4.576 646 HE1 TRP 82 HE1 TRP 82 108.780 7.393 3.873 647 HE3 TRP 82 HE3 TRP 82 112.567 3.660 3.361 648 HZ2 TRP 82 HZ2 TRP 82 107.767 4.864 2.896 649 HZ3 TRP 82 HZ3 TRP 82 110.936 1.983 2.545 650 HH2 TRP 82 HH2 TRP 82 108.541 2.578 2.313 651 H SER 83 H SER 83 115.632 5.504 6.472 652 HA SER 83 HA SER 83 117.238 8.047 6.318 653 HB2 SER 83 HB2 SER 83 117.051 8.036 8.637 654 HB3 SER 83 HB3 SER 83 116.840 6.269 8.716 655 HG SER 83 HG SER 83 118.939 6.988 9.444 656 H LEU 84 H LEU 84 119.570 7.580 5.990 657 HA LEU 84 HA LEU 84 119.840 4.927 4.628 658 HB2 LEU 84 HB2 LEU 84 120.861 6.315 3.142 659 HB3 LEU 84 HB3 LEU 84 121.044 7.610 4.348 660 HG LEU 84 HG LEU 84 122.959 6.300 5.349 661 HD11 LEU 84 HD11 LEU 84 123.477 4.761 2.918 662 HD12 LEU 84 HD12 LEU 84 121.947 4.266 3.680 663 HD13 LEU 84 HD13 LEU 84 123.462 4.220 4.613 664 HD21 LEU 84 HD21 LEU 84 124.559 6.905 3.553 665 HD22 LEU 84 HD22 LEU 84 123.209 7.055 2.402 666 HD23 LEU 84 HD23 LEU 84 123.335 8.179 3.777 667 H GLU 85 H GLU 85 120.919 3.282 5.584 668 HA GLU 85 HA GLU 85 122.822 3.968 7.821 669 HB2 GLU 85 HB3 GLU 85 121.873 2.406 9.293 670 HB3 GLU 85 HB2 GLU 85 120.430 3.100 8.518 671 HG2 GLU 85 HG3 GLU 85 120.545 1.198 6.829 672 HG3 GLU 85 HG2 GLU 85 121.807 0.465 7.850 673 H GLY 86 H GLY 86 124.775 3.040 7.445 674 HA2 GLY 86 HA2 GLY 86 126.368 1.578 6.483 675 HA3 GLY 86 HA3 GLY 86 125.086 0.342 6.464 676 H ASN 87 H ASN 87 124.305 -0.264 4.484 677 HA ASN 87 HA ASN 87 124.807 1.657 2.199 678 HB2 ASN 87 HB3 ASN 87 124.973 -0.575 0.831 679 HB3 ASN 87 HB2 ASN 87 126.377 -0.043 1.788 680 HD21 ASN 87 HD21 ASN 87 123.768 -2.443 1.567 681 HD22 ASN 87 HD22 ASN 87 124.363 -3.463 2.858 682 H LYS 88 H LYS 88 122.302 1.359 3.777 683 HA LYS 88 HA LYS 88 120.581 0.663 1.428 684 HB2 LYS 88 HB3 LYS 88 119.086 -0.735 2.905 685 HB3 LYS 88 HB2 LYS 88 120.683 -1.458 2.599 686 HG2 LYS 88 HG3 LYS 88 121.079 0.136 4.877 687 HG3 LYS 88 HG2 LYS 88 119.481 -0.602 5.135 688 HD2 LYS 88 HD2 LYS 88 120.393 -2.834 4.794 689 HD3 LYS 88 HD3 LYS 88 121.975 -2.162 4.331 690 HE2 LYS 88 HE2 LYS 88 122.369 -1.329 6.552 691 HE3 LYS 88 HE3 LYS 88 120.685 -1.638 7.038 692 HZ1 LYS 88 HZ1 LYS 88 122.169 -3.357 7.829 693 HZ2 LYS 88 HZ2 LYS 88 121.100 -3.988 6.744 694 HZ3 LYS 88 HZ3 LYS 88 122.661 -3.701 6.293 695 H LEU 89 H LEU 89 118.331 1.399 1.713 696 HA LEU 89 HA LEU 89 118.270 3.841 3.472 697 HB2 LEU 89 HB2 LEU 89 116.867 2.971 0.951 698 HB3 LEU 89 HB3 LEU 89 116.032 4.110 2.035 699 HG LEU 89 HG LEU 89 118.916 4.607 1.288 700 HD11 LEU 89 HD11 LEU 89 117.738 4.190 -0.854 701 HD12 LEU 89 HD12 LEU 89 118.143 5.914 -0.672 702 HD13 LEU 89 HD13 LEU 89 116.477 5.357 -0.386 703 HD21 LEU 89 HD21 LEU 89 117.807 5.977 3.034 704 HD22 LEU 89 HD22 LEU 89 116.517 6.399 1.883 705 HD23 LEU 89 HD23 LEU 89 118.183 6.957 1.597 706 H ILE 90 H ILE 90 117.440 3.407 5.461 707 HA ILE 90 HA ILE 90 115.568 1.157 5.823 708 HB ILE 90 HB ILE 90 115.440 2.354 8.205 709 HG12 ILE 90 HG12 ILE 90 118.104 3.304 7.091 710 HG13 ILE 90 HG13 ILE 90 116.684 4.360 7.302 711 HG21 ILE 90 HG21 ILE 90 116.425 0.121 7.646 712 HG22 ILE 90 HG22 ILE 90 117.378 1.005 8.861 713 HG23 ILE 90 HG23 ILE 90 117.934 0.936 7.172 714 HD11 ILE 90 HD11 ILE 90 118.185 4.484 9.263 715 HD12 ILE 90 HD12 ILE 90 118.026 2.726 9.492 716 HD13 ILE 90 HD13 ILE 90 116.609 3.781 9.700 717 H GLY 91 H GLY 91 113.515 1.454 6.990 718 HA2 GLY 91 HA2 GLY 91 112.132 4.062 6.484 719 HA3 GLY 91 HA3 GLY 91 111.475 2.615 5.676 720 H LYS 92 H LYS 92 111.866 4.294 8.711 721 HA LYS 92 HA LYS 92 110.717 2.020 10.261 722 HB2 LYS 92 HB2 LYS 92 111.845 4.739 10.887 723 HB3 LYS 92 HB3 LYS 92 110.703 4.018 12.047 724 HG2 LYS 92 HG2 LYS 92 112.097 1.965 12.135 725 HG3 LYS 92 HG3 LYS 92 113.243 2.698 10.986 726 HD2 LYS 92 HD2 LYS 92 114.015 4.261 12.547 727 HD3 LYS 92 HD3 LYS 92 112.521 4.189 13.512 728 HE2 LYS 92 HE2 LYS 92 113.103 2.013 14.388 729 HE3 LYS 92 HE3 LYS 92 114.465 1.857 13.253 730 HZ1 LYS 92 HZ1 LYS 92 115.201 2.541 15.438 731 HZ2 LYS 92 HZ2 LYS 92 114.238 3.879 15.393 732 HZ3 LYS 92 HZ3 LYS 92 115.500 3.735 14.341 733 H PHE 93 H PHE 93 108.579 1.686 9.803 734 HA PHE 93 HA PHE 93 106.796 4.131 9.871 735 HB2 PHE 93 HB3 PHE 93 106.764 1.635 8.179 736 HB3 PHE 93 HB2 PHE 93 105.220 2.416 8.586 737 HD1 PHE 93 HD1 PHE 93 107.511 5.024 8.673 738 HD2 PHE 93 HD2 PHE 93 105.587 2.416 5.850 739 HE1 PHE 93 HE1 PHE 93 107.880 6.692 6.877 740 HE2 PHE 93 HE2 PHE 93 105.956 4.088 4.057 741 HZ PHE 93 HZ PHE 93 107.101 6.226 4.571 742 H LYS 94 H LYS 94 105.380 4.198 11.483 743 HA LYS 94 HA LYS 94 104.843 1.627 12.983 744 HB2 LYS 94 HB3 LYS 94 105.107 4.512 13.853 745 HB3 LYS 94 HB2 LYS 94 104.138 3.374 14.819 746 HG2 LYS 94 HG2 LYS 94 106.030 1.915 15.149 747 HG3 LYS 94 HG3 LYS 94 107.001 2.804 13.951 748 HD2 LYS 94 HD2 LYS 94 106.851 4.841 15.411 749 HD3 LYS 94 HD3 LYS 94 106.001 3.864 16.631 750 HE2 LYS 94 HE3 LYS 94 108.263 3.787 17.333 751 HE3 LYS 94 HE2 LYS 94 108.044 2.254 16.454 752 HZ1 LYS 94 HZ1 LYS 94 110.046 3.397 15.766 753 HZ2 LYS 94 HZ2 LYS 94 109.185 4.731 15.323 754 HZ3 LYS 94 HZ3 LYS 94 108.982 3.311 14.509 755 H ARG 95 H ARG 95 102.817 0.854 12.697 756 HA ARG 95 HA ARG 95 100.784 2.072 11.174 757 HB2 ARG 95 HB3 ARG 95 100.740 0.056 13.425 758 HB3 ARG 95 HB2 ARG 95 99.204 0.670 12.770 759 HG2 ARG 95 HG2 ARG 95 100.122 0.083 10.444 760 HG3 ARG 95 HG3 ARG 95 101.417 -0.802 11.287 761 HD2 ARG 95 HD2 ARG 95 99.707 -2.423 10.840 762 HD3 ARG 95 HD3 ARG 95 99.550 -2.022 12.567 763 HE ARG 95 HE ARG 95 97.832 -0.229 11.170 764 HH11 ARG 95 HH11 ARG 95 95.637 -0.733 10.965 765 HH12 ARG 95 HH12 ARG 95 95.103 -2.392 11.117 766 HH21 ARG 95 HH21 ARG 95 98.305 -3.642 11.675 767 HH22 ARG 95 HH22 ARG 95 96.607 -4.031 11.517 768 H THR 96 H THR 96 99.857 4.025 11.456 769 HA THR 96 HA THR 96 99.770 5.270 14.142 770 HB THR 96 HB THR 96 98.166 6.783 12.411 771 HG1 THR 96 HG1 THR 96 99.396 6.772 10.474 772 HG21 THR 96 HG21 THR 96 100.160 8.242 12.274 773 HG22 THR 96 HG22 THR 96 99.944 7.609 13.923 774 HG23 THR 96 HG23 THR 96 101.180 6.904 12.855 775 H ASP 97 H ASP 97 97.931 3.135 12.393 776 HA ASP 97 HA ASP 97 95.314 3.969 13.574 777 HB2 ASP 97 HB2 ASP 97 95.641 3.075 11.171 778 HB3 ASP 97 HB3 ASP 97 95.869 1.478 11.924 779 H ASN 98 H ASN 98 97.898 1.624 14.051 780 HA ASN 98 HA ASN 98 96.320 0.569 16.403 781 HB2 ASN 98 HB3 ASN 98 96.473 -1.015 14.345 782 HB3 ASN 98 HB2 ASN 98 98.194 -1.174 14.771 783 HD21 ASN 98 HD21 ASN 98 96.214 -3.349 14.928 784 HD22 ASN 98 HD22 ASN 98 96.108 -3.800 16.615 785 H GLY 99 H GLY 99 98.905 2.336 15.474 786 HA2 GLY 99 HA2 GLY 99 101.012 2.787 16.458 787 HA3 GLY 99 HA3 GLY 99 100.211 2.333 17.981 788 H ASN 100 H ASN 100 100.985 0.356 15.085 789 HA ASN 100 HA ASN 100 102.174 -1.681 16.902 790 HB2 ASN 100 HB2 ASN 100 100.633 -2.213 14.920 791 HB3 ASN 100 HB3 ASN 100 101.987 -1.750 13.863 792 HD21 ASN 100 HD21 ASN 100 100.558 -4.461 15.012 793 HD22 ASN 100 HD22 ASN 100 101.958 -5.490 15.213 794 H GLU 101 H GLU 101 103.656 -2.054 14.059 795 HA GLU 101 HA GLU 101 105.758 -0.066 14.111 796 HB2 GLU 101 HB3 GLU 101 107.452 -1.050 15.363 797 HB3 GLU 101 HB2 GLU 101 106.030 -1.549 16.308 798 HG2 GLU 101 HG2 GLU 101 105.994 -3.667 14.839 799 HG3 GLU 101 HG3 GLU 101 107.621 -3.186 14.301 800 H LEU 102 H LEU 102 106.969 -0.245 12.258 801 HA LEU 102 HA LEU 102 107.017 -2.904 10.858 802 HB2 LEU 102 HB3 LEU 102 105.088 -1.541 9.950 803 HB3 LEU 102 HB2 LEU 102 106.262 -0.294 9.468 804 HG LEU 102 HG LEU 102 106.704 -3.161 8.622 805 HD11 LEU 102 HD11 LEU 102 104.355 -2.643 8.016 806 HD12 LEU 102 HD12 LEU 102 105.388 -2.740 6.570 807 HD13 LEU 102 HD13 LEU 102 104.895 -1.153 7.206 808 HD21 LEU 102 HD21 LEU 102 107.345 -1.448 6.536 809 HD22 LEU 102 HD22 LEU 102 107.718 -0.458 7.967 810 HD23 LEU 102 HD23 LEU 102 108.494 -2.046 7.757 811 H ASN 103 H ASN 103 109.132 -3.308 10.456 812 HA ASN 103 HA ASN 103 110.930 -0.904 10.062 813 HB2 ASN 103 HB3 ASN 103 111.543 -3.731 11.030 814 HB3 ASN 103 HB2 ASN 103 112.782 -2.499 10.692 815 HD21 ASN 103 HD21 ASN 103 110.985 -0.268 11.677 816 HD22 ASN 103 HD22 ASN 103 111.001 -0.420 13.420 817 H THR 104 H THR 104 111.310 -0.568 7.926 818 HA THR 104 HA THR 104 111.606 -3.048 6.218 819 HB THR 104 HB THR 104 109.553 -1.945 5.607 820 HG1 THR 104 HG1 THR 104 110.285 -2.292 3.649 821 HG21 THR 104 HG21 THR 104 109.923 0.579 4.791 822 HG22 THR 104 HG22 THR 104 109.576 0.201 6.496 823 HG23 THR 104 HG23 THR 104 111.250 0.513 5.976 824 H VAL 105 H VAL 105 112.705 -2.451 4.074 825 HA VAL 105 HA VAL 105 114.868 -0.401 4.435 826 HB VAL 105 HB VAL 105 115.409 -3.302 3.659 827 HG11 VAL 105 HG11 VAL 105 116.926 -1.627 2.640 828 HG12 VAL 105 HG12 VAL 105 117.251 -0.942 4.251 829 HG13 VAL 105 HG13 VAL 105 117.777 -2.599 3.866 830 HG21 VAL 105 HG21 VAL 105 114.811 -3.094 6.057 831 HG22 VAL 105 HG22 VAL 105 116.542 -3.455 5.859 832 HG23 VAL 105 HG23 VAL 105 116.017 -1.798 6.245 833 H ARG 106 H ARG 106 115.706 0.333 2.387 834 HA ARG 106 HA ARG 106 114.167 -0.748 0.013 835 HB2 ARG 106 HB2 ARG 106 113.181 1.381 0.512 836 HB3 ARG 106 HB3 ARG 106 114.771 2.131 0.789 837 HG2 ARG 106 HG3 ARG 106 115.313 2.113 -1.516 838 HG3 ARG 106 HG2 ARG 106 114.069 0.897 -1.891 839 HD2 ARG 106 HD2 ARG 106 113.536 3.332 -2.552 840 HD3 ARG 106 HD3 ARG 106 112.295 2.474 -1.607 841 HE ARG 106 HE ARG 106 114.186 3.952 0.098 842 HH11 ARG 106 HH11 ARG 106 113.311 5.748 1.153 843 HH12 ARG 106 HH12 ARG 106 111.779 6.411 0.628 844 HH21 ARG 106 HH21 ARG 106 111.352 4.077 -1.921 845 HH22 ARG 106 HH22 ARG 106 110.674 5.468 -1.105 846 H GLU 107 H GLU 107 115.397 -1.277 -1.717 847 HA GLU 107 HA GLU 107 118.186 -0.130 -1.867 848 HB2 GLU 107 HB2 GLU 107 117.329 -3.027 -1.818 849 HB3 GLU 107 HB3 GLU 107 118.748 -2.552 -2.783 850 HG2 GLU 107 HG3 GLU 107 119.702 -1.438 -0.746 851 HG3 GLU 107 HG2 GLU 107 118.323 -2.053 0.196 852 H ILE 108 H ILE 108 119.062 -0.212 -4.094 853 HA ILE 108 HA ILE 108 116.876 -0.561 -6.147 854 HB ILE 108 HB ILE 108 119.051 1.544 -6.330 855 HG12 ILE 108 HG12 ILE 108 116.564 1.504 -4.666 856 HG13 ILE 108 HG13 ILE 108 118.067 2.430 -4.441 857 HG21 ILE 108 HG21 ILE 108 117.627 0.723 -8.302 858 HG22 ILE 108 HG22 ILE 108 116.239 1.466 -7.472 859 HG23 ILE 108 HG23 ILE 108 117.609 2.476 -7.991 860 HD11 ILE 108 HD11 ILE 108 116.404 4.053 -5.001 861 HD12 ILE 108 HD12 ILE 108 117.338 3.805 -6.496 862 HD13 ILE 108 HD13 ILE 108 115.743 3.038 -6.305 863 H ILE 109 H ILE 109 117.823 -2.676 -6.471 864 HA ILE 109 HA ILE 109 120.619 -3.034 -7.118 865 HB ILE 109 HB ILE 109 118.201 -4.654 -8.035 866 HG12 ILE 109 HG12 ILE 109 120.060 -4.969 -5.634 867 HG13 ILE 109 HG13 ILE 109 118.366 -4.426 -5.568 868 HG21 ILE 109 HG21 ILE 109 120.657 -4.852 -9.100 869 HG22 ILE 109 HG22 ILE 109 119.673 -6.294 -8.754 870 HG23 ILE 109 HG23 ILE 109 120.950 -5.795 -7.619 871 HD11 ILE 109 HD11 ILE 109 118.051 -6.687 -5.162 872 HD12 ILE 109 HD12 ILE 109 119.483 -7.165 -6.104 873 HD13 ILE 109 HD13 ILE 109 117.981 -6.703 -6.940 874 H GLY 110 H GLY 110 121.252 -1.414 -8.568 875 HA2 GLY 110 HA3 GLY 110 121.558 -0.450 -10.703 876 HA3 GLY 110 HA2 GLY 110 121.119 -2.050 -11.343 877 H ASP 111 H ASP 111 118.741 -2.509 -11.556 878 HA ASP 111 HA ASP 111 117.176 0.051 -11.926 879 HB2 ASP 111 HB2 ASP 111 116.844 -2.266 -13.832 880 HB3 ASP 111 HB3 ASP 111 116.499 -0.538 -14.085 881 H GLU 112 H GLU 112 117.173 -2.025 -9.774 882 HA GLU 112 HA GLU 112 114.245 -2.708 -10.028 883 HB2 GLU 112 HB3 GLU 112 116.043 -4.623 -8.572 884 HB3 GLU 112 HB2 GLU 112 114.537 -4.936 -9.468 885 HG2 GLU 112 HG3 GLU 112 115.891 -4.274 -11.584 886 HG3 GLU 112 HG2 GLU 112 117.333 -4.488 -10.562 887 H LEU 113 H LEU 113 113.084 -2.202 -8.187 888 HA LEU 113 HA LEU 113 114.724 -1.108 -5.904 889 HB2 LEU 113 HB3 LEU 113 112.804 0.207 -7.065 890 HB3 LEU 113 HB2 LEU 113 111.714 -0.891 -6.185 891 HG LEU 113 HG LEU 113 113.219 -0.230 -4.107 892 HD11 LEU 113 HD11 LEU 113 114.862 1.058 -5.445 893 HD12 LEU 113 HD12 LEU 113 114.030 2.106 -4.271 894 HD13 LEU 113 HD13 LEU 113 113.564 2.148 -5.988 895 HD21 LEU 113 HD21 LEU 113 111.695 1.786 -3.761 896 HD22 LEU 113 HD22 LEU 113 111.103 1.525 -5.419 897 HD23 LEU 113 HD23 LEU 113 110.859 0.271 -4.180 898 H VAL 114 H VAL 114 115.125 -2.574 -4.329 899 HA VAL 114 HA VAL 114 113.027 -4.677 -3.840 900 HB VAL 114 HB VAL 114 115.811 -4.475 -2.617 901 HG11 VAL 114 HG11 VAL 114 114.191 -5.965 -1.474 902 HG12 VAL 114 HG12 VAL 114 115.474 -6.907 -2.272 903 HG13 VAL 114 HG13 VAL 114 113.862 -6.789 -3.017 904 HG21 VAL 114 HG21 VAL 114 116.511 -6.070 -4.384 905 HG22 VAL 114 HG22 VAL 114 115.968 -4.529 -5.091 906 HG23 VAL 114 HG23 VAL 114 114.898 -5.951 -5.129 907 H GLN 115 H GLN 115 111.492 -3.905 -2.453 908 HA GLN 115 HA GLN 115 112.490 -2.329 -0.069 909 HB2 GLN 115 HB2 GLN 115 110.835 -1.187 -1.594 910 HB3 GLN 115 HB3 GLN 115 109.663 -2.470 -1.209 911 HG2 GLN 115 HG3 GLN 115 109.825 -1.890 1.198 912 HG3 GLN 115 HG2 GLN 115 110.989 -0.602 0.807 913 HE21 GLN 115 HE21 GLN 115 108.116 -1.454 -1.176 914 HE22 GLN 115 HE22 GLN 115 107.289 0.064 -0.911 915 H THR 116 H THR 116 112.833 -3.840 1.525 916 HA THR 116 HA THR 116 110.738 -5.981 1.841 917 HB THR 116 HB THR 116 113.198 -5.935 3.547 918 HG1 THR 116 HG1 THR 116 114.125 -5.425 1.585 919 HG21 THR 116 HG21 THR 116 113.088 -8.377 3.033 920 HG22 THR 116 HG22 THR 116 111.702 -8.068 1.960 921 HG23 THR 116 HG23 THR 116 111.560 -7.763 3.708 922 H TYR 117 H TYR 117 109.599 -6.202 3.764 923 HA TYR 117 HA TYR 117 110.095 -4.037 5.814 924 HB2 TYR 117 HB2 TYR 117 107.290 -5.005 5.489 925 HB3 TYR 117 HB3 TYR 117 107.899 -3.381 5.889 926 HD1 TYR 117 HD1 TYR 117 108.042 -5.832 3.077 927 HD2 TYR 117 HD2 TYR 117 107.626 -1.737 4.268 928 HE1 TYR 117 HE1 TYR 117 107.733 -5.181 0.705 929 HE2 TYR 117 HE2 TYR 117 107.320 -1.071 1.898 930 HH TYR 117 HH TYR 117 106.933 -3.445 -0.658 931 H VAL 118 H VAL 118 109.831 -4.622 7.912 932 HA VAL 118 HA VAL 118 109.384 -7.574 8.394 933 HB VAL 118 HB VAL 118 110.679 -5.603 10.307 934 HG11 VAL 118 HG11 VAL 118 111.181 -7.454 11.600 935 HG12 VAL 118 HG12 VAL 118 111.269 -8.545 10.197 936 HG13 VAL 118 HG13 VAL 118 109.685 -8.041 10.835 937 HG21 VAL 118 HG21 VAL 118 112.866 -6.469 9.532 938 HG22 VAL 118 HG22 VAL 118 112.000 -5.638 8.218 939 HG23 VAL 118 HG23 VAL 118 112.042 -7.416 8.270 940 H TYR 119 H TYR 119 107.989 -8.161 10.047 941 HA TYR 119 HA TYR 119 106.588 -5.941 11.458 942 HB2 TYR 119 HB2 TYR 119 105.523 -6.694 9.113 943 HB3 TYR 119 HB3 TYR 119 104.801 -7.947 10.152 944 HD1 TYR 119 HD1 TYR 119 103.428 -7.321 12.084 945 HD2 TYR 119 HD2 TYR 119 104.875 -4.370 9.329 946 HE1 TYR 119 HE1 TYR 119 101.754 -5.707 12.941 947 HE2 TYR 119 HE2 TYR 119 103.215 -2.742 10.194 948 HH TYR 119 HH TYR 119 100.560 -3.549 11.926 949 H GLU 120 H GLU 120 106.698 -6.513 13.477 950 HA GLU 120 HA GLU 120 106.646 -7.809 15.433 951 HB2 GLU 120 HB2 GLU 120 104.471 -8.988 13.708 952 HB3 GLU 120 HB3 GLU 120 104.865 -9.749 15.268 953 HG2 GLU 120 HG2 GLU 120 104.472 -6.757 15.129 954 HG3 GLU 120 HG3 GLU 120 103.050 -7.828 15.164 955 H GLY 121 H GLY 121 108.282 -8.743 12.932 956 HA2 GLY 121 HA3 GLY 121 110.136 -10.364 13.366 957 HA3 GLY 121 HA2 GLY 121 108.949 -11.426 14.165 958 H VAL 122 H VAL 122 108.156 -9.645 11.259 959 HA VAL 122 HA VAL 122 108.306 -12.243 9.728 960 HB VAL 122 HB VAL 122 105.970 -11.041 10.368 961 HG11 VAL 122 HG11 VAL 122 105.203 -9.538 8.679 962 HG12 VAL 122 HG12 VAL 122 106.812 -8.938 9.148 963 HG13 VAL 122 HG13 VAL 122 106.612 -9.865 7.641 964 HG21 VAL 122 HG21 VAL 122 105.021 -12.149 8.366 965 HG22 VAL 122 HG22 VAL 122 106.253 -13.168 9.149 966 HG23 VAL 122 HG23 VAL 122 106.653 -12.271 7.665 967 H GLU 123 H GLU 123 108.183 -11.591 7.254 968 HA GLU 123 HA GLU 123 109.565 -9.010 6.769 969 HB2 GLU 123 HB3 GLU 123 110.969 -11.674 6.690 970 HB3 GLU 123 HB2 GLU 123 111.408 -10.437 5.488 971 HG2 GLU 123 HG3 GLU 123 111.647 -8.809 7.463 972 HG3 GLU 123 HG2 GLU 123 111.553 -10.238 8.520 973 H ALA 124 H ALA 124 108.375 -8.288 5.086 974 HA ALA 124 HA ALA 124 107.663 -10.277 2.927 975 HB1 ALA 124 HB1 ALA 124 106.447 -7.732 2.444 976 HB2 ALA 124 HB2 ALA 124 106.228 -8.098 4.172 977 HB3 ALA 124 HB3 ALA 124 105.652 -9.246 2.939 978 H LYS 125 H LYS 125 108.091 -9.644 0.681 979 HA LYS 125 HA LYS 125 110.129 -7.421 0.496 980 HB2 LYS 125 HB3 LYS 125 111.039 -9.876 0.507 981 HB3 LYS 125 HB2 LYS 125 110.382 -9.948 -1.146 982 HG2 LYS 125 HG2 LYS 125 111.785 -8.162 -1.892 983 HG3 LYS 125 HG3 LYS 125 112.202 -7.690 -0.228 984 HD2 LYS 125 HD3 LYS 125 114.112 -8.887 -0.939 985 HD3 LYS 125 HD2 LYS 125 113.185 -10.107 -0.035 986 HE2 LYS 125 HE2 LYS 125 112.111 -10.351 -2.567 987 HE3 LYS 125 HE3 LYS 125 113.809 -9.962 -2.930 988 HZ1 LYS 125 HZ1 LYS 125 114.487 -11.898 -2.079 989 HZ2 LYS 125 HZ2 LYS 125 113.410 -11.888 -0.830 990 HZ3 LYS 125 HZ3 LYS 125 112.934 -12.398 -2.324 991 H ARG 126 H ARG 126 109.955 -6.118 -1.252 992 HA ARG 126 HA ARG 126 108.032 -6.952 -3.432 993 HB2 ARG 126 HB3 ARG 126 107.806 -4.721 -1.541 994 HB3 ARG 126 HB2 ARG 126 107.858 -4.144 -3.224 995 HG2 ARG 126 HG2 ARG 126 105.987 -5.533 -3.845 996 HG3 ARG 126 HG3 ARG 126 106.043 -6.409 -2.297 997 HD2 ARG 126 HD2 ARG 126 105.198 -4.569 -1.084 998 HD3 ARG 126 HD3 ARG 126 105.640 -3.406 -2.357 999 HE ARG 126 HE ARG 126 103.725 -5.264 -3.449 1000 HH11 ARG 126 HH11 ARG 126 101.574 -4.586 -3.606 1001 HH12 ARG 126 HH12 ARG 126 101.006 -3.247 -2.633 1002 HH21 ARG 126 HH21 ARG 126 104.087 -2.723 -1.097 1003 HH22 ARG 126 HH22 ARG 126 102.423 -2.198 -1.219 1004 H ILE 127 H ILE 127 109.270 -7.068 -5.257 1005 HA ILE 127 HA ILE 127 111.605 -5.157 -5.442 1006 HB ILE 127 HB ILE 127 111.104 -7.678 -7.072 1007 HG12 ILE 127 HG13 ILE 127 113.195 -7.677 -4.954 1008 HG13 ILE 127 HG12 ILE 127 111.518 -7.676 -4.358 1009 HG21 ILE 127 HG21 ILE 127 113.534 -7.488 -7.523 1010 HG22 ILE 127 HG22 ILE 127 113.597 -6.001 -6.547 1011 HG23 ILE 127 HG23 ILE 127 112.663 -6.032 -8.062 1012 HD11 ILE 127 HD11 ILE 127 112.344 -9.992 -4.688 1013 HD12 ILE 127 HD12 ILE 127 112.682 -9.627 -6.397 1014 HD13 ILE 127 HD13 ILE 127 111.004 -9.626 -5.802 1015 H PHE 128 H PHE 128 111.406 -3.491 -6.828 1016 HA PHE 128 HA PHE 128 109.281 -3.677 -8.958 1017 HB2 PHE 128 HB2 PHE 128 110.947 -1.251 -8.154 1018 HB3 PHE 128 HB3 PHE 128 109.486 -1.262 -9.164 1019 HD1 PHE 128 HD1 PHE 128 108.374 -3.567 -7.127 1020 HD2 PHE 128 HD2 PHE 128 109.711 0.489 -6.774 1021 HE1 PHE 128 HE1 PHE 128 106.950 -3.280 -5.121 1022 HE2 PHE 128 HE2 PHE 128 108.296 0.782 -4.757 1023 HZ PHE 128 HZ PHE 128 106.908 -1.102 -3.933 1024 H LYS 129 H LYS 129 109.994 -2.361 -11.022 1025 HA LYS 129 HA LYS 129 112.857 -2.574 -11.714 1026 HB2 LYS 129 HB3 LYS 129 111.968 -4.954 -11.939 1027 HB3 LYS 129 HB2 LYS 129 110.890 -4.349 -13.220 1028 HG2 LYS 129 HG2 LYS 129 113.223 -3.301 -14.101 1029 HG3 LYS 129 HG3 LYS 129 113.864 -4.718 -13.235 1030 HD2 LYS 129 HD3 LYS 129 112.376 -6.203 -14.514 1031 HD3 LYS 129 HD2 LYS 129 111.654 -4.800 -15.338 1032 HE2 LYS 129 HE3 LYS 129 114.640 -5.363 -15.433 1033 HE3 LYS 129 HE2 LYS 129 113.508 -6.069 -16.612 1034 HZ1 LYS 129 HZ1 LYS 129 114.419 -3.985 -17.391 1035 HZ2 LYS 129 HZ2 LYS 129 113.841 -3.186 -16.069 1036 HZ3 LYS 129 HZ3 LYS 129 112.793 -3.840 -17.161 1037 H LYS 130 H LYS 130 113.319 -1.379 -13.606 1038 HA LYS 130 HA LYS 130 111.635 0.777 -14.277 1039 HB2 LYS 130 HB2 LYS 130 114.054 -0.406 -15.316 1040 HB3 LYS 130 HB3 LYS 130 112.995 0.013 -16.683 1041 HG2 LYS 130 HG2 LYS 130 112.687 2.301 -15.606 1042 HG3 LYS 130 HG3 LYS 130 113.972 1.852 -14.458 1043 HD2 LYS 130 HD2 LYS 130 115.468 1.375 -16.446 1044 HD3 LYS 130 HD3 LYS 130 114.198 2.052 -17.493 1045 HE2 LYS 130 HE3 LYS 130 115.535 3.936 -17.116 1046 HE3 LYS 130 HE2 LYS 130 114.327 4.099 -15.819 1047 HZ1 LYS 130 HZ1 LYS 130 116.568 4.356 -14.986 1048 HZ2 LYS 130 HZ2 LYS 130 115.871 3.012 -14.332 1049 HZ3 LYS 130 HZ3 LYS 130 116.991 2.859 -15.534 1050 H ASP 131 H ASP 131 109.827 1.043 -15.518 1051 HA ASP 131 HA ASP 131 108.288 -1.243 -16.351 1052 HB2 ASP 131 HB2 ASP 131 107.338 1.027 -15.907 1053 HB3 ASP 131 HB3 ASP 131 108.119 1.621 -17.392 Start of MODEL 13 1 H1 ALA 1 H1 ALA 1 116.757 7.371 -5.688 2 H2 ALA 1 H2 ALA 1 115.625 7.190 -4.502 3 H3 ALA 1 H3 ALA 1 115.230 7.955 -5.909 4 HA ALA 1 HA ALA 1 115.954 5.104 -5.651 5 HB1 ALA 1 HB1 ALA 1 113.663 5.927 -4.772 6 HB2 ALA 1 HB2 ALA 1 113.278 6.285 -6.472 7 HB3 ALA 1 HB3 ALA 1 113.645 4.616 -5.975 8 H PHE 2 H PHE 2 114.212 4.515 -7.923 9 HA PHE 2 HA PHE 2 116.139 4.948 -10.057 10 HB2 PHE 2 HB2 PHE 2 113.282 3.975 -9.934 11 HB3 PHE 2 HB3 PHE 2 114.025 4.323 -11.508 12 HD1 PHE 2 HD1 PHE 2 113.171 1.693 -9.643 13 HD2 PHE 2 HD2 PHE 2 116.761 3.402 -11.270 14 HE1 PHE 2 HE1 PHE 2 114.223 -0.550 -9.666 15 HE2 PHE 2 HE2 PHE 2 117.823 1.164 -11.272 16 HZ PHE 2 HZ PHE 2 116.555 -0.813 -10.476 17 H ASP 3 H ASP 3 114.364 7.187 -8.565 18 HA ASP 3 HA ASP 3 113.228 9.174 -9.281 19 HB2 ASP 3 HB3 ASP 3 115.900 8.959 -10.635 20 HB3 ASP 3 HB2 ASP 3 114.808 10.249 -11.192 21 H SER 4 H SER 4 111.729 7.255 -10.367 22 HA SER 4 HA SER 4 110.798 8.405 -12.866 23 HB2 SER 4 HB2 SER 4 111.745 7.121 -14.499 24 HB3 SER 4 HB3 SER 4 113.034 6.876 -13.296 25 HG SER 4 HG SER 4 112.464 4.834 -13.705 26 H THR 5 H THR 5 109.854 5.823 -13.969 27 HA THR 5 HA THR 5 107.753 5.287 -11.863 28 HB THR 5 HB THR 5 107.734 4.997 -14.896 29 HG1 THR 5 HG1 THR 5 106.046 6.563 -14.622 30 HG21 THR 5 HG21 THR 5 105.391 4.236 -14.621 31 HG22 THR 5 HG22 THR 5 106.525 3.111 -13.835 32 HG23 THR 5 HG23 THR 5 105.590 4.264 -12.852 33 H TRP 6 H TRP 6 107.591 3.287 -10.994 34 HA TRP 6 HA TRP 6 108.779 0.949 -12.459 35 HB2 TRP 6 HB3 TRP 6 109.548 1.808 -9.630 36 HB3 TRP 6 HB2 TRP 6 109.985 0.247 -10.369 37 HD1 TRP 6 HD1 TRP 6 110.362 4.031 -11.128 38 HE1 TRP 6 HE1 TRP 6 112.563 4.410 -12.407 39 HE3 TRP 6 HE3 TRP 6 111.926 -0.808 -11.493 40 HZ2 TRP 6 HZ2 TRP 6 114.736 2.807 -13.421 41 HZ3 TRP 6 HZ3 TRP 6 114.073 -1.357 -12.603 42 HH2 TRP 6 HH2 TRP 6 115.478 0.442 -13.571 43 H LYS 7 H LYS 7 107.954 -1.136 -11.519 44 HA LYS 7 HA LYS 7 105.708 -0.769 -9.569 45 HB2 LYS 7 HB2 LYS 7 104.018 -1.678 -10.990 46 HB3 LYS 7 HB3 LYS 7 104.847 -0.445 -11.970 47 HG2 LYS 7 HG2 LYS 7 106.374 -2.428 -12.742 48 HG3 LYS 7 HG3 LYS 7 105.063 -3.463 -12.127 49 HD2 LYS 7 HD2 LYS 7 103.501 -1.900 -13.541 50 HD3 LYS 7 HD3 LYS 7 104.999 -1.448 -14.387 51 HE2 LYS 7 HE3 LYS 7 104.069 -3.287 -15.621 52 HE3 LYS 7 HE2 LYS 7 105.427 -3.959 -14.686 53 HZ1 LYS 7 HZ1 LYS 7 103.455 -5.322 -14.497 54 HZ2 LYS 7 HZ2 LYS 7 102.585 -4.058 -13.894 55 HZ3 LYS 7 HZ3 LYS 7 103.843 -4.680 -13.028 56 H VAL 8 H VAL 8 104.992 -2.744 -8.614 57 HA VAL 8 HA VAL 8 106.925 -4.598 -7.874 58 HB VAL 8 HB VAL 8 104.107 -5.535 -8.454 59 HG11 VAL 8 HG11 VAL 8 104.452 -6.703 -6.294 60 HG12 VAL 8 HG12 VAL 8 106.063 -5.959 -6.150 61 HG13 VAL 8 HG13 VAL 8 105.732 -7.120 -7.459 62 HG21 VAL 8 HG21 VAL 8 103.841 -4.475 -5.990 63 HG22 VAL 8 HG22 VAL 8 105.046 -3.338 -6.641 64 HG23 VAL 8 HG23 VAL 8 103.481 -3.544 -7.463 65 H ASP 9 H ASP 9 108.305 -5.567 -9.270 66 HA ASP 9 HA ASP 9 107.169 -6.893 -11.718 67 HB2 ASP 9 HB3 ASP 9 109.329 -5.427 -11.690 68 HB3 ASP 9 HB2 ASP 9 110.092 -6.824 -10.893 69 H ARG 10 H ARG 10 108.658 -7.465 -8.586 70 HA ARG 10 HA ARG 10 107.756 -10.302 -8.704 71 HB2 ARG 10 HB2 ARG 10 110.676 -9.620 -8.139 72 HB3 ARG 10 HB3 ARG 10 109.941 -11.241 -8.129 73 HG2 ARG 10 HG2 ARG 10 109.318 -10.878 -10.560 74 HG3 ARG 10 HG3 ARG 10 110.281 -9.382 -10.520 75 HD2 ARG 10 HD2 ARG 10 112.201 -10.883 -9.611 76 HD3 ARG 10 HD3 ARG 10 111.219 -12.250 -10.191 77 HE ARG 10 HE ARG 10 111.730 -11.626 -12.438 78 HH11 ARG 10 HH11 ARG 10 112.845 -10.343 -13.928 79 HH12 ARG 10 HH12 ARG 10 113.574 -8.839 -13.413 80 HH21 ARG 10 HH21 ARG 10 112.537 -9.171 -10.106 81 HH22 ARG 10 HH22 ARG 10 113.401 -8.178 -11.259 82 H SER 11 H SER 11 108.286 -11.349 -6.440 83 HA SER 11 HA SER 11 108.804 -9.558 -4.201 84 HB2 SER 11 HB3 SER 11 106.666 -8.556 -4.651 85 HB3 SER 11 HB2 SER 11 105.903 -10.143 -4.914 86 HG SER 11 HG SER 11 105.509 -10.139 -2.841 87 H GLU 12 H GLU 12 107.885 -10.717 -2.061 88 HA GLU 12 HA GLU 12 107.594 -13.650 -2.417 89 HB2 GLU 12 HB3 GLU 12 109.669 -14.336 -1.735 90 HB3 GLU 12 HB2 GLU 12 110.173 -12.747 -2.354 91 HG2 GLU 12 HG2 GLU 12 109.681 -11.836 0.000 92 HG3 GLU 12 HG3 GLU 12 109.575 -13.534 0.524 93 H ASN 13 H ASN 13 107.248 -14.742 -0.304 94 HA ASN 13 HA ASN 13 106.141 -14.839 1.774 95 HB2 ASN 13 HB3 ASN 13 107.805 -12.331 1.999 96 HB3 ASN 13 HB2 ASN 13 106.624 -12.709 3.276 97 HD21 ASN 13 HD21 ASN 13 108.249 -13.255 4.877 98 HD22 ASN 13 HD22 ASN 13 109.235 -14.692 4.721 99 H TYR 14 H TYR 14 105.738 -11.516 2.392 100 HA TYR 14 HA TYR 14 103.875 -10.082 2.156 101 HB2 TYR 14 HB3 TYR 14 104.043 -11.250 -0.312 102 HB3 TYR 14 HB2 TYR 14 102.434 -11.808 0.203 103 HD1 TYR 14 HD1 TYR 14 104.255 -8.612 0.968 104 HD2 TYR 14 HD2 TYR 14 100.886 -10.469 -0.946 105 HE1 TYR 14 HE1 TYR 14 103.314 -6.376 0.452 106 HE2 TYR 14 HE2 TYR 14 99.944 -8.234 -1.459 107 HH TYR 14 HH TYR 14 100.219 -5.799 -0.345 108 H ASP 15 H ASP 15 102.858 -13.533 1.821 109 HA ASP 15 HA ASP 15 100.376 -13.145 3.239 110 HB2 ASP 15 HB2 ASP 15 100.467 -15.609 3.636 111 HB3 ASP 15 HB3 ASP 15 100.826 -15.188 1.944 112 H LYS 16 H LYS 16 103.644 -14.090 4.357 113 HA LYS 16 HA LYS 16 102.890 -14.343 7.142 114 HB2 LYS 16 HB2 LYS 16 105.593 -13.405 6.092 115 HB3 LYS 16 HB3 LYS 16 105.255 -14.255 7.619 116 HG2 LYS 16 HG3 LYS 16 104.489 -15.533 4.986 117 HG3 LYS 16 HG2 LYS 16 106.174 -15.614 5.551 118 HD2 LYS 16 HD3 LYS 16 103.959 -16.306 7.477 119 HD3 LYS 16 HD2 LYS 16 104.427 -17.498 6.241 120 HE2 LYS 16 HE3 LYS 16 106.545 -16.130 7.915 121 HE3 LYS 16 HE2 LYS 16 105.653 -17.526 8.565 122 HZ1 LYS 16 HZ1 LYS 16 107.655 -18.205 7.419 123 HZ2 LYS 16 HZ2 LYS 16 106.328 -18.777 6.626 124 HZ3 LYS 16 HZ3 LYS 16 107.154 -17.483 6.023 125 H PHE 17 H PHE 17 103.734 -11.619 5.059 126 HA PHE 17 HA PHE 17 103.986 -9.667 7.227 127 HB2 PHE 17 HB2 PHE 17 104.750 -9.544 4.725 128 HB3 PHE 17 HB3 PHE 17 103.071 -9.050 4.403 129 HD1 PHE 17 HD1 PHE 17 105.802 -8.308 6.865 130 HD2 PHE 17 HD2 PHE 17 102.642 -6.762 4.411 131 HE1 PHE 17 HE1 PHE 17 106.368 -6.006 7.592 132 HE2 PHE 17 HE2 PHE 17 103.199 -4.458 5.140 133 HZ PHE 17 HZ PHE 17 105.066 -4.080 6.730 134 H MET 18 H MET 18 101.490 -10.047 4.701 135 HA MET 18 HA MET 18 99.522 -8.432 6.019 136 HB2 MET 18 HB3 MET 18 99.444 -10.596 3.919 137 HB3 MET 18 HB2 MET 18 97.913 -10.023 4.623 138 HG2 MET 18 HG2 MET 18 98.492 -8.724 2.595 139 HG3 MET 18 HG3 MET 18 98.522 -7.688 4.042 140 HE1 MET 18 HE1 MET 18 99.946 -5.831 3.047 141 HE2 MET 18 HE2 MET 18 101.364 -6.105 2.008 142 HE3 MET 18 HE3 MET 18 99.763 -6.694 1.501 143 H GLU 19 H GLU 19 100.563 -11.731 6.606 144 HA GLU 19 HA GLU 19 98.122 -12.428 8.125 145 HB2 GLU 19 HB3 GLU 19 99.416 -14.206 7.042 146 HB3 GLU 19 HB2 GLU 19 100.869 -13.745 7.962 147 HG2 GLU 19 HG2 GLU 19 99.677 -15.715 8.957 148 HG3 GLU 19 HG3 GLU 19 99.764 -14.329 10.071 149 H LYS 20 H LYS 20 101.288 -11.014 8.776 150 HA LYS 20 HA LYS 20 101.146 -11.393 11.675 151 HB2 LYS 20 HB3 LYS 20 103.128 -10.633 9.958 152 HB3 LYS 20 HB2 LYS 20 102.640 -9.046 10.597 153 HG2 LYS 20 HG2 LYS 20 104.243 -9.724 12.171 154 HG3 LYS 20 HG3 LYS 20 102.730 -10.269 12.934 155 HD2 LYS 20 HD3 LYS 20 103.062 -12.536 12.082 156 HD3 LYS 20 HD2 LYS 20 104.497 -12.016 11.166 157 HE2 LYS 20 HE2 LYS 20 104.402 -11.519 14.139 158 HE3 LYS 20 HE3 LYS 20 104.767 -13.158 13.549 159 HZ1 LYS 20 HZ1 LYS 20 106.810 -12.455 13.168 160 HZ2 LYS 20 HZ2 LYS 20 106.440 -10.909 13.606 161 HZ3 LYS 20 HZ3 LYS 20 106.254 -11.389 12.039 162 H MET 21 H MET 21 100.290 -8.737 9.435 163 HA MET 21 HA MET 21 99.451 -6.921 11.550 164 HB2 MET 21 HB3 MET 21 99.136 -7.104 8.575 165 HB3 MET 21 HB2 MET 21 97.957 -6.096 9.446 166 HG2 MET 21 HG2 MET 21 99.910 -4.949 10.588 167 HG3 MET 21 HG3 MET 21 100.995 -5.844 9.496 168 HE1 MET 21 HE1 MET 21 101.125 -3.995 6.379 169 HE2 MET 21 HE2 MET 21 102.038 -4.529 7.811 170 HE3 MET 21 HE3 MET 21 100.997 -5.680 6.939 171 H GLY 22 H GLY 22 98.190 -9.879 10.541 172 HA2 GLY 22 HA3 GLY 22 96.183 -10.954 11.204 173 HA3 GLY 22 HA2 GLY 22 95.793 -9.520 12.184 174 H VAL 23 H VAL 23 96.506 -9.400 8.716 175 HA VAL 23 HA VAL 23 93.977 -7.988 8.226 176 HB VAL 23 HB VAL 23 95.845 -9.209 6.153 177 HG11 VAL 23 HG11 VAL 23 93.676 -8.327 5.337 178 HG12 VAL 23 HG12 VAL 23 95.028 -7.307 4.790 179 HG13 VAL 23 HG13 VAL 23 94.004 -6.775 6.145 180 HG21 VAL 23 HG21 VAL 23 97.058 -7.046 6.222 181 HG22 VAL 23 HG22 VAL 23 96.033 -6.515 7.577 182 HG23 VAL 23 HG23 VAL 23 97.153 -7.883 7.790 183 H ASN 24 H ASN 24 92.041 -8.846 7.624 184 HA ASN 24 HA ASN 24 91.443 -11.604 7.827 185 HB2 ASN 24 HB2 ASN 24 90.113 -9.555 5.996 186 HB3 ASN 24 HB3 ASN 24 89.399 -11.101 6.513 187 HD21 ASN 24 HD21 ASN 24 91.378 -9.700 8.968 188 HD22 ASN 24 HD22 ASN 24 90.089 -8.989 9.914 189 H ILE 25 H ILE 25 90.563 -12.952 5.848 190 HA ILE 25 HA ILE 25 92.881 -13.216 4.003 191 HB ILE 25 HB ILE 25 90.438 -14.835 4.686 192 HG12 ILE 25 HG12 ILE 25 92.850 -14.984 5.693 193 HG13 ILE 25 HG13 ILE 25 92.022 -16.491 5.236 194 HG21 ILE 25 HG21 ILE 25 91.046 -16.375 2.760 195 HG22 ILE 25 HG22 ILE 25 92.058 -15.060 2.117 196 HG23 ILE 25 HG23 ILE 25 90.299 -14.835 2.273 197 HD11 ILE 25 HD11 ILE 25 94.501 -16.118 4.456 198 HD12 ILE 25 HD12 ILE 25 93.776 -15.043 3.237 199 HD13 ILE 25 HD13 ILE 25 93.322 -16.763 3.290 200 H VAL 26 H VAL 26 90.206 -11.349 4.103 201 HA VAL 26 HA VAL 26 89.414 -11.561 1.254 202 HB VAL 26 HB VAL 26 88.708 -9.629 3.501 203 HG11 VAL 26 HG11 VAL 26 88.695 -8.434 1.328 204 HG12 VAL 26 HG12 VAL 26 87.039 -8.681 1.931 205 HG13 VAL 26 HG13 VAL 26 87.675 -9.715 0.630 206 HG21 VAL 26 HG21 VAL 26 86.487 -10.713 3.276 207 HG22 VAL 26 HG22 VAL 26 87.751 -11.914 3.632 208 HG23 VAL 26 HG23 VAL 26 87.124 -11.747 1.975 209 H LYS 27 H LYS 27 90.811 -8.921 3.266 210 HA LYS 27 HA LYS 27 91.579 -7.276 1.052 211 HB2 LYS 27 HB3 LYS 27 92.145 -7.431 3.924 212 HB3 LYS 27 HB2 LYS 27 93.580 -6.917 3.005 213 HG2 LYS 27 HG2 LYS 27 92.308 -4.929 3.579 214 HG3 LYS 27 HG3 LYS 27 92.120 -5.213 1.832 215 HD2 LYS 27 HD2 LYS 27 89.993 -6.574 2.523 216 HD3 LYS 27 HD3 LYS 27 90.128 -5.694 4.064 217 HE2 LYS 27 HE2 LYS 27 89.411 -4.688 1.341 218 HE3 LYS 27 HE3 LYS 27 88.849 -4.146 2.940 219 HZ1 LYS 27 HZ1 LYS 27 90.219 -2.458 2.126 220 HZ2 LYS 27 HZ2 LYS 27 91.386 -3.498 1.599 221 HZ3 LYS 27 HZ3 LYS 27 91.166 -3.254 3.216 222 H ARG 28 H ARG 28 93.237 -9.997 2.645 223 HA ARG 28 HA ARG 28 95.734 -9.709 1.203 224 HB2 ARG 28 HB3 ARG 28 95.691 -11.151 3.133 225 HB3 ARG 28 HB2 ARG 28 94.349 -12.111 2.464 226 HG2 ARG 28 HG2 ARG 28 95.738 -13.352 1.143 227 HG3 ARG 28 HG3 ARG 28 96.725 -11.942 0.694 228 HD2 ARG 28 HD2 ARG 28 97.728 -12.038 3.038 229 HD3 ARG 28 HD3 ARG 28 96.902 -13.602 3.243 230 HE ARG 28 HE ARG 28 98.581 -14.585 1.890 231 HH11 ARG 28 HH11 ARG 28 100.319 -14.491 0.447 232 HH12 ARG 28 HH12 ARG 28 100.786 -12.961 -0.261 233 HH21 ARG 28 HH21 ARG 28 98.298 -11.154 1.373 234 HH22 ARG 28 HH22 ARG 28 99.647 -11.080 0.261 235 H LYS 29 H LYS 29 92.840 -11.770 0.576 236 HA LYS 29 HA LYS 29 93.730 -12.988 -1.818 237 HB2 LYS 29 HB2 LYS 29 91.543 -13.469 -0.725 238 HB3 LYS 29 HB3 LYS 29 90.940 -11.882 -1.258 239 HG2 LYS 29 HG3 LYS 29 91.388 -12.557 -3.633 240 HG3 LYS 29 HG2 LYS 29 91.864 -14.171 -3.052 241 HD2 LYS 29 HD3 LYS 29 89.140 -12.857 -2.637 242 HD3 LYS 29 HD2 LYS 29 89.501 -14.162 -3.793 243 HE2 LYS 29 HE2 LYS 29 89.408 -14.259 -0.772 244 HE3 LYS 29 HE3 LYS 29 88.666 -15.361 -1.956 245 HZ1 LYS 29 HZ1 LYS 29 90.486 -16.519 -1.179 246 HZ2 LYS 29 HZ2 LYS 29 91.470 -15.198 -1.115 247 HZ3 LYS 29 HZ3 LYS 29 91.076 -15.863 -2.572 248 H LEU 30 H LEU 30 92.491 -9.697 -1.289 249 HA LEU 30 HA LEU 30 92.660 -9.113 -4.203 250 HB2 LEU 30 HB3 LEU 30 92.073 -7.285 -1.833 251 HB3 LEU 30 HB2 LEU 30 91.918 -6.842 -3.550 252 HG LEU 30 HG LEU 30 90.494 -9.304 -2.544 253 HD11 LEU 30 HD11 LEU 30 89.938 -7.530 -0.901 254 HD12 LEU 30 HD12 LEU 30 89.499 -6.435 -2.233 255 HD13 LEU 30 HD13 LEU 30 88.539 -7.904 -1.936 256 HD21 LEU 30 HD21 LEU 30 90.538 -8.744 -4.960 257 HD22 LEU 30 HD22 LEU 30 88.889 -8.613 -4.304 258 HD23 LEU 30 HD23 LEU 30 89.848 -7.143 -4.601 259 H ALA 31 H ALA 31 94.679 -9.159 -1.519 260 HA ALA 31 HA ALA 31 96.466 -6.973 -2.440 261 HB1 ALA 31 HB1 ALA 31 97.716 -7.387 -0.480 262 HB2 ALA 31 HB2 ALA 31 96.051 -7.776 0.013 263 HB3 ALA 31 HB3 ALA 31 97.188 -9.085 -0.391 264 H ALA 32 H ALA 32 96.348 -10.536 -2.499 265 HA ALA 32 HA ALA 32 98.932 -11.222 -3.280 266 HB1 ALA 32 HB1 ALA 32 97.934 -12.995 -4.698 267 HB2 ALA 32 HB2 ALA 32 97.059 -12.842 -3.156 268 HB3 ALA 32 HB3 ALA 32 96.366 -12.156 -4.645 269 H HIS 33 H HIS 33 96.474 -9.581 -5.268 270 HA HIS 33 HA HIS 33 98.478 -9.392 -7.504 271 HB2 HIS 33 HB2 HIS 33 95.506 -8.753 -7.305 272 HB3 HIS 33 HB3 HIS 33 96.493 -8.361 -8.733 273 HD2 HIS 33 HD2 HIS 33 97.212 -10.594 -10.322 274 HE1 HIS 33 HE1 HIS 33 95.162 -13.491 -8.033 275 HE2 HIS 33 HE2 HIS 33 96.426 -13.097 -10.216 276 H ASP 34 H ASP 34 98.864 -7.943 -4.991 277 HA ASP 34 HA ASP 34 98.071 -5.142 -5.507 278 HB2 ASP 34 HB2 ASP 34 98.343 -5.966 -3.198 279 HB3 ASP 34 HB3 ASP 34 100.050 -6.352 -3.523 280 H ASN 35 H ASN 35 99.508 -6.328 -7.699 281 HA ASN 35 HA ASN 35 102.315 -5.473 -7.567 282 HB2 ASN 35 HB2 ASN 35 102.258 -5.847 -10.045 283 HB3 ASN 35 HB3 ASN 35 101.630 -7.236 -9.127 284 HD21 ASN 35 HD21 ASN 35 99.923 -8.080 -10.340 285 HD22 ASN 35 HD22 ASN 35 98.636 -7.119 -11.031 286 H LEU 36 H LEU 36 100.704 -3.385 -6.656 287 HA LEU 36 HA LEU 36 99.834 -1.476 -8.561 288 HB2 LEU 36 HB2 LEU 36 100.046 0.170 -6.821 289 HB3 LEU 36 HB3 LEU 36 99.611 -1.363 -6.030 290 HG LEU 36 HG LEU 36 102.507 -0.488 -6.348 291 HD11 LEU 36 HD11 LEU 36 101.281 1.285 -5.122 292 HD12 LEU 36 HD12 LEU 36 100.614 0.059 -4.018 293 HD13 LEU 36 HD13 LEU 36 102.363 0.385 -4.032 294 HD21 LEU 36 HD21 LEU 36 102.512 -1.949 -4.149 295 HD22 LEU 36 HD22 LEU 36 102.447 -2.752 -5.736 296 HD23 LEU 36 HD23 LEU 36 100.961 -2.557 -4.776 297 H LYS 37 H LYS 37 100.883 0.680 -8.953 298 HA LYS 37 HA LYS 37 103.755 0.264 -9.809 299 HB2 LYS 37 HB2 LYS 37 102.037 0.705 -11.615 300 HB3 LYS 37 HB3 LYS 37 101.699 2.273 -10.844 301 HG2 LYS 37 HG2 LYS 37 103.651 3.207 -11.594 302 HG3 LYS 37 HG3 LYS 37 104.577 1.705 -11.359 303 HD2 LYS 37 HD2 LYS 37 104.456 2.154 -13.747 304 HD3 LYS 37 HD3 LYS 37 103.413 0.756 -13.394 305 HE2 LYS 37 HE2 LYS 37 101.924 1.993 -14.658 306 HE3 LYS 37 HE3 LYS 37 101.589 2.714 -13.066 307 HZ1 LYS 37 HZ1 LYS 37 101.995 4.402 -14.723 308 HZ2 LYS 37 HZ2 LYS 37 103.479 3.772 -15.073 309 HZ3 LYS 37 HZ3 LYS 37 103.193 4.436 -13.590 310 H LEU 38 H LEU 38 105.251 1.977 -9.312 311 HA LEU 38 HA LEU 38 104.137 4.115 -7.501 312 HB2 LEU 38 HB3 LEU 38 106.735 2.705 -6.836 313 HB3 LEU 38 HB2 LEU 38 105.696 3.692 -5.780 314 HG LEU 38 HG LEU 38 103.896 1.822 -6.293 315 HD11 LEU 38 HD11 LEU 38 104.733 0.234 -7.704 316 HD12 LEU 38 HD12 LEU 38 105.571 -0.374 -6.257 317 HD13 LEU 38 HD13 LEU 38 106.419 0.709 -7.386 318 HD21 LEU 38 HD21 LEU 38 104.705 0.567 -4.312 319 HD22 LEU 38 HD22 LEU 38 106.299 1.343 -4.474 320 HD23 LEU 38 HD23 LEU 38 104.869 2.323 -4.072 321 H THR 39 H THR 39 104.794 6.061 -8.175 322 HA THR 39 HA THR 39 107.190 6.221 -9.977 323 HB THR 39 HB THR 39 105.593 8.649 -9.222 324 HG1 THR 39 HG1 THR 39 103.922 7.213 -9.529 325 HG21 THR 39 HG21 THR 39 105.896 9.114 -11.638 326 HG22 THR 39 HG22 THR 39 107.452 8.741 -10.858 327 HG23 THR 39 HG23 THR 39 106.637 7.510 -11.853 328 H ILE 40 H ILE 40 109.081 6.383 -8.840 329 HA ILE 40 HA ILE 40 108.992 7.938 -6.258 330 HB ILE 40 HB ILE 40 111.364 6.314 -7.189 331 HG12 ILE 40 HG13 ILE 40 109.979 4.548 -5.613 332 HG13 ILE 40 HG12 ILE 40 108.640 5.329 -6.487 333 HG21 ILE 40 HG21 ILE 40 110.133 7.221 -4.570 334 HG22 ILE 40 HG22 ILE 40 111.782 7.494 -5.180 335 HG23 ILE 40 HG23 ILE 40 111.298 5.876 -4.617 336 HD11 ILE 40 HD11 ILE 40 109.444 4.640 -8.593 337 HD12 ILE 40 HD12 ILE 40 109.800 3.234 -7.561 338 HD13 ILE 40 HD13 ILE 40 111.096 4.379 -7.983 339 H THR 41 H THR 41 109.886 9.898 -6.146 340 HA THR 41 HA THR 41 111.983 10.620 -8.198 341 HB THR 41 HB THR 41 110.113 12.699 -7.070 342 HG1 THR 41 HG1 THR 41 108.636 11.244 -7.848 343 HG21 THR 41 HG21 THR 41 110.541 13.726 -9.284 344 HG22 THR 41 HG22 THR 41 111.484 12.296 -9.765 345 HG23 THR 41 HG23 THR 41 112.065 13.345 -8.449 346 H GLN 42 H GLN 42 113.608 12.102 -7.367 347 HA GLN 42 HA GLN 42 113.433 12.611 -4.408 348 HB2 GLN 42 HB2 GLN 42 115.512 11.589 -3.915 349 HB3 GLN 42 HB3 GLN 42 114.709 10.421 -4.990 350 HG2 GLN 42 HG3 GLN 42 115.928 11.713 -6.913 351 HG3 GLN 42 HG2 GLN 42 116.970 12.339 -5.613 352 HE21 GLN 42 HE21 GLN 42 117.489 10.298 -3.941 353 HE22 GLN 42 HE22 GLN 42 118.134 8.906 -4.782 354 H GLU 43 H GLU 43 114.412 14.522 -3.781 355 HA GLU 43 HA GLU 43 116.118 15.915 -5.837 356 HB2 GLU 43 HB2 GLU 43 113.681 17.101 -4.437 357 HB3 GLU 43 HB3 GLU 43 114.857 18.038 -5.390 358 HG2 GLU 43 HG2 GLU 43 113.217 15.690 -6.446 359 HG3 GLU 43 HG3 GLU 43 112.846 17.407 -6.733 360 H GLY 44 H GLY 44 117.773 15.199 -4.257 361 HA2 GLY 44 HA2 GLY 44 119.240 15.698 -2.483 362 HA3 GLY 44 HA3 GLY 44 118.551 17.337 -2.508 363 H ASN 45 H ASN 45 116.738 17.808 -1.134 364 HA ASN 45 HA ASN 45 116.423 15.784 1.095 365 HB2 ASN 45 HB3 ASN 45 115.807 18.651 1.634 366 HB3 ASN 45 HB2 ASN 45 116.634 17.449 2.654 367 HD21 ASN 45 HD21 ASN 45 117.254 18.963 -0.602 368 HD22 ASN 45 HD22 ASN 45 118.931 19.325 -0.260 369 H LYS 46 H LYS 46 114.801 16.086 -1.399 370 HA LYS 46 HA LYS 46 112.171 16.296 0.001 371 HB2 LYS 46 HB3 LYS 46 112.363 18.517 -0.914 372 HB3 LYS 46 HB2 LYS 46 113.027 17.899 -2.445 373 HG2 LYS 46 HG2 LYS 46 110.457 16.655 -1.856 374 HG3 LYS 46 HG3 LYS 46 110.313 18.429 -1.859 375 HD2 LYS 46 HD2 LYS 46 111.538 18.445 -4.076 376 HD3 LYS 46 HD3 LYS 46 111.437 16.668 -4.081 377 HE2 LYS 46 HE3 LYS 46 109.036 16.713 -4.146 378 HE3 LYS 46 HE2 LYS 46 108.991 18.453 -3.773 379 HZ1 LYS 46 HZ1 LYS 46 108.660 18.037 -6.118 380 HZ2 LYS 46 HZ2 LYS 46 110.065 18.867 -5.883 381 HZ3 LYS 46 HZ3 LYS 46 110.108 17.255 -6.229 382 H PHE 47 H PHE 47 111.459 14.298 -0.337 383 HA PHE 47 HA PHE 47 111.987 13.007 -3.013 384 HB2 PHE 47 HB2 PHE 47 111.401 11.950 -0.236 385 HB3 PHE 47 HB3 PHE 47 111.093 10.939 -1.667 386 HD1 PHE 47 HD1 PHE 47 113.774 13.229 -0.338 387 HD2 PHE 47 HD2 PHE 47 112.831 9.575 -2.391 388 HE1 PHE 47 HE1 PHE 47 116.189 12.680 -0.472 389 HE2 PHE 47 HE2 PHE 47 115.245 9.027 -2.526 390 HZ PHE 47 HZ PHE 47 116.924 10.578 -1.564 391 H THR 48 H THR 48 110.106 11.562 -3.771 392 HA THR 48 HA THR 48 107.435 12.463 -2.842 393 HB THR 48 HB THR 48 108.426 13.050 -5.668 394 HG1 THR 48 HG1 THR 48 109.092 14.597 -4.132 395 HG21 THR 48 HG21 THR 48 106.166 14.014 -5.991 396 HG22 THR 48 HG22 THR 48 105.709 13.492 -4.352 397 HG23 THR 48 HG23 THR 48 106.073 12.279 -5.604 398 H VAL 49 H VAL 49 106.743 10.398 -2.531 399 HA VAL 49 HA VAL 49 107.204 8.396 -4.728 400 HB VAL 49 HB VAL 49 106.013 8.034 -1.942 401 HG11 VAL 49 HG11 VAL 49 106.415 5.628 -2.393 402 HG12 VAL 49 HG12 VAL 49 105.302 6.326 -3.593 403 HG13 VAL 49 HG13 VAL 49 107.004 6.033 -4.023 404 HG21 VAL 49 HG21 VAL 49 108.390 8.743 -1.876 405 HG22 VAL 49 HG22 VAL 49 108.217 7.040 -1.388 406 HG23 VAL 49 HG23 VAL 49 108.809 7.443 -3.017 407 H LYS 50 H LYS 50 105.609 8.096 -6.204 408 HA LYS 50 HA LYS 50 102.810 8.914 -5.383 409 HB2 LYS 50 HB2 LYS 50 104.214 9.969 -7.428 410 HB3 LYS 50 HB3 LYS 50 103.555 8.546 -8.269 411 HG2 LYS 50 HG3 LYS 50 101.274 9.187 -7.659 412 HG3 LYS 50 HG2 LYS 50 101.883 10.539 -6.675 413 HD2 LYS 50 HD2 LYS 50 103.002 11.404 -8.823 414 HD3 LYS 50 HD3 LYS 50 102.011 10.211 -9.696 415 HE2 LYS 50 HE2 LYS 50 99.962 11.224 -8.910 416 HE3 LYS 50 HE3 LYS 50 100.849 12.273 -7.778 417 HZ1 LYS 50 HZ1 LYS 50 100.240 13.446 -9.786 418 HZ2 LYS 50 HZ2 LYS 50 101.059 12.362 -10.721 419 HZ3 LYS 50 HZ3 LYS 50 101.881 13.334 -9.672 420 H GLU 51 H GLU 51 101.948 6.968 -4.638 421 HA GLU 51 HA GLU 51 102.508 4.442 -6.060 422 HB2 GLU 51 HB2 GLU 51 100.397 5.118 -3.961 423 HB3 GLU 51 HB3 GLU 51 100.848 3.480 -4.492 424 HG2 GLU 51 HG2 GLU 51 103.123 3.783 -3.664 425 HG3 GLU 51 HG3 GLU 51 102.791 5.487 -3.267 426 H SER 52 H SER 52 100.835 3.153 -7.148 427 HA SER 52 HA SER 52 98.326 4.511 -7.908 428 HB2 SER 52 HB3 SER 52 100.178 3.787 -10.190 429 HB3 SER 52 HB2 SER 52 98.758 4.862 -10.195 430 HG SER 52 HG SER 52 100.959 5.875 -10.166 431 H SER 53 H SER 53 97.093 2.831 -7.440 432 HA SER 53 HA SER 53 97.682 0.234 -8.858 433 HB2 SER 53 HB2 SER 53 97.947 0.520 -6.144 434 HB3 SER 53 HB3 SER 53 96.224 0.087 -6.263 435 HG SER 53 HG SER 53 96.756 -1.826 -7.177 436 H ALA 54 H ALA 54 95.823 -0.784 -9.703 437 HA ALA 54 HA ALA 54 93.599 0.915 -10.358 438 HB1 ALA 54 HB1 ALA 54 92.479 -1.172 -11.093 439 HB2 ALA 54 HB2 ALA 54 93.703 -2.133 -10.228 440 HB3 ALA 54 HB3 ALA 54 94.177 -1.138 -11.626 441 H PHE 55 H PHE 55 94.419 0.082 -7.341 442 HA PHE 55 HA PHE 55 91.554 -0.381 -6.493 443 HB2 PHE 55 HB2 PHE 55 93.105 -2.209 -5.872 444 HB3 PHE 55 HB3 PHE 55 94.139 -1.040 -5.016 445 HD1 PHE 55 HD1 PHE 55 93.786 -0.731 -2.735 446 HD2 PHE 55 HD2 PHE 55 90.532 -2.105 -5.179 447 HE1 PHE 55 HE1 PHE 55 92.364 -0.949 -0.716 448 HE2 PHE 55 HE2 PHE 55 89.107 -2.322 -3.160 449 HZ PHE 55 HZ PHE 55 90.025 -1.747 -0.928 450 H ARG 56 H ARG 56 94.241 1.861 -6.339 451 HA ARG 56 HA ARG 56 92.818 4.011 -5.286 452 HB2 ARG 56 HB2 ARG 56 93.345 1.991 -3.190 453 HB3 ARG 56 HB3 ARG 56 93.928 3.617 -2.766 454 HG2 ARG 56 HG2 ARG 56 91.797 4.528 -2.752 455 HG3 ARG 56 HG3 ARG 56 91.189 3.395 -3.983 456 HD2 ARG 56 HD3 ARG 56 90.166 2.840 -1.837 457 HD3 ARG 56 HD2 ARG 56 91.320 1.555 -2.267 458 HE ARG 56 HE ARG 56 92.696 2.210 -0.427 459 HH11 ARG 56 HH11 ARG 56 93.040 3.447 1.434 460 HH12 ARG 56 HH12 ARG 56 92.071 4.873 1.729 461 HH21 ARG 56 HH21 ARG 56 90.206 4.521 -1.191 462 HH22 ARG 56 HH22 ARG 56 90.473 5.478 0.249 463 H ASN 57 H ASN 57 94.442 4.887 -6.681 464 HA ASN 57 HA ASN 57 97.276 4.593 -6.197 465 HB2 ASN 57 HB3 ASN 57 97.511 6.602 -7.618 466 HB3 ASN 57 HB2 ASN 57 96.320 5.477 -8.315 467 HD21 ASN 57 HD21 ASN 57 96.145 8.153 -9.098 468 HD22 ASN 57 HD22 ASN 57 94.755 8.899 -8.341 469 H ILE 58 H ILE 58 98.728 5.852 -5.008 470 HA ILE 58 HA ILE 58 97.512 7.991 -3.265 471 HB ILE 58 HB ILE 58 99.582 6.139 -2.118 472 HG12 ILE 58 HG13 ILE 58 96.625 5.541 -2.473 473 HG13 ILE 58 HG12 ILE 58 98.017 4.508 -2.887 474 HG21 ILE 58 HG21 ILE 58 98.520 8.352 -1.115 475 HG22 ILE 58 HG22 ILE 58 98.779 6.934 -0.071 476 HG23 ILE 58 HG23 ILE 58 97.158 7.276 -0.721 477 HD11 ILE 58 HD11 ILE 58 97.348 3.587 -0.842 478 HD12 ILE 58 HD12 ILE 58 98.585 4.754 -0.318 479 HD13 ILE 58 HD13 ILE 58 96.859 5.164 -0.178 480 H GLU 59 H GLU 59 99.368 9.121 -2.037 481 HA GLU 59 HA GLU 59 101.966 9.130 -3.467 482 HB2 GLU 59 HB2 GLU 59 101.835 11.275 -4.425 483 HB3 GLU 59 HB3 GLU 59 100.222 10.605 -4.765 484 HG2 GLU 59 HG2 GLU 59 101.015 12.562 -2.574 485 HG3 GLU 59 HG3 GLU 59 99.849 12.810 -3.895 486 H CYS 60 H CYS 60 103.554 10.464 -2.336 487 HA CYS 60 HA CYS 60 102.730 11.833 0.146 488 HB2 CYS 60 HB2 CYS 60 103.337 9.002 0.217 489 HB3 CYS 60 HB3 CYS 60 104.605 9.894 1.092 490 HG CYS 60 HG CYS 60 101.434 10.946 1.752 491 H VAL 61 H VAL 61 104.016 13.594 -0.160 492 HA VAL 61 HA VAL 61 106.864 13.115 -1.009 493 HB VAL 61 HB VAL 61 105.927 14.693 -2.458 494 HG11 VAL 61 HG11 VAL 61 104.533 16.650 -1.438 495 HG12 VAL 61 HG12 VAL 61 103.769 15.049 -1.579 496 HG13 VAL 61 HG13 VAL 61 104.397 15.600 -0.008 497 HG21 VAL 61 HG21 VAL 61 106.912 16.849 -1.891 498 HG22 VAL 61 HG22 VAL 61 107.993 15.561 -1.308 499 HG23 VAL 61 HG23 VAL 61 106.940 16.425 -0.162 500 H PHE 62 H PHE 62 108.562 14.181 0.155 501 HA PHE 62 HA PHE 62 108.148 15.803 2.480 502 HB2 PHE 62 HB3 PHE 62 107.749 12.891 2.897 503 HB3 PHE 62 HB2 PHE 62 108.871 13.659 4.045 504 HD1 PHE 62 HD1 PHE 62 105.552 12.797 3.647 505 HD2 PHE 62 HD2 PHE 62 107.958 16.196 4.706 506 HE1 PHE 62 HE1 PHE 62 103.629 13.780 4.867 507 HE2 PHE 62 HE2 PHE 62 106.034 17.176 5.926 508 HZ PHE 62 HZ PHE 62 103.871 15.968 6.008 509 H GLU 63 H GLU 63 110.114 15.419 4.124 510 HA GLU 63 HA GLU 63 112.560 14.988 2.389 511 HB2 GLU 63 HB3 GLU 63 112.331 17.343 2.979 512 HB3 GLU 63 HB2 GLU 63 112.062 16.931 4.689 513 HG2 GLU 63 HG3 GLU 63 114.307 16.224 4.991 514 HG3 GLU 63 HG2 GLU 63 114.592 16.091 3.239 515 H LEU 64 H LEU 64 114.545 14.422 3.781 516 HA LEU 64 HA LEU 64 113.772 12.160 5.533 517 HB2 LEU 64 HB2 LEU 64 116.567 13.259 5.028 518 HB3 LEU 64 HB3 LEU 64 116.120 11.617 5.550 519 HG LEU 64 HG LEU 64 115.221 12.816 2.899 520 HD11 LEU 64 HD11 LEU 64 117.699 12.709 2.977 521 HD12 LEU 64 HD12 LEU 64 117.609 11.008 3.493 522 HD13 LEU 64 HD13 LEU 64 117.041 11.478 1.873 523 HD21 LEU 64 HD21 LEU 64 113.900 10.914 3.788 524 HD22 LEU 64 HD22 LEU 64 115.392 9.961 3.966 525 HD23 LEU 64 HD23 LEU 64 114.825 10.431 2.346 526 H GLY 65 H GLY 65 113.949 12.082 7.768 527 HA2 GLY 65 HA2 GLY 65 114.721 12.865 9.923 528 HA3 GLY 65 HA3 GLY 65 115.301 14.363 9.160 529 H VAL 66 H VAL 66 112.090 13.210 8.378 530 HA VAL 66 HA VAL 66 110.888 15.057 10.419 531 HB VAL 66 HB VAL 66 110.334 15.256 7.425 532 HG11 VAL 66 HG11 VAL 66 108.358 15.693 8.857 533 HG12 VAL 66 HG12 VAL 66 108.941 17.193 8.097 534 HG13 VAL 66 HG13 VAL 66 109.306 16.863 9.807 535 HG21 VAL 66 HG21 VAL 66 111.375 17.499 7.638 536 HG22 VAL 66 HG22 VAL 66 111.743 17.164 9.346 537 HG23 VAL 66 HG23 VAL 66 112.530 16.213 8.064 538 H THR 67 H THR 67 109.674 13.497 11.449 539 HA THR 67 HA THR 67 108.528 11.186 10.240 540 HB THR 67 HB THR 67 107.003 12.613 12.403 541 HG1 THR 67 HG1 THR 67 109.073 13.021 13.076 542 HG21 THR 67 HG21 THR 67 106.949 10.318 13.341 543 HG22 THR 67 HG22 THR 67 106.360 10.339 11.662 544 HG23 THR 67 HG23 THR 67 108.002 9.754 12.021 545 H PHE 68 H PHE 68 106.622 10.749 9.266 546 HA PHE 68 HA PHE 68 104.563 12.874 8.987 547 HB2 PHE 68 HB3 PHE 68 104.636 12.200 6.379 548 HB3 PHE 68 HB2 PHE 68 105.560 13.574 7.027 549 HD1 PHE 68 HD1 PHE 68 105.914 9.840 6.630 550 HD2 PHE 68 HD2 PHE 68 107.806 13.695 6.501 551 HE1 PHE 68 HE1 PHE 68 108.032 8.781 5.880 552 HE2 PHE 68 HE2 PHE 68 109.920 12.633 5.762 553 HZ PHE 68 HZ PHE 68 110.030 10.178 5.449 554 H ASN 69 H ASN 69 102.923 11.677 7.131 555 HA ASN 69 HA ASN 69 102.769 8.814 8.051 556 HB2 ASN 69 HB3 ASN 69 100.443 9.015 8.638 557 HB3 ASN 69 HB2 ASN 69 101.298 10.337 9.469 558 HD21 ASN 69 HD21 ASN 69 101.187 12.539 8.418 559 HD22 ASN 69 HD22 ASN 69 99.801 12.918 7.420 560 H CYS 70 H CYS 70 101.631 7.429 6.644 561 HA CYS 70 HA CYS 70 100.473 8.519 4.142 562 HB2 CYS 70 HB2 CYS 70 102.967 6.757 4.065 563 HB3 CYS 70 HB3 CYS 70 102.023 7.298 2.656 564 HG CYS 70 HG CYS 70 104.246 9.064 4.558 565 H ASN 71 H ASN 71 98.950 7.055 3.359 566 HA ASN 71 HA ASN 71 98.634 4.607 5.049 567 HB2 ASN 71 HB3 ASN 71 96.453 4.483 3.557 568 HB3 ASN 71 HB2 ASN 71 96.567 5.674 4.874 569 HD21 ASN 71 HD21 ASN 71 97.499 7.906 4.162 570 HD22 ASN 71 HD22 ASN 71 97.017 8.478 2.580 571 H LEU 72 H LEU 72 98.631 2.517 4.247 572 HA LEU 72 HA LEU 72 99.984 2.218 1.589 573 HB2 LEU 72 HB2 LEU 72 99.362 0.221 3.810 574 HB3 LEU 72 HB3 LEU 72 100.236 -0.172 2.310 575 HG LEU 72 HG LEU 72 101.103 1.985 4.285 576 HD11 LEU 72 HD11 LEU 72 101.235 -0.276 5.296 577 HD12 LEU 72 HD12 LEU 72 102.859 0.369 4.956 578 HD13 LEU 72 HD13 LEU 72 102.144 -0.856 3.879 579 HD21 LEU 72 HD21 LEU 72 101.856 2.310 1.942 580 HD22 LEU 72 HD22 LEU 72 102.506 0.653 1.922 581 HD23 LEU 72 HD23 LEU 72 103.222 1.877 2.999 582 H ALA 73 H ALA 73 99.099 0.980 -0.104 583 HA ALA 73 HA ALA 73 96.404 1.214 -0.737 584 HB1 ALA 73 HB1 ALA 73 96.680 -0.749 -2.227 585 HB2 ALA 73 HB2 ALA 73 98.162 -1.203 -1.353 586 HB3 ALA 73 HB3 ALA 73 98.109 0.310 -2.289 587 H ASP 74 H ASP 74 97.858 -1.240 1.387 588 HA ASP 74 HA ASP 74 95.536 -2.950 1.561 589 HB2 ASP 74 HB3 ASP 74 97.946 -3.333 2.455 590 HB3 ASP 74 HB2 ASP 74 97.417 -2.409 3.881 591 H GLY 75 H GLY 75 95.407 0.207 2.000 592 HA2 GLY 75 HA2 GLY 75 93.843 1.570 3.139 593 HA3 GLY 75 HA3 GLY 75 93.050 0.083 3.714 594 H THR 76 H THR 76 96.475 0.639 4.282 595 HA THR 76 HA THR 76 95.840 0.793 7.217 596 HB THR 76 HB THR 76 98.670 0.594 6.371 597 HG1 THR 76 HG1 THR 76 97.779 -0.666 4.736 598 HG21 THR 76 HG21 THR 76 98.639 -1.207 8.072 599 HG22 THR 76 HG22 THR 76 96.867 -1.078 8.176 600 HG23 THR 76 HG23 THR 76 97.891 0.281 8.699 601 H GLU 77 H GLU 77 97.193 2.257 8.528 602 HA GLU 77 HA GLU 77 98.114 4.686 6.988 603 HB2 GLU 77 HB2 GLU 77 95.793 4.964 8.031 604 HB3 GLU 77 HB3 GLU 77 96.581 4.793 9.618 605 HG2 GLU 77 HG2 GLU 77 97.992 6.731 9.187 606 HG3 GLU 77 HG3 GLU 77 97.390 6.848 7.516 607 H LEU 78 H LEU 78 100.258 4.998 7.482 608 HA LEU 78 HA LEU 78 101.076 4.372 10.327 609 HB2 LEU 78 HB2 LEU 78 102.941 3.795 8.021 610 HB3 LEU 78 HB3 LEU 78 102.944 3.119 9.667 611 HG LEU 78 HG LEU 78 100.521 2.237 8.869 612 HD11 LEU 78 HD11 LEU 78 100.807 3.342 6.618 613 HD12 LEU 78 HD12 LEU 78 102.189 2.263 6.315 614 HD13 LEU 78 HD13 LEU 78 100.557 1.583 6.518 615 HD21 LEU 78 HD21 LEU 78 102.403 0.859 9.711 616 HD22 LEU 78 HD22 LEU 78 103.189 0.960 8.118 617 HD23 LEU 78 HD23 LEU 78 101.640 0.101 8.293 618 H ARG 79 H ARG 79 103.141 5.417 10.955 619 HA ARG 79 HA ARG 79 103.888 7.774 9.246 620 HB2 ARG 79 HB2 ARG 79 103.720 9.303 11.188 621 HB3 ARG 79 HB3 ARG 79 102.136 8.591 10.798 622 HG2 ARG 79 HG3 ARG 79 102.609 6.812 12.548 623 HG3 ARG 79 HG2 ARG 79 104.046 7.750 13.019 624 HD2 ARG 79 HD2 ARG 79 101.321 9.067 12.864 625 HD3 ARG 79 HD3 ARG 79 101.811 8.162 14.316 626 HE ARG 79 HE ARG 79 103.779 10.186 13.383 627 HH11 ARG 79 HH11 ARG 79 104.136 11.852 14.869 628 HH12 ARG 79 HH12 ARG 79 103.061 12.050 16.235 629 HH21 ARG 79 HH21 ARG 79 101.040 9.352 15.364 630 HH22 ARG 79 HH22 ARG 79 101.316 10.641 16.514 631 H GLY 80 H GLY 80 106.046 8.399 9.500 632 HA2 GLY 80 HA2 GLY 80 107.727 7.842 11.716 633 HA3 GLY 80 HA3 GLY 80 107.839 6.428 10.636 634 H THR 81 H THR 81 109.448 6.588 9.140 635 HA THR 81 HA THR 81 109.732 8.769 7.331 636 HB THR 81 HB THR 81 112.119 9.298 8.816 637 HG1 THR 81 HG1 THR 81 111.370 9.798 10.808 638 HG21 THR 81 HG21 THR 81 111.051 11.596 8.969 639 HG22 THR 81 HG22 THR 81 109.582 10.886 8.258 640 HG23 THR 81 HG23 THR 81 111.100 10.907 7.328 641 H TRP 82 H TRP 82 111.643 8.622 5.993 642 HA TRP 82 HA TRP 82 112.910 5.894 6.209 643 HB2 TRP 82 HB2 TRP 82 113.126 7.784 3.842 644 HB3 TRP 82 HB3 TRP 82 113.340 6.018 3.873 645 HD1 TRP 82 HD1 TRP 82 110.610 8.704 4.158 646 HE1 TRP 82 HE1 TRP 82 108.331 7.673 3.545 647 HE3 TRP 82 HE3 TRP 82 112.054 3.843 3.623 648 HZ2 TRP 82 HZ2 TRP 82 107.291 5.055 2.885 649 HZ3 TRP 82 HZ3 TRP 82 110.410 2.101 2.994 650 HH2 TRP 82 HH2 TRP 82 108.031 2.698 2.627 651 H SER 83 H SER 83 115.151 5.674 6.312 652 HA SER 83 HA SER 83 116.757 8.224 6.296 653 HB2 SER 83 HB2 SER 83 116.694 8.081 8.596 654 HB3 SER 83 HB3 SER 83 116.308 6.343 8.580 655 HG SER 83 HG SER 83 118.460 6.735 9.313 656 H LEU 84 H LEU 84 119.090 7.773 5.913 657 HA LEU 84 HA LEU 84 119.332 5.205 4.385 658 HB2 LEU 84 HB2 LEU 84 120.271 6.692 2.939 659 HB3 LEU 84 HB3 LEU 84 120.515 7.911 4.211 660 HG LEU 84 HG LEU 84 122.465 6.540 5.043 661 HD11 LEU 84 HD11 LEU 84 122.860 5.144 2.504 662 HD12 LEU 84 HD12 LEU 84 121.366 4.609 3.311 663 HD13 LEU 84 HD13 LEU 84 122.925 4.507 4.165 664 HD21 LEU 84 HD21 LEU 84 123.985 7.243 3.215 665 HD22 LEU 84 HD22 LEU 84 122.586 7.464 2.137 666 HD23 LEU 84 HD23 LEU 84 122.782 8.505 3.568 667 H GLU 85 H GLU 85 120.395 3.522 5.267 668 HA GLU 85 HA GLU 85 122.292 4.108 7.552 669 HB2 GLU 85 HB2 GLU 85 120.065 2.106 7.269 670 HB3 GLU 85 HB3 GLU 85 121.535 1.594 8.131 671 HG2 GLU 85 HG2 GLU 85 120.108 4.203 8.766 672 HG3 GLU 85 HG3 GLU 85 119.679 2.669 9.561 673 H GLY 86 H GLY 86 124.307 3.737 6.751 674 HA2 GLY 86 HA2 GLY 86 126.062 2.578 5.663 675 HA3 GLY 86 HA3 GLY 86 125.043 1.118 5.747 676 H ASN 87 H ASN 87 124.076 0.407 3.876 677 HA ASN 87 HA ASN 87 124.111 2.335 1.543 678 HB2 ASN 87 HB2 ASN 87 125.842 0.392 1.543 679 HB3 ASN 87 HB3 ASN 87 124.442 -0.664 1.242 680 HD21 ASN 87 HD21 ASN 87 126.665 -0.090 -0.653 681 HD22 ASN 87 HD22 ASN 87 125.922 0.661 -2.047 682 H LYS 88 H LYS 88 121.882 1.779 3.415 683 HA LYS 88 HA LYS 88 119.972 0.736 1.334 684 HB2 LYS 88 HB2 LYS 88 118.789 -0.377 3.422 685 HB3 LYS 88 HB3 LYS 88 120.135 -1.216 2.613 686 HG2 LYS 88 HG3 LYS 88 121.720 -0.264 4.270 687 HG3 LYS 88 HG2 LYS 88 120.370 0.564 5.081 688 HD2 LYS 88 HD2 LYS 88 120.530 -1.378 6.364 689 HD3 LYS 88 HD3 LYS 88 119.326 -1.874 5.150 690 HE2 LYS 88 HE2 LYS 88 121.124 -2.898 3.784 691 HE3 LYS 88 HE3 LYS 88 122.329 -2.401 4.996 692 HZ1 LYS 88 HZ1 LYS 88 121.621 -4.676 5.326 693 HZ2 LYS 88 HZ2 LYS 88 120.047 -4.210 5.487 694 HZ3 LYS 88 HZ3 LYS 88 121.163 -3.750 6.611 695 H LEU 89 H LEU 89 117.861 1.611 1.499 696 HA LEU 89 HA LEU 89 117.735 4.083 3.205 697 HB2 LEU 89 HB2 LEU 89 116.365 3.102 0.712 698 HB3 LEU 89 HB3 LEU 89 115.468 4.219 1.768 699 HG LEU 89 HG LEU 89 118.330 4.847 1.032 700 HD11 LEU 89 HD11 LEU 89 117.195 4.327 -1.111 701 HD12 LEU 89 HD12 LEU 89 115.871 5.436 -0.679 702 HD13 LEU 89 HD13 LEU 89 117.509 6.073 -0.962 703 HD21 LEU 89 HD21 LEU 89 117.135 6.193 2.739 704 HD22 LEU 89 HD22 LEU 89 115.836 6.525 1.568 705 HD23 LEU 89 HD23 LEU 89 117.474 7.162 1.285 706 H ILE 90 H ILE 90 116.993 3.612 5.233 707 HA ILE 90 HA ILE 90 115.153 1.348 5.647 708 HB ILE 90 HB ILE 90 115.083 2.515 8.033 709 HG12 ILE 90 HG12 ILE 90 117.680 3.578 6.867 710 HG13 ILE 90 HG13 ILE 90 116.221 4.578 7.081 711 HG21 ILE 90 HG21 ILE 90 116.127 0.334 7.482 712 HG22 ILE 90 HG22 ILE 90 117.155 1.278 8.588 713 HG23 ILE 90 HG23 ILE 90 117.563 1.181 6.858 714 HD11 ILE 90 HD11 ILE 90 116.209 4.177 9.461 715 HD12 ILE 90 HD12 ILE 90 117.857 4.679 9.012 716 HD13 ILE 90 HD13 ILE 90 117.501 2.961 9.315 717 H GLY 91 H GLY 91 113.132 1.613 6.860 718 HA2 GLY 91 HA2 GLY 91 111.699 4.205 6.424 719 HA3 GLY 91 HA3 GLY 91 111.041 2.762 5.611 720 H LYS 92 H LYS 92 111.509 4.386 8.673 721 HA LYS 92 HA LYS 92 110.411 2.066 10.193 722 HB2 LYS 92 HB3 LYS 92 111.564 4.762 10.864 723 HB3 LYS 92 HB2 LYS 92 110.450 4.016 12.034 724 HG2 LYS 92 HG3 LYS 92 111.837 1.946 12.008 725 HG3 LYS 92 HG2 LYS 92 112.966 2.733 10.879 726 HD2 LYS 92 HD2 LYS 92 114.049 3.292 12.830 727 HD3 LYS 92 HD3 LYS 92 112.877 4.631 12.821 728 HE2 LYS 92 HE2 LYS 92 112.782 2.039 14.396 729 HE3 LYS 92 HE3 LYS 92 112.681 3.710 14.999 730 HZ1 LYS 92 HZ1 LYS 92 110.519 2.710 14.968 731 HZ2 LYS 92 HZ2 LYS 92 110.650 2.316 13.372 732 HZ3 LYS 92 HZ3 LYS 92 110.562 3.899 13.825 733 H PHE 93 H PHE 93 108.263 1.750 9.764 734 HA PHE 93 HA PHE 93 106.497 4.204 9.918 735 HB2 PHE 93 HB3 PHE 93 106.400 1.719 8.215 736 HB3 PHE 93 HB2 PHE 93 104.872 2.501 8.674 737 HD1 PHE 93 HD1 PHE 93 107.170 5.104 8.707 738 HD2 PHE 93 HD2 PHE 93 105.161 2.515 5.928 739 HE1 PHE 93 HE1 PHE 93 107.485 6.783 6.912 740 HE2 PHE 93 HE2 PHE 93 105.477 4.196 4.135 741 HZ PHE 93 HZ PHE 93 106.641 6.329 4.626 742 H LYS 94 H LYS 94 104.812 4.193 11.303 743 HA LYS 94 HA LYS 94 104.426 1.673 12.933 744 HB2 LYS 94 HB2 LYS 94 104.723 4.556 13.732 745 HB3 LYS 94 HB3 LYS 94 103.596 3.544 14.665 746 HG2 LYS 94 HG3 LYS 94 105.288 2.125 15.426 747 HG3 LYS 94 HG2 LYS 94 106.352 2.483 14.044 748 HD2 LYS 94 HD2 LYS 94 106.646 4.810 14.931 749 HD3 LYS 94 HD3 LYS 94 105.682 4.355 16.357 750 HE2 LYS 94 HE3 LYS 94 107.399 2.373 16.559 751 HE3 LYS 94 HE2 LYS 94 108.426 3.392 15.522 752 HZ1 LYS 94 HZ1 LYS 94 108.809 3.828 17.856 753 HZ2 LYS 94 HZ2 LYS 94 107.224 4.221 18.087 754 HZ3 LYS 94 HZ3 LYS 94 108.176 5.165 17.126 755 H ARG 95 H ARG 95 102.433 0.842 12.650 756 HA ARG 95 HA ARG 95 100.374 2.074 11.112 757 HB2 ARG 95 HB2 ARG 95 100.562 -0.208 13.017 758 HB3 ARG 95 HB3 ARG 95 98.932 0.481 12.827 759 HG2 ARG 95 HG2 ARG 95 99.247 0.310 10.314 760 HG3 ARG 95 HG3 ARG 95 100.755 -0.582 10.625 761 HD2 ARG 95 HD3 ARG 95 98.697 -2.038 10.232 762 HD3 ARG 95 HD2 ARG 95 99.567 -2.356 11.752 763 HE ARG 95 HE ARG 95 97.502 -0.383 12.233 764 HH11 ARG 95 HH11 ARG 95 95.619 -1.097 13.259 765 HH12 ARG 95 HH12 ARG 95 95.224 -2.802 13.275 766 HH21 ARG 95 HH21 ARG 95 98.054 -3.736 11.474 767 HH22 ARG 95 HH22 ARG 95 96.597 -4.289 12.268 768 H THR 96 H THR 96 99.366 3.969 11.548 769 HA THR 96 HA THR 96 99.380 5.146 14.212 770 HB THR 96 HB THR 96 97.364 6.460 12.882 771 HG1 THR 96 HG1 THR 96 99.187 5.522 10.899 772 HG21 THR 96 HG21 THR 96 99.140 8.036 12.180 773 HG22 THR 96 HG22 THR 96 100.369 6.783 12.475 774 HG23 THR 96 HG23 THR 96 99.428 7.444 13.834 775 H ASP 97 H ASP 97 97.564 2.762 12.756 776 HA ASP 97 HA ASP 97 95.035 3.225 14.199 777 HB2 ASP 97 HB2 ASP 97 96.113 0.738 12.796 778 HB3 ASP 97 HB3 ASP 97 94.436 0.977 13.343 779 H ASN 98 H ASN 98 97.709 0.832 14.479 780 HA ASN 98 HA ASN 98 96.989 0.623 17.405 781 HB2 ASN 98 HB2 ASN 98 96.091 -1.356 16.225 782 HB3 ASN 98 HB3 ASN 98 97.700 -1.682 15.537 783 HD21 ASN 98 HD21 ASN 98 97.691 -0.372 18.775 784 HD22 ASN 98 HD22 ASN 98 98.027 -1.876 19.603 785 H GLY 99 H GLY 99 99.215 1.847 15.500 786 HA2 GLY 99 HA2 GLY 99 101.587 2.015 15.572 787 HA3 GLY 99 HA3 GLY 99 101.343 1.879 17.331 788 H ASN 100 H ASN 100 100.760 -0.537 14.743 789 HA ASN 100 HA ASN 100 102.112 -2.597 16.359 790 HB2 ASN 100 HB3 ASN 100 100.771 -2.480 13.662 791 HB3 ASN 100 HB2 ASN 100 101.812 -3.870 14.055 792 HD21 ASN 100 HD21 ASN 100 98.735 -3.582 13.805 793 HD22 ASN 100 HD22 ASN 100 98.141 -4.252 15.308 794 H GLU 101 H GLU 101 103.524 -0.138 15.196 795 HA GLU 101 HA GLU 101 105.556 0.369 14.108 796 HB2 GLU 101 HB2 GLU 101 107.423 -0.777 15.038 797 HB3 GLU 101 HB3 GLU 101 106.160 -0.834 16.288 798 HG2 GLU 101 HG3 GLU 101 105.610 -3.120 15.739 799 HG3 GLU 101 HG2 GLU 101 106.625 -3.074 14.277 800 H LEU 102 H LEU 102 107.133 -0.205 12.475 801 HA LEU 102 HA LEU 102 106.798 -2.723 10.966 802 HB2 LEU 102 HB2 LEU 102 104.870 -1.261 10.171 803 HB3 LEU 102 HB3 LEU 102 106.082 -0.095 9.589 804 HG LEU 102 HG LEU 102 106.067 -3.029 8.767 805 HD11 LEU 102 HD11 LEU 102 103.962 -1.934 8.042 806 HD12 LEU 102 HD12 LEU 102 105.026 -2.265 6.654 807 HD13 LEU 102 HD13 LEU 102 104.903 -0.614 7.308 808 HD21 LEU 102 HD21 LEU 102 107.272 -1.664 6.757 809 HD22 LEU 102 HD22 LEU 102 108.167 -2.291 8.162 810 HD23 LEU 102 HD23 LEU 102 107.668 -0.583 8.114 811 H ASN 103 H ASN 103 108.858 -3.186 10.304 812 HA ASN 103 HA ASN 103 110.700 -0.812 9.921 813 HB2 ASN 103 HB3 ASN 103 111.028 -3.463 11.237 814 HB3 ASN 103 HB2 ASN 103 112.388 -2.953 10.208 815 HD21 ASN 103 HD21 ASN 103 113.804 -1.376 11.041 816 HD22 ASN 103 HD22 ASN 103 113.510 -0.499 12.526 817 H THR 104 H THR 104 111.026 -0.431 7.787 818 HA THR 104 HA THR 104 111.241 -2.866 6.003 819 HB THR 104 HB THR 104 109.142 -1.801 5.492 820 HG1 THR 104 HG1 THR 104 109.836 -2.090 3.505 821 HG21 THR 104 HG21 THR 104 109.394 0.751 4.750 822 HG22 THR 104 HG22 THR 104 109.163 0.318 6.461 823 HG23 THR 104 HG23 THR 104 110.792 0.695 5.850 824 H VAL 105 H VAL 105 112.233 -2.135 3.800 825 HA VAL 105 HA VAL 105 114.320 -0.022 4.126 826 HB VAL 105 HB VAL 105 114.901 -2.985 3.745 827 HG11 VAL 105 HG11 VAL 105 117.299 -2.142 3.372 828 HG12 VAL 105 HG12 VAL 105 116.582 -0.542 3.067 829 HG13 VAL 105 HG13 VAL 105 116.171 -1.916 2.014 830 HG21 VAL 105 HG21 VAL 105 116.657 -2.321 5.528 831 HG22 VAL 105 HG22 VAL 105 115.732 -0.809 5.697 832 HG23 VAL 105 HG23 VAL 105 114.956 -2.372 6.048 833 H ARG 106 H ARG 106 115.162 0.668 2.065 834 HA ARG 106 HA ARG 106 113.700 -0.532 -0.302 835 HB2 ARG 106 HB3 ARG 106 112.793 1.723 0.524 836 HB3 ARG 106 HB2 ARG 106 114.351 2.423 0.027 837 HG2 ARG 106 HG2 ARG 106 113.986 1.538 -2.278 838 HG3 ARG 106 HG3 ARG 106 112.398 0.916 -1.768 839 HD2 ARG 106 HD2 ARG 106 113.025 3.811 -1.239 840 HD3 ARG 106 HD3 ARG 106 112.642 3.326 -2.909 841 HE ARG 106 HE ARG 106 110.604 2.139 -1.412 842 HH11 ARG 106 HH11 ARG 106 108.675 3.218 -0.938 843 HH12 ARG 106 HH12 ARG 106 108.634 4.966 -0.909 844 HH21 ARG 106 HH21 ARG 106 112.005 5.313 -1.710 845 HH22 ARG 106 HH22 ARG 106 110.512 6.147 -1.344 846 H GLU 107 H GLU 107 114.993 -0.955 -2.065 847 HA GLU 107 HA GLU 107 117.697 0.363 -2.153 848 HB2 GLU 107 HB2 GLU 107 117.142 -2.614 -2.000 849 HB3 GLU 107 HB3 GLU 107 118.615 -1.990 -2.781 850 HG2 GLU 107 HG2 GLU 107 119.083 -0.678 -0.665 851 HG3 GLU 107 HG3 GLU 107 117.717 -1.528 0.097 852 H ILE 108 H ILE 108 118.710 0.166 -4.303 853 HA ILE 108 HA ILE 108 116.645 -0.375 -6.444 854 HB ILE 108 HB ILE 108 118.957 1.615 -6.483 855 HG12 ILE 108 HG13 ILE 108 116.692 1.871 -4.958 856 HG13 ILE 108 HG12 ILE 108 117.555 3.246 -5.686 857 HG21 ILE 108 HG21 ILE 108 118.406 0.908 -8.703 858 HG22 ILE 108 HG22 ILE 108 117.588 2.470 -8.466 859 HG23 ILE 108 HG23 ILE 108 116.661 0.955 -8.359 860 HD11 ILE 108 HD11 ILE 108 115.030 3.170 -6.110 861 HD12 ILE 108 HD12 ILE 108 115.336 1.742 -7.128 862 HD13 ILE 108 HD13 ILE 108 116.052 3.313 -7.561 863 H ILE 109 H ILE 109 117.457 -2.571 -6.455 864 HA ILE 109 HA ILE 109 120.258 -3.176 -6.856 865 HB ILE 109 HB ILE 109 117.688 -4.692 -7.440 866 HG12 ILE 109 HG12 ILE 109 118.505 -6.051 -5.516 867 HG13 ILE 109 HG13 ILE 109 119.917 -4.977 -5.374 868 HG21 ILE 109 HG21 ILE 109 119.431 -5.414 -9.050 869 HG22 ILE 109 HG22 ILE 109 119.126 -6.676 -7.833 870 HG23 ILE 109 HG23 ILE 109 120.575 -5.650 -7.707 871 HD11 ILE 109 HD11 ILE 109 117.757 -4.546 -3.894 872 HD12 ILE 109 HD12 ILE 109 118.641 -3.177 -4.609 873 HD13 ILE 109 HD13 ILE 109 117.150 -3.773 -5.378 874 H GLY 110 H GLY 110 121.056 -1.818 -8.469 875 HA2 GLY 110 HA3 GLY 110 121.456 -1.101 -10.690 876 HA3 GLY 110 HA2 GLY 110 121.254 -2.825 -11.070 877 H ASP 111 H ASP 111 118.939 -3.569 -11.435 878 HA ASP 111 HA ASP 111 117.331 -1.297 -12.621 879 HB2 ASP 111 HB2 ASP 111 118.549 -2.860 -14.274 880 HB3 ASP 111 HB3 ASP 111 117.398 -4.114 -13.752 881 H GLU 112 H GLU 112 117.100 -2.650 -9.954 882 HA GLU 112 HA GLU 112 114.198 -3.337 -10.269 883 HB2 GLU 112 HB2 GLU 112 115.689 -5.098 -8.382 884 HB3 GLU 112 HB3 GLU 112 114.335 -5.482 -9.472 885 HG2 GLU 112 HG2 GLU 112 115.899 -5.414 -11.410 886 HG3 GLU 112 HG3 GLU 112 117.246 -5.083 -10.295 887 H LEU 113 H LEU 113 112.980 -2.536 -8.559 888 HA LEU 113 HA LEU 113 114.560 -1.106 -6.429 889 HB2 LEU 113 HB3 LEU 113 112.492 -0.187 -7.908 890 HB3 LEU 113 HB2 LEU 113 111.566 -0.928 -6.582 891 HG LEU 113 HG LEU 113 113.908 0.741 -5.766 892 HD11 LEU 113 HD11 LEU 113 112.957 2.084 -7.623 893 HD12 LEU 113 HD12 LEU 113 111.340 1.947 -6.893 894 HD13 LEU 113 HD13 LEU 113 112.624 2.845 -6.049 895 HD21 LEU 113 HD21 LEU 113 111.116 0.071 -4.843 896 HD22 LEU 113 HD22 LEU 113 111.878 1.566 -4.249 897 HD23 LEU 113 HD23 LEU 113 112.653 -0.008 -3.948 898 H VAL 114 H VAL 114 114.967 -2.384 -4.668 899 HA VAL 114 HA VAL 114 112.943 -4.501 -4.018 900 HB VAL 114 HB VAL 114 115.792 -3.964 -3.106 901 HG11 VAL 114 HG11 VAL 114 114.448 -4.685 -1.150 902 HG12 VAL 114 HG12 VAL 114 115.562 -5.971 -1.670 903 HG13 VAL 114 HG13 VAL 114 113.833 -6.070 -2.083 904 HG21 VAL 114 HG21 VAL 114 114.453 -6.355 -4.449 905 HG22 VAL 114 HG22 VAL 114 116.191 -6.165 -4.116 906 HG23 VAL 114 HG23 VAL 114 115.390 -5.105 -5.301 907 H GLN 115 H GLN 115 111.389 -4.009 -2.606 908 HA GLN 115 HA GLN 115 112.087 -2.086 -0.373 909 HB2 GLN 115 HB2 GLN 115 110.340 -1.367 -2.187 910 HB3 GLN 115 HB3 GLN 115 109.272 -2.559 -1.408 911 HG2 GLN 115 HG2 GLN 115 109.446 -1.419 0.726 912 HG3 GLN 115 HG3 GLN 115 110.703 -0.328 0.096 913 HE21 GLN 115 HE21 GLN 115 108.368 -0.976 -2.324 914 HE22 GLN 115 HE22 GLN 115 107.403 0.468 -2.113 915 H THR 116 H THR 116 112.509 -3.513 1.294 916 HA THR 116 HA THR 116 110.578 -5.809 1.622 917 HB THR 116 HB THR 116 113.066 -5.558 3.284 918 HG1 THR 116 HG1 THR 116 113.916 -5.101 1.282 919 HG21 THR 116 HG21 THR 116 113.072 -8.013 2.930 920 HG22 THR 116 HG22 THR 116 111.504 -7.456 3.560 921 HG23 THR 116 HG23 THR 116 111.679 -7.856 1.834 922 H TYR 117 H TYR 117 109.532 -6.149 3.588 923 HA TYR 117 HA TYR 117 109.814 -3.899 5.588 924 HB2 TYR 117 HB2 TYR 117 107.181 -5.324 5.172 925 HB3 TYR 117 HB3 TYR 117 107.493 -3.724 5.885 926 HD1 TYR 117 HD1 TYR 117 108.112 -5.551 2.693 927 HD2 TYR 117 HD2 TYR 117 106.958 -1.878 4.570 928 HE1 TYR 117 HE1 TYR 117 107.741 -4.535 0.462 929 HE2 TYR 117 HE2 TYR 117 106.589 -0.846 2.346 930 HH TYR 117 HH TYR 117 106.736 -1.120 0.122 931 H VAL 118 H VAL 118 109.431 -4.468 7.735 932 HA VAL 118 HA VAL 118 109.497 -7.448 8.266 933 HB VAL 118 HB VAL 118 110.688 -5.339 10.092 934 HG11 VAL 118 HG11 VAL 118 111.576 -7.144 11.264 935 HG12 VAL 118 HG12 VAL 118 110.058 -7.860 10.672 936 HG13 VAL 118 HG13 VAL 118 111.590 -8.202 9.832 937 HG21 VAL 118 HG21 VAL 118 112.618 -6.939 8.560 938 HG22 VAL 118 HG22 VAL 118 111.640 -5.877 7.519 939 HG23 VAL 118 HG23 VAL 118 112.583 -5.185 8.861 940 H TYR 119 H TYR 119 108.298 -8.150 10.040 941 HA TYR 119 HA TYR 119 106.681 -6.053 11.433 942 HB2 TYR 119 HB2 TYR 119 105.628 -7.310 9.240 943 HB3 TYR 119 HB3 TYR 119 105.105 -8.404 10.544 944 HD1 TYR 119 HD1 TYR 119 103.881 -7.469 12.509 945 HD2 TYR 119 HD2 TYR 119 104.639 -5.148 8.981 946 HE1 TYR 119 HE1 TYR 119 102.104 -5.877 13.179 947 HE2 TYR 119 HE2 TYR 119 102.871 -3.544 9.653 948 HH TYR 119 HH TYR 119 100.883 -3.452 11.055 949 H GLU 120 H GLU 120 107.161 -6.434 13.470 950 HA GLU 120 HA GLU 120 107.579 -7.591 15.478 951 HB2 GLU 120 HB3 GLU 120 105.288 -9.193 14.280 952 HB3 GLU 120 HB2 GLU 120 105.874 -9.411 15.947 953 HG2 GLU 120 HG2 GLU 120 105.439 -7.012 16.411 954 HG3 GLU 120 HG3 GLU 120 104.843 -6.801 14.747 955 H GLY 121 H GLY 121 108.928 -8.618 12.889 956 HA2 GLY 121 HA2 GLY 121 110.858 -10.187 13.206 957 HA3 GLY 121 HA3 GLY 121 109.768 -11.246 14.134 958 H VAL 122 H VAL 122 108.693 -9.575 11.252 959 HA VAL 122 HA VAL 122 108.820 -12.205 9.778 960 HB VAL 122 HB VAL 122 106.486 -11.088 10.610 961 HG11 VAL 122 HG11 VAL 122 106.729 -10.084 7.762 962 HG12 VAL 122 HG12 VAL 122 105.499 -9.687 8.986 963 HG13 VAL 122 HG13 VAL 122 107.150 -9.041 9.141 964 HG21 VAL 122 HG21 VAL 122 105.420 -12.361 8.774 965 HG22 VAL 122 HG22 VAL 122 106.983 -12.439 7.925 966 HG23 VAL 122 HG23 VAL 122 106.776 -13.267 9.487 967 H GLU 123 H GLU 123 108.421 -11.596 7.299 968 HA GLU 123 HA GLU 123 109.636 -8.960 6.682 969 HB2 GLU 123 HB2 GLU 123 111.629 -10.279 7.208 970 HB3 GLU 123 HB3 GLU 123 111.104 -11.564 6.094 971 HG2 GLU 123 HG2 GLU 123 111.290 -10.065 4.187 972 HG3 GLU 123 HG3 GLU 123 111.625 -8.681 5.255 973 H ALA 124 H ALA 124 108.601 -8.228 4.936 974 HA ALA 124 HA ALA 124 107.660 -10.259 2.894 975 HB1 ALA 124 HB1 ALA 124 106.406 -7.710 2.498 976 HB2 ALA 124 HB2 ALA 124 105.647 -9.231 3.025 977 HB3 ALA 124 HB3 ALA 124 106.293 -8.094 4.232 978 H LYS 125 H LYS 125 108.284 -9.884 0.707 979 HA LYS 125 HA LYS 125 110.157 -7.524 0.397 980 HB2 LYS 125 HB2 LYS 125 111.141 -9.927 0.392 981 HB3 LYS 125 HB3 LYS 125 110.376 -10.086 -1.207 982 HG2 LYS 125 HG2 LYS 125 111.553 -7.759 -1.672 983 HG3 LYS 125 HG3 LYS 125 112.612 -8.251 -0.329 984 HD2 LYS 125 HD3 LYS 125 112.021 -10.100 -2.669 985 HD3 LYS 125 HD2 LYS 125 113.354 -8.922 -2.714 986 HE2 LYS 125 HE2 LYS 125 113.018 -10.884 -0.418 987 HE3 LYS 125 HE3 LYS 125 113.928 -11.303 -1.890 988 HZ1 LYS 125 HZ1 LYS 125 115.358 -10.383 -0.190 989 HZ2 LYS 125 HZ2 LYS 125 115.317 -9.380 -1.498 990 HZ3 LYS 125 HZ3 LYS 125 114.473 -8.992 -0.134 991 H ARG 126 H ARG 126 109.966 -6.263 -1.390 992 HA ARG 126 HA ARG 126 108.001 -7.129 -3.511 993 HB2 ARG 126 HB3 ARG 126 108.114 -4.423 -2.103 994 HB3 ARG 126 HB2 ARG 126 107.150 -4.762 -3.560 995 HG2 ARG 126 HG3 ARG 126 105.945 -6.559 -2.326 996 HG3 ARG 126 HG2 ARG 126 106.886 -6.170 -0.866 997 HD2 ARG 126 HD2 ARG 126 104.860 -4.965 -0.585 998 HD3 ARG 126 HD3 ARG 126 106.009 -3.746 -1.186 999 HE ARG 126 HE ARG 126 104.712 -3.570 -3.169 1000 HH11 ARG 126 HH11 ARG 126 102.988 -4.189 -4.493 1001 HH12 ARG 126 HH12 ARG 126 102.122 -5.673 -4.165 1002 HH21 ARG 126 HH21 ARG 126 104.061 -6.491 -1.392 1003 HH22 ARG 126 HH22 ARG 126 102.727 -6.970 -2.417 1004 H ILE 127 H ILE 127 109.213 -7.214 -5.347 1005 HA ILE 127 HA ILE 127 111.493 -5.240 -5.585 1006 HB ILE 127 HB ILE 127 111.131 -7.714 -7.297 1007 HG12 ILE 127 HG12 ILE 127 112.827 -7.776 -4.804 1008 HG13 ILE 127 HG13 ILE 127 111.078 -8.075 -4.658 1009 HG21 ILE 127 HG21 ILE 127 113.600 -7.542 -7.408 1010 HG22 ILE 127 HG22 ILE 127 112.824 -6.033 -7.944 1011 HG23 ILE 127 HG23 ILE 127 113.549 -6.134 -6.321 1012 HD11 ILE 127 HD11 ILE 127 112.318 -10.196 -5.000 1013 HD12 ILE 127 HD12 ILE 127 111.240 -9.857 -6.375 1014 HD13 ILE 127 HD13 ILE 127 112.988 -9.558 -6.521 1015 H PHE 128 H PHE 128 111.257 -3.624 -7.041 1016 HA PHE 128 HA PHE 128 109.074 -3.903 -9.094 1017 HB2 PHE 128 HB3 PHE 128 110.746 -1.435 -8.459 1018 HB3 PHE 128 HB2 PHE 128 109.251 -1.508 -9.415 1019 HD1 PHE 128 HD1 PHE 128 108.259 -3.735 -7.213 1020 HD2 PHE 128 HD2 PHE 128 109.499 0.370 -7.152 1021 HE1 PHE 128 HE1 PHE 128 106.886 -3.354 -5.187 1022 HE2 PHE 128 HE2 PHE 128 108.138 0.753 -5.114 1023 HZ PHE 128 HZ PHE 128 106.825 -1.110 -4.133 1024 H LYS 129 H LYS 129 109.694 -2.603 -11.192 1025 HA LYS 129 HA LYS 129 112.506 -2.912 -12.062 1026 HB2 LYS 129 HB2 LYS 129 111.470 -5.235 -12.300 1027 HB3 LYS 129 HB3 LYS 129 110.350 -4.527 -13.488 1028 HG2 LYS 129 HG3 LYS 129 112.621 -3.581 -14.537 1029 HG3 LYS 129 HG2 LYS 129 113.319 -4.980 -13.687 1030 HD2 LYS 129 HD2 LYS 129 111.575 -6.433 -14.797 1031 HD3 LYS 129 HD3 LYS 129 111.078 -5.017 -15.754 1032 HE2 LYS 129 HE3 LYS 129 112.751 -6.563 -16.900 1033 HE3 LYS 129 HE2 LYS 129 113.250 -4.858 -16.794 1034 HZ1 LYS 129 HZ1 LYS 129 114.853 -6.737 -16.072 1035 HZ2 LYS 129 HZ2 LYS 129 114.005 -6.696 -14.658 1036 HZ3 LYS 129 HZ3 LYS 129 114.779 -5.342 -15.194 1037 H LYS 130 H LYS 130 112.879 -1.698 -13.985 1038 HA LYS 130 HA LYS 130 111.321 0.603 -14.404 1039 HB2 LYS 130 HB2 LYS 130 112.510 0.910 -16.466 1040 HB3 LYS 130 HB3 LYS 130 113.620 0.028 -15.390 1041 HG2 LYS 130 HG3 LYS 130 112.583 -2.120 -16.468 1042 HG3 LYS 130 HG2 LYS 130 112.022 -1.015 -17.745 1043 HD2 LYS 130 HD2 LYS 130 114.391 -0.203 -18.005 1044 HD3 LYS 130 HD3 LYS 130 114.901 -1.445 -16.837 1045 HE2 LYS 130 HE3 LYS 130 115.230 -2.349 -19.065 1046 HE3 LYS 130 HE2 LYS 130 113.830 -3.180 -18.345 1047 HZ1 LYS 130 HZ1 LYS 130 113.375 -2.454 -20.592 1048 HZ2 LYS 130 HZ2 LYS 130 112.398 -1.656 -19.530 1049 HZ3 LYS 130 HZ3 LYS 130 113.695 -0.885 -20.197 1050 H ASP 131 H ASP 131 109.362 1.018 -15.291 1051 HA ASP 131 HA ASP 131 107.472 -0.930 -15.981 1052 HB2 ASP 131 HB2 ASP 131 106.455 0.904 -17.490 1053 HB3 ASP 131 HB3 ASP 131 106.716 1.324 -15.780 Start of MODEL 14 1 H1 ALA 1 H1 ALA 1 113.575 4.507 -4.189 2 H2 ALA 1 H2 ALA 1 112.637 4.562 -5.544 3 H3 ALA 1 H3 ALA 1 114.149 3.908 -5.614 4 HA ALA 1 HA ALA 1 113.360 6.720 -5.447 5 HB1 ALA 1 HB1 ALA 1 115.690 7.279 -4.796 6 HB2 ALA 1 HB2 ALA 1 114.887 6.314 -3.534 7 HB3 ALA 1 HB3 ALA 1 116.059 5.545 -4.631 8 H PHE 2 H PHE 2 113.336 4.556 -7.495 9 HA PHE 2 HA PHE 2 115.643 4.789 -9.225 10 HB2 PHE 2 HB2 PHE 2 112.822 3.867 -9.458 11 HB3 PHE 2 HB3 PHE 2 113.578 4.389 -10.978 12 HD1 PHE 2 HD1 PHE 2 112.834 1.578 -9.287 13 HD2 PHE 2 HD2 PHE 2 116.311 3.549 -10.861 14 HE1 PHE 2 HE1 PHE 2 113.984 -0.610 -9.473 15 HE2 PHE 2 HE2 PHE 2 117.469 1.363 -11.035 16 HZ PHE 2 HZ PHE 2 116.305 -0.716 -10.344 17 H ASP 3 H ASP 3 113.957 7.260 -8.136 18 HA ASP 3 HA ASP 3 113.184 9.327 -9.063 19 HB2 ASP 3 HB2 ASP 3 115.009 10.290 -10.621 20 HB3 ASP 3 HB3 ASP 3 115.521 9.814 -8.984 21 H SER 4 H SER 4 111.816 7.213 -10.320 22 HA SER 4 HA SER 4 111.142 8.467 -12.881 23 HB2 SER 4 HB3 SER 4 113.341 6.843 -13.083 24 HB3 SER 4 HB2 SER 4 112.032 5.678 -13.397 25 HG SER 4 HG SER 4 112.724 6.778 -15.318 26 H THR 5 H THR 5 110.194 5.923 -14.068 27 HA THR 5 HA THR 5 107.885 5.474 -12.164 28 HB THR 5 HB THR 5 108.092 5.209 -15.195 29 HG1 THR 5 HG1 THR 5 106.530 6.915 -15.053 30 HG21 THR 5 HG21 THR 5 105.678 4.655 -15.103 31 HG22 THR 5 HG22 THR 5 105.741 4.676 -13.325 32 HG23 THR 5 HG23 THR 5 106.645 3.441 -14.233 33 H TRP 6 H TRP 6 107.685 3.495 -11.269 34 HA TRP 6 HA TRP 6 108.799 1.116 -12.737 35 HB2 TRP 6 HB3 TRP 6 109.443 1.843 -9.842 36 HB3 TRP 6 HB2 TRP 6 109.883 0.312 -10.640 37 HD1 TRP 6 HD1 TRP 6 110.346 4.113 -11.286 38 HE1 TRP 6 HE1 TRP 6 112.654 4.496 -12.359 39 HE3 TRP 6 HE3 TRP 6 111.936 -0.727 -11.547 40 HZ2 TRP 6 HZ2 TRP 6 114.911 2.901 -13.172 41 HZ3 TRP 6 HZ3 TRP 6 114.174 -1.268 -12.463 42 HH2 TRP 6 HH2 TRP 6 115.664 0.539 -13.274 43 H LYS 7 H LYS 7 108.006 -0.978 -11.552 44 HA LYS 7 HA LYS 7 105.556 -0.498 -9.918 45 HB2 LYS 7 HB3 LYS 7 104.015 -1.513 -11.439 46 HB3 LYS 7 HB2 LYS 7 104.929 -0.329 -12.404 47 HG2 LYS 7 HG3 LYS 7 106.542 -2.368 -12.861 48 HG3 LYS 7 HG2 LYS 7 105.131 -3.345 -12.389 49 HD2 LYS 7 HD2 LYS 7 103.763 -2.302 -14.116 50 HD3 LYS 7 HD3 LYS 7 105.070 -1.164 -14.520 51 HE2 LYS 7 HE2 LYS 7 105.218 -2.880 -16.172 52 HE3 LYS 7 HE3 LYS 7 106.509 -3.256 -15.005 53 HZ1 LYS 7 HZ1 LYS 7 105.203 -5.203 -15.546 54 HZ2 LYS 7 HZ2 LYS 7 103.817 -4.469 -15.035 55 HZ3 LYS 7 HZ3 LYS 7 105.012 -4.818 -13.953 56 H VAL 8 H VAL 8 104.987 -2.272 -8.674 57 HA VAL 8 HA VAL 8 106.891 -4.159 -7.915 58 HB VAL 8 HB VAL 8 105.039 -4.188 -6.528 59 HG11 VAL 8 HG11 VAL 8 102.667 -4.450 -7.545 60 HG12 VAL 8 HG12 VAL 8 103.497 -2.894 -7.780 61 HG13 VAL 8 HG13 VAL 8 103.442 -4.082 -9.104 62 HG21 VAL 8 HG21 VAL 8 104.082 -6.366 -6.570 63 HG22 VAL 8 HG22 VAL 8 105.653 -6.558 -7.384 64 HG23 VAL 8 HG23 VAL 8 104.158 -6.457 -8.346 65 H ASP 9 H ASP 9 108.075 -5.345 -9.301 66 HA ASP 9 HA ASP 9 106.670 -6.747 -11.556 67 HB2 ASP 9 HB3 ASP 9 108.733 -5.588 -12.167 68 HB3 ASP 9 HB2 ASP 9 109.621 -6.400 -10.855 69 H ARG 10 H ARG 10 108.358 -7.258 -8.499 70 HA ARG 10 HA ARG 10 107.303 -10.057 -8.492 71 HB2 ARG 10 HB2 ARG 10 110.231 -9.571 -7.844 72 HB3 ARG 10 HB3 ARG 10 109.398 -11.123 -8.101 73 HG2 ARG 10 HG3 ARG 10 108.974 -10.444 -10.483 74 HG3 ARG 10 HG2 ARG 10 109.939 -8.975 -10.199 75 HD2 ARG 10 HD2 ARG 10 111.095 -11.689 -9.534 76 HD3 ARG 10 HD3 ARG 10 111.103 -11.110 -11.218 77 HE ARG 10 HE ARG 10 112.134 -8.966 -9.682 78 HH11 ARG 10 HH11 ARG 10 114.366 -8.740 -9.404 79 HH12 ARG 10 HH12 ARG 10 115.414 -10.128 -9.582 80 HH21 ARG 10 HH21 ARG 10 112.810 -12.324 -10.305 81 HH22 ARG 10 HH22 ARG 10 114.537 -12.150 -10.090 82 H SER 11 H SER 11 107.584 -11.064 -6.283 83 HA SER 11 HA SER 11 108.348 -9.378 -4.021 84 HB2 SER 11 HB3 SER 11 106.367 -8.116 -4.340 85 HB3 SER 11 HB2 SER 11 105.422 -9.552 -4.805 86 HG SER 11 HG SER 11 105.142 -8.725 -2.564 87 H GLU 12 H GLU 12 107.572 -10.493 -1.890 88 HA GLU 12 HA GLU 12 106.632 -13.266 -2.143 89 HB2 GLU 12 HB3 GLU 12 108.804 -14.266 -1.253 90 HB3 GLU 12 HB2 GLU 12 108.850 -13.730 -2.949 91 HG2 GLU 12 HG3 GLU 12 109.959 -11.652 -2.320 92 HG3 GLU 12 HG2 GLU 12 109.778 -12.034 -0.591 93 H ASN 13 H ASN 13 106.760 -14.417 0.007 94 HA ASN 13 HA ASN 13 106.364 -14.426 2.331 95 HB2 ASN 13 HB2 ASN 13 108.431 -12.315 1.944 96 HB3 ASN 13 HB3 ASN 13 107.514 -12.219 3.465 97 HD21 ASN 13 HD21 ASN 13 109.308 -12.938 4.783 98 HD22 ASN 13 HD22 ASN 13 109.886 -14.587 4.713 99 H TYR 14 H TYR 14 105.365 -11.874 0.305 100 HA TYR 14 HA TYR 14 104.131 -9.990 1.954 101 HB2 TYR 14 HB2 TYR 14 103.917 -10.706 -0.713 102 HB3 TYR 14 HB3 TYR 14 102.278 -11.033 -0.103 103 HD1 TYR 14 HD1 TYR 14 104.800 -8.434 0.905 104 HD2 TYR 14 HD2 TYR 14 100.936 -9.241 -0.788 105 HE1 TYR 14 HE1 TYR 14 104.306 -6.004 0.874 106 HE2 TYR 14 HE2 TYR 14 100.441 -6.813 -0.820 107 HH TYR 14 HH TYR 14 101.868 -4.624 -0.889 108 H ASP 15 H ASP 15 102.490 -13.048 0.924 109 HA ASP 15 HA ASP 15 100.227 -12.782 2.586 110 HB2 ASP 15 HB3 ASP 15 101.632 -15.454 2.363 111 HB3 ASP 15 HB2 ASP 15 99.888 -15.096 2.325 112 H LYS 16 H LYS 16 103.432 -14.147 3.459 113 HA LYS 16 HA LYS 16 102.737 -14.773 6.182 114 HB2 LYS 16 HB3 LYS 16 105.416 -13.828 5.062 115 HB3 LYS 16 HB2 LYS 16 105.173 -14.639 6.628 116 HG2 LYS 16 HG2 LYS 16 104.117 -15.956 4.131 117 HG3 LYS 16 HG3 LYS 16 105.862 -16.037 4.470 118 HD2 LYS 16 HD2 LYS 16 105.514 -17.151 6.551 119 HD3 LYS 16 HD3 LYS 16 103.781 -16.745 6.569 120 HE2 LYS 16 HE2 LYS 16 105.162 -18.607 4.583 121 HE3 LYS 16 HE3 LYS 16 104.116 -19.112 5.932 122 HZ1 LYS 16 HZ1 LYS 16 102.617 -19.013 4.253 123 HZ2 LYS 16 HZ2 LYS 16 102.500 -17.448 4.761 124 HZ3 LYS 16 HZ3 LYS 16 103.398 -17.817 3.428 125 H PHE 17 H PHE 17 103.916 -11.786 4.637 126 HA PHE 17 HA PHE 17 104.095 -10.262 7.111 127 HB2 PHE 17 HB3 PHE 17 105.209 -9.496 5.088 128 HB3 PHE 17 HB2 PHE 17 103.667 -9.459 4.202 129 HD1 PHE 17 HD1 PHE 17 105.850 -7.738 6.527 130 HD2 PHE 17 HD2 PHE 17 101.912 -7.766 4.832 131 HE1 PHE 17 HE1 PHE 17 105.516 -5.401 7.279 132 HE2 PHE 17 HE2 PHE 17 101.568 -5.429 5.589 133 HZ PHE 17 HZ PHE 17 103.371 -4.245 6.813 134 H MET 18 H MET 18 101.699 -10.061 4.457 135 HA MET 18 HA MET 18 99.752 -8.534 5.825 136 HB2 MET 18 HB2 MET 18 99.724 -10.513 3.593 137 HB3 MET 18 HB3 MET 18 98.159 -10.253 4.399 138 HG2 MET 18 HG3 MET 18 98.202 -8.616 2.681 139 HG3 MET 18 HG2 MET 18 98.675 -7.718 4.142 140 HE1 MET 18 HE1 MET 18 99.741 -5.878 3.330 141 HE2 MET 18 HE2 MET 18 101.085 -5.757 2.169 142 HE3 MET 18 HE3 MET 18 99.452 -6.180 1.599 143 H GLU 19 H GLU 19 100.561 -11.967 6.169 144 HA GLU 19 HA GLU 19 98.173 -12.595 7.758 145 HB2 GLU 19 HB2 GLU 19 99.333 -14.416 6.663 146 HB3 GLU 19 HB3 GLU 19 100.873 -13.972 7.437 147 HG2 GLU 19 HG3 GLU 19 100.126 -14.672 9.584 148 HG3 GLU 19 HG2 GLU 19 98.420 -14.690 9.076 149 H LYS 20 H LYS 20 101.388 -11.301 8.403 150 HA LYS 20 HA LYS 20 101.330 -11.760 11.279 151 HB2 LYS 20 HB2 LYS 20 103.192 -10.799 9.463 152 HB3 LYS 20 HB3 LYS 20 102.747 -9.330 10.362 153 HG2 LYS 20 HG3 LYS 20 104.491 -10.232 11.669 154 HG3 LYS 20 HG2 LYS 20 103.032 -10.840 12.487 155 HD2 LYS 20 HD2 LYS 20 103.231 -12.994 11.387 156 HD3 LYS 20 HD3 LYS 20 104.546 -12.396 10.348 157 HE2 LYS 20 HE2 LYS 20 105.678 -13.577 12.060 158 HE3 LYS 20 HE3 LYS 20 105.786 -11.878 12.580 159 HZ1 LYS 20 HZ1 LYS 20 105.075 -13.314 14.373 160 HZ2 LYS 20 HZ2 LYS 20 103.872 -12.255 13.984 161 HZ3 LYS 20 HZ3 LYS 20 103.772 -13.829 13.503 162 H MET 21 H MET 21 100.500 -8.917 9.242 163 HA MET 21 HA MET 21 99.644 -7.270 11.459 164 HB2 MET 21 HB2 MET 21 99.761 -7.070 8.618 165 HB3 MET 21 HB3 MET 21 98.069 -6.758 9.074 166 HG2 MET 21 HG2 MET 21 99.045 -5.187 10.892 167 HG3 MET 21 HG3 MET 21 100.572 -5.299 9.984 168 HE1 MET 21 HE1 MET 21 99.790 -3.901 6.524 169 HE2 MET 21 HE2 MET 21 101.026 -4.418 7.694 170 HE3 MET 21 HE3 MET 21 99.837 -5.591 7.080 171 H GLY 22 H GLY 22 98.369 -10.172 10.295 172 HA2 GLY 22 HA3 GLY 22 96.424 -11.288 11.132 173 HA3 GLY 22 HA2 GLY 22 95.925 -9.779 11.934 174 H VAL 23 H VAL 23 96.845 -9.775 8.549 175 HA VAL 23 HA VAL 23 94.230 -8.680 7.803 176 HB VAL 23 HB VAL 23 96.490 -9.734 6.043 177 HG11 VAL 23 HG11 VAL 23 94.318 -9.488 4.873 178 HG12 VAL 23 HG12 VAL 23 94.181 -7.820 5.479 179 HG13 VAL 23 HG13 VAL 23 95.478 -8.248 4.337 180 HG21 VAL 23 HG21 VAL 23 97.178 -7.353 5.932 181 HG22 VAL 23 HG22 VAL 23 95.881 -6.925 7.073 182 HG23 VAL 23 HG23 VAL 23 97.232 -7.956 7.606 183 H ASN 24 H ASN 24 92.480 -9.726 6.903 184 HA ASN 24 HA ASN 24 92.102 -12.518 7.293 185 HB2 ASN 24 HB2 ASN 24 90.805 -10.483 5.462 186 HB3 ASN 24 HB3 ASN 24 90.324 -12.195 5.388 187 HD21 ASN 24 HD21 ASN 24 88.334 -12.249 6.483 188 HD22 ASN 24 HD22 ASN 24 88.093 -11.613 8.095 189 H ILE 25 H ILE 25 91.567 -14.056 5.317 190 HA ILE 25 HA ILE 25 94.108 -14.216 3.775 191 HB ILE 25 HB ILE 25 91.759 -16.027 4.295 192 HG12 ILE 25 HG12 ILE 25 94.029 -15.849 5.596 193 HG13 ILE 25 HG13 ILE 25 93.404 -17.461 5.179 194 HG21 ILE 25 HG21 ILE 25 92.765 -17.622 2.590 195 HG22 ILE 25 HG22 ILE 25 91.933 -16.211 1.895 196 HG23 ILE 25 HG23 ILE 25 93.712 -16.249 1.969 197 HD11 ILE 25 HD11 ILE 25 95.918 -16.910 4.668 198 HD12 ILE 25 HD12 ILE 25 94.956 -17.749 3.427 199 HD13 ILE 25 HD13 ILE 25 95.264 -16.001 3.285 200 H VAL 26 H VAL 26 91.262 -12.640 3.422 201 HA VAL 26 HA VAL 26 90.806 -13.140 0.547 202 HB VAL 26 HB VAL 26 89.797 -10.927 2.390 203 HG11 VAL 26 HG11 VAL 26 89.723 -10.304 -0.009 204 HG12 VAL 26 HG12 VAL 26 88.086 -10.589 0.628 205 HG13 VAL 26 HG13 VAL 26 88.877 -11.826 -0.378 206 HG21 VAL 26 HG21 VAL 26 87.721 -12.285 2.426 207 HG22 VAL 26 HG22 VAL 26 88.513 -13.521 1.420 208 HG23 VAL 26 HG23 VAL 26 89.099 -13.208 3.071 209 H LYS 27 H LYS 27 91.832 -10.224 2.397 210 HA LYS 27 HA LYS 27 92.824 -8.879 0.018 211 HB2 LYS 27 HB3 LYS 27 93.384 -8.532 2.993 212 HB3 LYS 27 HB2 LYS 27 94.124 -7.492 1.752 213 HG2 LYS 27 HG2 LYS 27 92.218 -6.250 2.230 214 HG3 LYS 27 HG3 LYS 27 91.591 -7.280 0.921 215 HD2 LYS 27 HD2 LYS 27 90.751 -8.897 2.630 216 HD3 LYS 27 HD3 LYS 27 91.324 -7.808 3.916 217 HE2 LYS 27 HE3 LYS 27 89.887 -5.993 2.690 218 HE3 LYS 27 HE2 LYS 27 89.087 -7.382 1.917 219 HZ1 LYS 27 HZ1 LYS 27 87.977 -6.734 3.951 220 HZ2 LYS 27 HZ2 LYS 27 89.356 -6.959 4.827 221 HZ3 LYS 27 HZ3 LYS 27 88.614 -8.247 4.111 222 H ARG 28 H ARG 28 94.058 -11.383 2.074 223 HA ARG 28 HA ARG 28 96.894 -10.966 1.464 224 HB2 ARG 28 HB2 ARG 28 95.730 -12.378 3.370 225 HB3 ARG 28 HB3 ARG 28 95.712 -13.665 2.140 226 HG2 ARG 28 HG2 ARG 28 98.178 -13.315 1.810 227 HG3 ARG 28 HG3 ARG 28 98.154 -12.142 3.149 228 HD2 ARG 28 HD2 ARG 28 98.771 -14.134 4.238 229 HD3 ARG 28 HD3 ARG 28 97.009 -14.094 4.490 230 HE ARG 28 HE ARG 28 97.161 -15.533 2.160 231 HH11 ARG 28 HH11 ARG 28 97.587 -17.749 2.036 232 HH12 ARG 28 HH12 ARG 28 98.513 -18.534 3.295 233 HH21 ARG 28 HH21 ARG 28 98.954 -15.616 5.144 234 HH22 ARG 28 HH22 ARG 28 99.284 -17.331 5.047 235 H LYS 29 H LYS 29 94.301 -13.063 0.125 236 HA LYS 29 HA LYS 29 96.081 -14.314 -1.827 237 HB2 LYS 29 HB2 LYS 29 93.857 -15.245 -1.045 238 HB3 LYS 29 HB3 LYS 29 93.056 -13.974 -2.000 239 HG2 LYS 29 HG2 LYS 29 93.101 -15.720 -3.549 240 HG3 LYS 29 HG3 LYS 29 94.626 -14.890 -3.941 241 HD2 LYS 29 HD2 LYS 29 95.885 -16.466 -2.545 242 HD3 LYS 29 HD3 LYS 29 94.375 -17.254 -2.027 243 HE2 LYS 29 HE2 LYS 29 93.997 -18.209 -4.141 244 HE3 LYS 29 HE3 LYS 29 95.032 -17.022 -4.971 245 HZ1 LYS 29 HZ1 LYS 29 96.111 -19.162 -4.776 246 HZ2 LYS 29 HZ2 LYS 29 96.934 -18.031 -3.901 247 HZ3 LYS 29 HZ3 LYS 29 95.975 -19.131 -3.132 248 H LEU 30 H LEU 30 94.048 -11.408 -1.799 249 HA LEU 30 HA LEU 30 94.540 -10.965 -4.703 250 HB2 LEU 30 HB2 LEU 30 93.274 -9.044 -2.712 251 HB3 LEU 30 HB3 LEU 30 93.111 -9.041 -4.484 252 HG LEU 30 HG LEU 30 92.209 -11.349 -2.710 253 HD11 LEU 30 HD11 LEU 30 90.917 -9.296 -2.196 254 HD12 LEU 30 HD12 LEU 30 89.915 -10.479 -3.071 255 HD13 LEU 30 HD13 LEU 30 90.585 -9.071 -3.931 256 HD21 LEU 30 HD21 LEU 30 90.962 -12.003 -4.752 257 HD22 LEU 30 HD22 LEU 30 91.631 -10.594 -5.610 258 HD23 LEU 30 HD23 LEU 30 92.710 -11.905 -5.074 259 H ALA 31 H ALA 31 96.082 -10.359 -1.775 260 HA ALA 31 HA ALA 31 97.414 -7.852 -2.646 261 HB1 ALA 31 HB1 ALA 31 98.831 -8.398 -0.527 262 HB2 ALA 31 HB2 ALA 31 97.633 -9.682 -0.239 263 HB3 ALA 31 HB3 ALA 31 97.115 -7.980 -0.303 264 H ALA 32 H ALA 32 98.468 -11.232 -1.954 265 HA ALA 32 HA ALA 32 101.161 -11.070 -2.650 266 HB1 ALA 32 HB1 ALA 32 100.985 -13.395 -3.493 267 HB2 ALA 32 HB2 ALA 32 99.215 -13.227 -3.583 268 HB3 ALA 32 HB3 ALA 32 100.034 -13.179 -2.004 269 H HIS 33 H HIS 33 98.464 -11.491 -4.987 270 HA HIS 33 HA HIS 33 100.261 -11.215 -7.293 271 HB2 HIS 33 HB2 HIS 33 97.236 -10.845 -7.171 272 HB3 HIS 33 HB3 HIS 33 98.212 -11.192 -8.618 273 HD2 HIS 33 HD2 HIS 33 97.762 -13.092 -5.112 274 HE1 HIS 33 HE1 HIS 33 97.956 -15.921 -8.242 275 HE2 HIS 33 HE2 HIS 33 97.696 -15.646 -5.716 276 H ASP 34 H ASP 34 100.807 -9.086 -5.583 277 HA ASP 34 HA ASP 34 99.268 -6.703 -6.302 278 HB2 ASP 34 HB3 ASP 34 101.897 -7.249 -4.926 279 HB3 ASP 34 HB2 ASP 34 101.520 -5.592 -5.454 280 H ASN 35 H ASN 35 99.560 -5.285 -7.967 281 HA ASN 35 HA ASN 35 102.042 -5.485 -9.630 282 HB2 ASN 35 HB3 ASN 35 99.353 -5.531 -11.021 283 HB3 ASN 35 HB2 ASN 35 100.950 -6.007 -11.649 284 HD21 ASN 35 HD21 ASN 35 98.035 -7.296 -10.593 285 HD22 ASN 35 HD22 ASN 35 98.607 -8.865 -10.072 286 H LEU 36 H LEU 36 101.247 -3.449 -7.852 287 HA LEU 36 HA LEU 36 99.838 -1.373 -9.436 288 HB2 LEU 36 HB2 LEU 36 99.970 -0.017 -7.465 289 HB3 LEU 36 HB3 LEU 36 99.637 -1.672 -6.906 290 HG LEU 36 HG LEU 36 102.523 -0.939 -7.170 291 HD11 LEU 36 HD11 LEU 36 101.563 1.142 -6.220 292 HD12 LEU 36 HD12 LEU 36 100.743 0.187 -4.961 293 HD13 LEU 36 HD13 LEU 36 102.521 0.264 -5.003 294 HD21 LEU 36 HD21 LEU 36 101.205 -2.083 -4.718 295 HD22 LEU 36 HD22 LEU 36 101.251 -3.082 -6.190 296 HD23 LEU 36 HD23 LEU 36 102.767 -2.498 -5.464 297 H LYS 37 H LYS 37 100.790 0.783 -9.735 298 HA LYS 37 HA LYS 37 103.705 0.551 -10.500 299 HB2 LYS 37 HB2 LYS 37 102.018 1.074 -12.311 300 HB3 LYS 37 HB3 LYS 37 101.622 2.574 -11.439 301 HG2 LYS 37 HG2 LYS 37 104.145 3.103 -11.541 302 HG3 LYS 37 HG3 LYS 37 104.257 1.788 -12.734 303 HD2 LYS 37 HD2 LYS 37 103.872 3.596 -14.149 304 HD3 LYS 37 HD3 LYS 37 102.198 3.077 -13.839 305 HE2 LYS 37 HE3 LYS 37 102.333 4.718 -11.794 306 HE3 LYS 37 HE2 LYS 37 103.716 5.421 -12.667 307 HZ1 LYS 37 HZ1 LYS 37 101.649 6.498 -13.260 308 HZ2 LYS 37 HZ2 LYS 37 102.279 5.721 -14.571 309 HZ3 LYS 37 HZ3 LYS 37 100.997 5.069 -13.764 310 H LEU 38 H LEU 38 105.142 2.217 -9.834 311 HA LEU 38 HA LEU 38 103.972 4.244 -7.933 312 HB2 LEU 38 HB2 LEU 38 106.498 2.633 -7.370 313 HB3 LEU 38 HB3 LEU 38 105.703 3.802 -6.289 314 HG LEU 38 HG LEU 38 103.607 2.163 -6.702 315 HD11 LEU 38 HD11 LEU 38 104.861 0.675 -8.243 316 HD12 LEU 38 HD12 LEU 38 106.059 0.363 -6.964 317 HD13 LEU 38 HD13 LEU 38 104.379 -0.192 -6.765 318 HD21 LEU 38 HD21 LEU 38 104.614 2.763 -4.513 319 HD22 LEU 38 HD22 LEU 38 104.235 1.026 -4.590 320 HD23 LEU 38 HD23 LEU 38 105.914 1.580 -4.789 321 H THR 39 H THR 39 104.592 6.223 -8.590 322 HA THR 39 HA THR 39 107.015 6.457 -10.338 323 HB THR 39 HB THR 39 105.110 8.661 -9.443 324 HG1 THR 39 HG1 THR 39 104.041 8.189 -11.446 325 HG21 THR 39 HG21 THR 39 105.894 9.737 -11.534 326 HG22 THR 39 HG22 THR 39 107.259 9.376 -10.450 327 HG23 THR 39 HG23 THR 39 106.945 8.337 -11.860 328 H ILE 40 H ILE 40 108.866 6.457 -9.103 329 HA ILE 40 HA ILE 40 108.808 7.982 -6.515 330 HB ILE 40 HB ILE 40 111.236 6.484 -7.471 331 HG12 ILE 40 HG12 ILE 40 109.932 4.487 -6.205 332 HG13 ILE 40 HG13 ILE 40 108.527 5.317 -6.914 333 HG21 ILE 40 HG21 ILE 40 111.351 5.935 -5.055 334 HG22 ILE 40 HG22 ILE 40 111.216 7.692 -5.305 335 HG23 ILE 40 HG23 ILE 40 109.792 6.755 -4.795 336 HD11 ILE 40 HD11 ILE 40 110.433 3.579 -8.210 337 HD12 ILE 40 HD12 ILE 40 110.557 5.202 -8.930 338 HD13 ILE 40 HD13 ILE 40 108.991 4.358 -8.905 339 H THR 41 H THR 41 109.431 10.052 -6.564 340 HA THR 41 HA THR 41 111.578 10.826 -8.552 341 HB THR 41 HB THR 41 109.662 12.847 -7.402 342 HG1 THR 41 HG1 THR 41 108.217 11.340 -8.144 343 HG21 THR 41 HG21 THR 41 110.019 13.873 -9.630 344 HG22 THR 41 HG22 THR 41 111.570 13.540 -8.823 345 HG23 THR 41 HG23 THR 41 110.993 12.467 -10.122 346 H GLN 42 H GLN 42 113.153 12.367 -7.753 347 HA GLN 42 HA GLN 42 113.103 12.667 -4.739 348 HB2 GLN 42 HB2 GLN 42 114.696 10.910 -5.208 349 HB3 GLN 42 HB3 GLN 42 115.423 11.846 -6.535 350 HG2 GLN 42 HG3 GLN 42 116.282 13.503 -4.986 351 HG3 GLN 42 HG2 GLN 42 115.381 12.778 -3.633 352 HE21 GLN 42 HE21 GLN 42 118.010 12.938 -3.078 353 HE22 GLN 42 HE22 GLN 42 118.823 11.407 -3.310 354 H GLU 43 H GLU 43 113.975 14.627 -3.941 355 HA GLU 43 HA GLU 43 115.074 16.543 -5.972 356 HB2 GLU 43 HB3 GLU 43 112.435 16.775 -4.575 357 HB3 GLU 43 HB2 GLU 43 113.429 18.250 -4.654 358 HG2 GLU 43 HG2 GLU 43 113.030 16.564 -7.134 359 HG3 GLU 43 HG3 GLU 43 111.764 17.707 -6.625 360 H GLY 44 H GLY 44 117.006 16.015 -4.654 361 HA2 GLY 44 HA2 GLY 44 118.558 16.685 -3.005 362 HA3 GLY 44 HA3 GLY 44 117.474 18.048 -2.638 363 H ASN 45 H ASN 45 115.939 17.834 -0.963 364 HA ASN 45 HA ASN 45 116.259 15.322 0.697 365 HB2 ASN 45 HB2 ASN 45 115.523 17.192 2.544 366 HB3 ASN 45 HB3 ASN 45 117.216 16.786 2.176 367 HD21 ASN 45 HD21 ASN 45 115.302 19.427 2.655 368 HD22 ASN 45 HD22 ASN 45 116.069 20.556 1.561 369 H LYS 46 H LYS 46 114.241 16.048 -1.391 370 HA LYS 46 HA LYS 46 111.863 15.513 0.342 371 HB2 LYS 46 HB3 LYS 46 112.232 17.890 -1.496 372 HB3 LYS 46 HB2 LYS 46 110.617 17.173 -1.298 373 HG2 LYS 46 HG2 LYS 46 110.373 18.293 0.650 374 HG3 LYS 46 HG3 LYS 46 111.772 17.418 1.317 375 HD2 LYS 46 HD3 LYS 46 113.306 19.102 0.540 376 HD3 LYS 46 HD2 LYS 46 112.051 19.879 -0.456 377 HE2 LYS 46 HE3 LYS 46 110.792 20.484 1.584 378 HE3 LYS 46 HE2 LYS 46 112.020 19.680 2.591 379 HZ1 LYS 46 HZ1 LYS 46 112.407 22.049 2.439 380 HZ2 LYS 46 HZ2 LYS 46 112.509 21.972 0.795 381 HZ3 LYS 46 HZ3 LYS 46 113.647 21.226 1.727 382 H PHE 47 H PHE 47 111.326 13.613 -0.440 383 HA PHE 47 HA PHE 47 111.624 13.064 -3.373 384 HB2 PHE 47 HB2 PHE 47 111.036 11.278 -0.976 385 HB3 PHE 47 HB3 PHE 47 111.073 10.699 -2.659 386 HD1 PHE 47 HD1 PHE 47 113.167 12.762 -0.297 387 HD2 PHE 47 HD2 PHE 47 113.088 9.862 -3.465 388 HE1 PHE 47 HE1 PHE 47 115.635 12.560 -0.174 389 HE2 PHE 47 HE2 PHE 47 115.556 9.662 -3.345 390 HZ PHE 47 HZ PHE 47 116.830 11.011 -1.698 391 H THR 48 H THR 48 109.757 11.591 -4.243 392 HA THR 48 HA THR 48 107.094 12.295 -3.116 393 HB THR 48 HB THR 48 107.938 13.152 -5.923 394 HG1 THR 48 HG1 THR 48 108.703 14.545 -4.266 395 HG21 THR 48 HG21 THR 48 105.666 14.137 -6.015 396 HG22 THR 48 HG22 THR 48 105.591 12.375 -5.774 397 HG23 THR 48 HG23 THR 48 105.313 13.474 -4.402 398 H VAL 49 H VAL 49 106.456 10.199 -2.988 399 HA VAL 49 HA VAL 49 106.900 8.437 -5.389 400 HB VAL 49 HB VAL 49 105.729 7.541 -2.742 401 HG11 VAL 49 HG11 VAL 49 105.730 5.984 -4.672 402 HG12 VAL 49 HG12 VAL 49 106.839 5.423 -3.398 403 HG13 VAL 49 HG13 VAL 49 107.485 6.214 -4.856 404 HG21 VAL 49 HG21 VAL 49 108.239 6.938 -2.262 405 HG22 VAL 49 HG22 VAL 49 107.677 8.595 -1.936 406 HG23 VAL 49 HG23 VAL 49 108.597 8.243 -3.418 407 H LYS 50 H LYS 50 105.250 8.514 -6.833 408 HA LYS 50 HA LYS 50 102.477 9.011 -5.765 409 HB2 LYS 50 HB2 LYS 50 103.754 10.176 -7.869 410 HB3 LYS 50 HB3 LYS 50 102.973 8.814 -8.706 411 HG2 LYS 50 HG2 LYS 50 100.810 9.503 -7.498 412 HG3 LYS 50 HG3 LYS 50 101.656 11.004 -7.052 413 HD2 LYS 50 HD2 LYS 50 100.774 11.734 -9.048 414 HD3 LYS 50 HD3 LYS 50 102.223 10.940 -9.708 415 HE2 LYS 50 HE2 LYS 50 99.415 9.773 -9.489 416 HE3 LYS 50 HE3 LYS 50 100.311 10.153 -10.979 417 HZ1 LYS 50 HZ1 LYS 50 100.317 7.767 -10.187 418 HZ2 LYS 50 HZ2 LYS 50 101.354 8.250 -8.999 419 HZ3 LYS 50 HZ3 LYS 50 101.779 8.417 -10.584 420 H GLU 51 H GLU 51 101.721 7.014 -5.075 421 HA GLU 51 HA GLU 51 102.293 4.551 -6.565 422 HB2 GLU 51 HB2 GLU 51 100.110 5.128 -4.512 423 HB3 GLU 51 HB3 GLU 51 100.660 3.519 -5.037 424 HG2 GLU 51 HG2 GLU 51 101.922 3.799 -3.093 425 HG3 GLU 51 HG3 GLU 51 103.043 4.447 -4.314 426 H SER 52 H SER 52 100.699 3.275 -7.748 427 HA SER 52 HA SER 52 98.155 4.577 -8.492 428 HB2 SER 52 HB2 SER 52 100.023 3.997 -10.793 429 HB3 SER 52 HB3 SER 52 98.614 5.084 -10.730 430 HG SER 52 HG SER 52 101.204 5.659 -10.256 431 H SER 53 H SER 53 96.979 2.837 -8.108 432 HA SER 53 HA SER 53 97.683 0.321 -9.618 433 HB2 SER 53 HB2 SER 53 97.864 0.519 -6.883 434 HB3 SER 53 HB3 SER 53 96.167 0.016 -7.073 435 HG SER 53 HG SER 53 97.998 -1.658 -7.031 436 H ALA 54 H ALA 54 95.877 -0.718 -10.549 437 HA ALA 54 HA ALA 54 93.619 0.939 -11.194 438 HB1 ALA 54 HB1 ALA 54 92.584 -1.151 -12.040 439 HB2 ALA 54 HB2 ALA 54 93.815 -2.108 -11.182 440 HB3 ALA 54 HB3 ALA 54 94.293 -1.044 -12.526 441 H PHE 55 H PHE 55 94.382 0.019 -8.187 442 HA PHE 55 HA PHE 55 91.501 -0.529 -7.446 443 HB2 PHE 55 HB2 PHE 55 93.719 -1.143 -5.526 444 HB3 PHE 55 HB3 PHE 55 92.190 -2.007 -5.816 445 HD1 PHE 55 HD1 PHE 55 95.666 -2.177 -6.259 446 HD2 PHE 55 HD2 PHE 55 91.989 -2.968 -8.334 447 HE1 PHE 55 HE1 PHE 55 96.849 -3.768 -7.750 448 HE2 PHE 55 HE2 PHE 55 93.172 -4.558 -9.825 449 HZ PHE 55 HZ PHE 55 95.602 -4.957 -9.534 450 H ARG 56 H ARG 56 94.223 1.663 -7.010 451 HA ARG 56 HA ARG 56 92.693 3.714 -5.828 452 HB2 ARG 56 HB2 ARG 56 93.447 3.494 -3.378 453 HB3 ARG 56 HB3 ARG 56 92.149 2.396 -3.903 454 HG2 ARG 56 HG2 ARG 56 94.352 0.894 -4.522 455 HG3 ARG 56 HG3 ARG 56 94.959 1.791 -3.110 456 HD2 ARG 56 HD2 ARG 56 92.957 1.079 -1.814 457 HD3 ARG 56 HD3 ARG 56 92.384 0.155 -3.223 458 HE ARG 56 HE ARG 56 95.111 -0.612 -2.471 459 HH11 ARG 56 HH11 ARG 56 95.321 -2.650 -1.517 460 HH12 ARG 56 HH12 ARG 56 93.911 -3.465 -0.878 461 HH21 ARG 56 HH21 ARG 56 91.718 -0.902 -1.742 462 HH22 ARG 56 HH22 ARG 56 91.880 -2.480 -1.005 463 H ASN 57 H ASN 57 94.271 4.711 -7.227 464 HA ASN 57 HA ASN 57 97.120 4.536 -6.759 465 HB2 ASN 57 HB2 ASN 57 97.252 6.610 -8.094 466 HB3 ASN 57 HB3 ASN 57 96.107 5.466 -8.835 467 HD21 ASN 57 HD21 ASN 57 96.096 8.432 -9.132 468 HD22 ASN 57 HD22 ASN 57 94.558 8.967 -8.492 469 H ILE 58 H ILE 58 98.509 5.812 -5.506 470 HA ILE 58 HA ILE 58 97.182 7.805 -3.673 471 HB ILE 58 HB ILE 58 99.352 6.021 -2.606 472 HG12 ILE 58 HG12 ILE 58 96.429 5.280 -2.982 473 HG13 ILE 58 HG13 ILE 58 97.873 4.345 -3.448 474 HG21 ILE 58 HG21 ILE 58 98.168 8.129 -1.510 475 HG22 ILE 58 HG22 ILE 58 98.511 6.685 -0.527 476 HG23 ILE 58 HG23 ILE 58 96.871 6.960 -1.162 477 HD11 ILE 58 HD11 ILE 58 97.272 3.294 -1.446 478 HD12 ILE 58 HD12 ILE 58 96.698 4.808 -0.707 479 HD13 ILE 58 HD13 ILE 58 98.444 4.505 -0.873 480 H GLU 59 H GLU 59 98.968 8.976 -2.391 481 HA GLU 59 HA GLU 59 101.551 9.226 -3.842 482 HB2 GLU 59 HB3 GLU 59 101.287 11.438 -4.604 483 HB3 GLU 59 HB2 GLU 59 99.707 10.710 -4.980 484 HG2 GLU 59 HG2 GLU 59 99.060 11.531 -2.560 485 HG3 GLU 59 HG3 GLU 59 100.445 12.630 -2.765 486 H CYS 60 H CYS 60 103.145 10.088 -2.506 487 HA CYS 60 HA CYS 60 102.378 11.490 -0.010 488 HB2 CYS 60 HB2 CYS 60 103.107 8.582 -0.069 489 HB3 CYS 60 HB3 CYS 60 103.846 9.572 1.212 490 HG CYS 60 HG CYS 60 100.816 10.613 1.301 491 H VAL 61 H VAL 61 104.015 12.870 0.516 492 HA VAL 61 HA VAL 61 106.471 12.811 -1.100 493 HB VAL 61 HB VAL 61 105.809 14.990 -0.529 494 HG11 VAL 61 HG11 VAL 61 105.436 15.425 2.091 495 HG12 VAL 61 HG12 VAL 61 104.122 14.828 1.049 496 HG13 VAL 61 HG13 VAL 61 105.038 13.691 2.068 497 HG21 VAL 61 HG21 VAL 61 107.529 15.882 0.931 498 HG22 VAL 61 HG22 VAL 61 108.234 14.515 0.037 499 HG23 VAL 61 HG23 VAL 61 107.736 14.306 1.732 500 H PHE 62 H PHE 62 108.662 12.826 -0.018 501 HA PHE 62 HA PHE 62 108.714 11.317 2.561 502 HB2 PHE 62 HB2 PHE 62 108.853 9.347 1.405 503 HB3 PHE 62 HB3 PHE 62 109.350 10.148 -0.103 504 HD1 PHE 62 HD1 PHE 62 110.892 10.302 3.317 505 HD2 PHE 62 HD2 PHE 62 111.323 9.043 -0.768 506 HE1 PHE 62 HE1 PHE 62 113.252 9.688 3.755 507 HE2 PHE 62 HE2 PHE 62 113.682 8.419 -0.326 508 HZ PHE 62 HZ PHE 62 114.646 8.744 1.935 509 H GLU 63 H GLU 63 110.127 12.379 3.787 510 HA GLU 63 HA GLU 63 112.671 13.365 2.481 511 HB2 GLU 63 HB2 GLU 63 111.326 15.344 2.864 512 HB3 GLU 63 HB3 GLU 63 110.886 14.795 4.499 513 HG2 GLU 63 HG3 GLU 63 113.063 15.180 5.345 514 HG3 GLU 63 HG2 GLU 63 113.787 15.206 3.719 515 H LEU 64 H LEU 64 114.543 13.142 3.827 516 HA LEU 64 HA LEU 64 114.072 11.231 6.094 517 HB2 LEU 64 HB2 LEU 64 116.543 10.891 5.992 518 HB3 LEU 64 HB3 LEU 64 115.744 10.561 4.436 519 HG LEU 64 HG LEU 64 116.284 13.240 4.182 520 HD11 LEU 64 HD11 LEU 64 117.513 13.281 6.336 521 HD12 LEU 64 HD12 LEU 64 118.612 13.583 4.969 522 HD13 LEU 64 HD13 LEU 64 118.583 11.985 5.751 523 HD21 LEU 64 HD21 LEU 64 118.178 12.509 2.755 524 HD22 LEU 64 HD22 LEU 64 118.151 10.911 3.539 525 HD23 LEU 64 HD23 LEU 64 116.771 11.439 2.546 526 H GLY 65 H GLY 65 114.287 11.829 8.182 527 HA2 GLY 65 HA3 GLY 65 115.436 13.102 9.950 528 HA3 GLY 65 HA2 GLY 65 115.775 14.387 8.767 529 H VAL 66 H VAL 66 112.619 13.206 8.345 530 HA VAL 66 HA VAL 66 111.463 15.120 10.350 531 HB VAL 66 HB VAL 66 110.846 15.237 7.364 532 HG11 VAL 66 HG11 VAL 66 108.918 15.756 8.835 533 HG12 VAL 66 HG12 VAL 66 109.506 17.220 8.011 534 HG13 VAL 66 HG13 VAL 66 109.912 16.937 9.721 535 HG21 VAL 66 HG21 VAL 66 111.939 17.457 7.467 536 HG22 VAL 66 HG22 VAL 66 113.078 16.169 7.926 537 HG23 VAL 66 HG23 VAL 66 112.333 17.187 9.182 538 H THR 67 H THR 67 110.253 13.607 11.445 539 HA THR 67 HA THR 67 109.032 11.285 10.300 540 HB THR 67 HB THR 67 107.661 12.762 12.541 541 HG1 THR 67 HG1 THR 67 109.774 13.072 13.113 542 HG21 THR 67 HG21 THR 67 107.236 10.586 13.356 543 HG22 THR 67 HG22 THR 67 107.115 10.389 11.592 544 HG23 THR 67 HG23 THR 67 108.591 9.879 12.445 545 H PHE 68 H PHE 68 107.046 10.862 9.487 546 HA PHE 68 HA PHE 68 104.983 12.977 9.310 547 HB2 PHE 68 HB3 PHE 68 104.948 12.341 6.680 548 HB3 PHE 68 HB2 PHE 68 105.837 13.743 7.316 549 HD1 PHE 68 HD1 PHE 68 106.387 10.027 6.997 550 HD2 PHE 68 HD2 PHE 68 107.993 13.983 6.545 551 HE1 PHE 68 HE1 PHE 68 108.518 9.068 6.149 552 HE2 PHE 68 HE2 PHE 68 110.118 13.029 5.704 553 HZ PHE 68 HZ PHE 68 110.380 10.571 5.503 554 H ASN 69 H ASN 69 103.285 11.780 7.483 555 HA ASN 69 HA ASN 69 103.260 8.883 8.250 556 HB2 ASN 69 HB2 ASN 69 101.075 8.955 9.223 557 HB3 ASN 69 HB3 ASN 69 101.992 10.274 9.989 558 HD21 ASN 69 HD21 ASN 69 99.926 9.757 7.035 559 HD22 ASN 69 HD22 ASN 69 99.109 11.297 7.175 560 H CYS 70 H CYS 70 102.029 7.583 6.900 561 HA CYS 70 HA CYS 70 100.490 8.850 4.681 562 HB2 CYS 70 HB2 CYS 70 102.871 8.728 3.864 563 HB3 CYS 70 HB3 CYS 70 102.833 6.969 4.138 564 HG CYS 70 HG CYS 70 101.095 6.329 2.139 565 H ASN 71 H ASN 71 99.487 6.944 3.325 566 HA ASN 71 HA ASN 71 98.987 4.682 5.276 567 HB2 ASN 71 HB2 ASN 71 96.708 4.595 3.951 568 HB3 ASN 71 HB3 ASN 71 96.932 5.802 5.240 569 HD21 ASN 71 HD21 ASN 71 95.997 5.429 1.988 570 HD22 ASN 71 HD22 ASN 71 96.205 7.090 1.481 571 H LEU 72 H LEU 72 98.836 2.596 4.437 572 HA LEU 72 HA LEU 72 100.049 2.303 1.710 573 HB2 LEU 72 HB3 LEU 72 99.452 0.243 3.883 574 HB3 LEU 72 HB2 LEU 72 100.323 -0.078 2.364 575 HG LEU 72 HG LEU 72 101.261 2.139 4.191 576 HD11 LEU 72 HD11 LEU 72 101.952 -0.822 4.451 577 HD12 LEU 72 HD12 LEU 72 101.018 0.132 5.628 578 HD13 LEU 72 HD13 LEU 72 102.734 0.509 5.337 579 HD21 LEU 72 HD21 LEU 72 102.224 1.891 1.918 580 HD22 LEU 72 HD22 LEU 72 103.438 1.533 3.169 581 HD23 LEU 72 HD23 LEU 72 102.652 0.203 2.285 582 H ALA 73 H ALA 73 99.042 1.124 0.046 583 HA ALA 73 HA ALA 73 96.332 1.442 -0.457 584 HB1 ALA 73 HB1 ALA 73 98.450 -0.256 -1.474 585 HB2 ALA 73 HB2 ALA 73 97.019 0.377 -2.323 586 HB3 ALA 73 HB3 ALA 73 96.919 -1.164 -1.439 587 H ASP 74 H ASP 74 97.806 -1.133 1.522 588 HA ASP 74 HA ASP 74 95.469 -2.767 1.820 589 HB2 ASP 74 HB2 ASP 74 97.868 -3.214 2.648 590 HB3 ASP 74 HB3 ASP 74 97.455 -2.201 4.052 591 H GLY 75 H GLY 75 95.557 0.443 2.353 592 HA2 GLY 75 HA2 GLY 75 93.991 1.830 3.474 593 HA3 GLY 75 HA3 GLY 75 93.171 0.365 4.064 594 H THR 76 H THR 76 96.617 0.793 4.562 595 HA THR 76 HA THR 76 96.051 0.987 7.508 596 HB THR 76 HB THR 76 98.851 0.661 6.618 597 HG1 THR 76 HG1 THR 76 97.879 -0.550 4.987 598 HG21 THR 76 HG21 THR 76 98.764 -1.148 8.309 599 HG22 THR 76 HG22 THR 76 97.001 -0.942 8.437 600 HG23 THR 76 HG23 THR 76 98.089 0.368 8.954 601 H GLU 77 H GLU 77 97.488 2.402 8.783 602 HA GLU 77 HA GLU 77 98.484 4.776 7.206 603 HB2 GLU 77 HB2 GLU 77 96.177 5.108 8.327 604 HB3 GLU 77 HB3 GLU 77 97.050 5.017 9.876 605 HG2 GLU 77 HG3 GLU 77 98.519 6.876 9.159 606 HG3 GLU 77 HG2 GLU 77 97.650 6.966 7.609 607 H LEU 78 H LEU 78 100.607 5.180 7.732 608 HA LEU 78 HA LEU 78 101.471 4.415 10.528 609 HB2 LEU 78 HB2 LEU 78 103.366 3.983 8.229 610 HB3 LEU 78 HB3 LEU 78 103.288 3.159 9.804 611 HG LEU 78 HG LEU 78 100.931 2.333 8.895 612 HD11 LEU 78 HD11 LEU 78 101.342 3.836 6.794 613 HD12 LEU 78 HD12 LEU 78 102.450 2.542 6.277 614 HD13 LEU 78 HD13 LEU 78 100.726 2.185 6.541 615 HD21 LEU 78 HD21 LEU 78 102.067 0.326 7.976 616 HD22 LEU 78 HD22 LEU 78 103.594 1.235 7.882 617 HD23 LEU 78 HD23 LEU 78 102.863 0.886 9.467 618 H ARG 79 H ARG 79 103.631 5.414 11.105 619 HA ARG 79 HA ARG 79 104.302 7.867 9.524 620 HB2 ARG 79 HB2 ARG 79 103.949 9.399 11.332 621 HB3 ARG 79 HB3 ARG 79 102.464 8.423 11.234 622 HG2 ARG 79 HG2 ARG 79 103.454 6.900 13.007 623 HG3 ARG 79 HG3 ARG 79 104.778 8.075 13.190 624 HD2 ARG 79 HD3 ARG 79 102.106 9.326 13.262 625 HD3 ARG 79 HD2 ARG 79 102.356 8.140 14.565 626 HE ARG 79 HE ARG 79 103.783 10.723 14.244 627 HH11 ARG 79 HH11 ARG 79 105.184 11.210 15.948 628 HH12 ARG 79 HH12 ARG 79 105.613 9.973 17.108 629 HH21 ARG 79 HH21 ARG 79 103.683 7.510 15.581 630 HH22 ARG 79 HH22 ARG 79 104.767 7.887 16.901 631 H GLY 80 H GLY 80 106.461 8.474 9.778 632 HA2 GLY 80 HA2 GLY 80 108.143 7.941 11.986 633 HA3 GLY 80 HA3 GLY 80 108.248 6.502 10.937 634 H THR 81 H THR 81 109.852 6.624 9.448 635 HA THR 81 HA THR 81 110.132 8.740 7.566 636 HB THR 81 HB THR 81 112.528 9.277 9.069 637 HG1 THR 81 HG1 THR 81 111.646 10.079 10.961 638 HG21 THR 81 HG21 THR 81 111.622 11.607 8.976 639 HG22 THR 81 HG22 THR 81 111.541 10.775 7.404 640 HG23 THR 81 HG23 THR 81 110.073 10.952 8.394 641 H TRP 82 H TRP 82 112.072 8.554 6.249 642 HA TRP 82 HA TRP 82 113.312 5.824 6.563 643 HB2 TRP 82 HB3 TRP 82 113.593 7.570 4.105 644 HB3 TRP 82 HB2 TRP 82 113.657 5.796 4.234 645 HD1 TRP 82 HD1 TRP 82 111.064 8.620 4.824 646 HE1 TRP 82 HE1 TRP 82 108.740 7.776 4.095 647 HE3 TRP 82 HE3 TRP 82 112.320 3.855 3.501 648 HZ2 TRP 82 HZ2 TRP 82 107.593 5.329 3.067 649 HZ3 TRP 82 HZ3 TRP 82 110.600 2.288 2.650 650 HH2 TRP 82 HH2 TRP 82 108.241 3.018 2.431 651 H SER 83 H SER 83 115.562 5.592 6.588 652 HA SER 83 HA SER 83 117.190 8.120 6.510 653 HB2 SER 83 HB3 SER 83 118.398 6.900 8.593 654 HB3 SER 83 HB2 SER 83 117.063 8.056 8.822 655 HG SER 83 HG SER 83 115.711 6.429 9.267 656 H LEU 84 H LEU 84 119.532 7.606 6.167 657 HA LEU 84 HA LEU 84 119.710 5.056 4.631 658 HB2 LEU 84 HB2 LEU 84 120.894 6.488 3.324 659 HB3 LEU 84 HB3 LEU 84 121.093 7.661 4.646 660 HG LEU 84 HG LEU 84 122.870 6.139 5.612 661 HD11 LEU 84 HD11 LEU 84 123.430 4.818 3.066 662 HD12 LEU 84 HD12 LEU 84 121.833 4.347 3.697 663 HD13 LEU 84 HD13 LEU 84 123.289 4.115 4.695 664 HD21 LEU 84 HD21 LEU 84 124.594 6.817 3.964 665 HD22 LEU 84 HD22 LEU 84 123.436 8.136 4.258 666 HD23 LEU 84 HD23 LEU 84 123.318 7.163 2.772 667 H GLU 85 H GLU 85 120.617 3.260 5.461 668 HA GLU 85 HA GLU 85 122.362 3.569 7.910 669 HB2 GLU 85 HB3 GLU 85 120.669 2.480 8.993 670 HB3 GLU 85 HB2 GLU 85 119.892 1.993 7.469 671 HG2 GLU 85 HG3 GLU 85 121.363 0.105 7.219 672 HG3 GLU 85 HG2 GLU 85 122.423 0.677 8.530 673 H GLY 86 H GLY 86 124.382 2.794 7.495 674 HA2 GLY 86 HA2 GLY 86 126.093 1.604 6.365 675 HA3 GLY 86 HA3 GLY 86 124.907 0.282 6.218 676 H ASN 87 H ASN 87 124.125 -0.169 4.193 677 HA ASN 87 HA ASN 87 124.515 1.980 2.096 678 HB2 ASN 87 HB3 ASN 87 125.141 -0.979 2.025 679 HB3 ASN 87 HB2 ASN 87 124.750 -0.108 0.524 680 HD21 ASN 87 HD21 ASN 87 126.213 1.901 2.943 681 HD22 ASN 87 HD22 ASN 87 127.829 1.899 2.273 682 H LYS 88 H LYS 88 122.093 1.396 3.705 683 HA LYS 88 HA LYS 88 120.305 0.780 1.363 684 HB2 LYS 88 HB3 LYS 88 119.761 -0.386 4.119 685 HB3 LYS 88 HB2 LYS 88 118.969 -0.786 2.577 686 HG2 LYS 88 HG2 LYS 88 120.424 -2.573 2.684 687 HG3 LYS 88 HG3 LYS 88 121.511 -1.399 1.903 688 HD2 LYS 88 HD3 LYS 88 122.392 -0.750 4.140 689 HD3 LYS 88 HD2 LYS 88 121.330 -1.960 4.898 690 HE2 LYS 88 HE3 LYS 88 122.507 -3.580 3.124 691 HE3 LYS 88 HE2 LYS 88 123.796 -2.356 3.219 692 HZ1 LYS 88 HZ1 LYS 88 124.088 -4.084 4.865 693 HZ2 LYS 88 HZ2 LYS 88 122.606 -3.774 5.519 694 HZ3 LYS 88 HZ3 LYS 88 123.800 -2.639 5.607 695 H LEU 89 H LEU 89 118.082 1.572 1.696 696 HA LEU 89 HA LEU 89 118.103 3.984 3.498 697 HB2 LEU 89 HB2 LEU 89 116.218 3.150 1.246 698 HB3 LEU 89 HB3 LEU 89 116.093 4.661 2.178 699 HG LEU 89 HG LEU 89 118.703 3.951 0.830 700 HD11 LEU 89 HD11 LEU 89 116.957 3.694 -0.914 701 HD12 LEU 89 HD12 LEU 89 117.934 5.154 -1.199 702 HD13 LEU 89 HD13 LEU 89 116.304 5.296 -0.497 703 HD21 LEU 89 HD21 LEU 89 118.573 5.869 2.398 704 HD22 LEU 89 HD22 LEU 89 117.247 6.565 1.436 705 HD23 LEU 89 HD23 LEU 89 118.876 6.424 0.734 706 H ILE 90 H ILE 90 117.356 3.485 5.526 707 HA ILE 90 HA ILE 90 115.465 1.260 5.897 708 HB ILE 90 HB ILE 90 115.381 2.437 8.293 709 HG12 ILE 90 HG13 ILE 90 118.039 3.373 7.157 710 HG13 ILE 90 HG12 ILE 90 116.631 4.441 7.386 711 HG21 ILE 90 HG21 ILE 90 116.319 0.204 7.762 712 HG22 ILE 90 HG22 ILE 90 117.371 1.093 8.889 713 HG23 ILE 90 HG23 ILE 90 117.809 0.973 7.168 714 HD11 ILE 90 HD11 ILE 90 117.919 2.754 9.569 715 HD12 ILE 90 HD12 ILE 90 118.199 4.495 9.329 716 HD13 ILE 90 HD13 ILE 90 116.579 3.907 9.775 717 H GLY 91 H GLY 91 113.427 1.550 7.090 718 HA2 GLY 91 HA3 GLY 91 112.065 4.180 6.675 719 HA3 GLY 91 HA2 GLY 91 111.389 2.774 5.815 720 H LYS 92 H LYS 92 111.784 4.343 8.906 721 HA LYS 92 HA LYS 92 110.586 2.015 10.346 722 HB2 LYS 92 HB2 LYS 92 110.951 3.305 12.360 723 HB3 LYS 92 HB3 LYS 92 112.408 3.477 11.353 724 HG2 LYS 92 HG3 LYS 92 111.057 5.585 10.400 725 HG3 LYS 92 HG2 LYS 92 110.271 5.494 11.994 726 HD2 LYS 92 HD2 LYS 92 112.824 5.226 12.803 727 HD3 LYS 92 HD3 LYS 92 113.124 6.125 11.296 728 HE2 LYS 92 HE2 LYS 92 111.684 6.987 13.790 729 HE3 LYS 92 HE3 LYS 92 112.788 7.908 12.741 730 HZ1 LYS 92 HZ1 LYS 92 111.087 8.122 11.136 731 HZ2 LYS 92 HZ2 LYS 92 110.413 8.548 12.580 732 HZ3 LYS 92 HZ3 LYS 92 110.083 7.073 11.919 733 H PHE 93 H PHE 93 108.444 1.773 9.905 734 HA PHE 93 HA PHE 93 106.744 4.273 10.048 735 HB2 PHE 93 HB2 PHE 93 106.664 1.853 8.261 736 HB3 PHE 93 HB3 PHE 93 105.122 2.615 8.710 737 HD1 PHE 93 HD1 PHE 93 107.499 5.177 8.876 738 HD2 PHE 93 HD2 PHE 93 105.400 2.772 6.000 739 HE1 PHE 93 HE1 PHE 93 107.862 6.919 7.151 740 HE2 PHE 93 HE2 PHE 93 105.762 4.517 4.278 741 HZ PHE 93 HZ PHE 93 106.996 6.590 4.852 742 H LYS 94 H LYS 94 105.382 4.346 11.697 743 HA LYS 94 HA LYS 94 104.749 1.756 13.118 744 HB2 LYS 94 HB2 LYS 94 104.936 4.643 14.038 745 HB3 LYS 94 HB3 LYS 94 104.050 3.425 14.987 746 HG2 LYS 94 HG3 LYS 94 106.053 2.035 15.160 747 HG3 LYS 94 HG2 LYS 94 106.948 3.131 14.081 748 HD2 LYS 94 HD2 LYS 94 106.315 4.973 15.841 749 HD3 LYS 94 HD3 LYS 94 106.023 3.592 16.926 750 HE2 LYS 94 HE3 LYS 94 108.589 4.619 15.779 751 HE3 LYS 94 HE2 LYS 94 108.269 3.864 17.359 752 HZ1 LYS 94 HZ1 LYS 94 109.472 2.305 16.133 753 HZ2 LYS 94 HZ2 LYS 94 107.916 1.767 16.043 754 HZ3 LYS 94 HZ3 LYS 94 108.598 2.538 14.754 755 H ARG 95 H ARG 95 102.739 0.997 12.704 756 HA ARG 95 HA ARG 95 100.752 2.270 11.178 757 HB2 ARG 95 HB2 ARG 95 100.524 0.282 13.465 758 HB3 ARG 95 HB3 ARG 95 99.102 0.822 12.542 759 HG2 ARG 95 HG2 ARG 95 100.358 0.149 10.426 760 HG3 ARG 95 HG3 ARG 95 101.572 -0.612 11.483 761 HD2 ARG 95 HD3 ARG 95 99.922 -2.289 10.768 762 HD3 ARG 95 HD2 ARG 95 99.762 -1.993 12.516 763 HE ARG 95 HE ARG 95 97.965 -0.197 11.215 764 HH11 ARG 95 HH11 ARG 95 95.789 -0.773 11.021 765 HH12 ARG 95 HH12 ARG 95 95.317 -2.455 11.118 766 HH21 ARG 95 HH21 ARG 95 98.569 -3.606 11.587 767 HH22 ARG 95 HH22 ARG 95 96.884 -4.052 11.437 768 H THR 96 H THR 96 99.847 4.230 11.480 769 HA THR 96 HA THR 96 99.704 5.410 14.195 770 HB THR 96 HB THR 96 98.195 7.007 12.456 771 HG1 THR 96 HG1 THR 96 99.487 7.017 10.559 772 HG21 THR 96 HG21 THR 96 100.228 8.418 12.425 773 HG22 THR 96 HG22 THR 96 99.942 7.745 14.047 774 HG23 THR 96 HG23 THR 96 101.195 7.039 12.999 775 H ASP 97 H ASP 97 97.882 3.363 12.330 776 HA ASP 97 HA ASP 97 95.242 4.224 13.428 777 HB2 ASP 97 HB2 ASP 97 95.481 3.420 11.057 778 HB3 ASP 97 HB3 ASP 97 95.954 1.823 11.685 779 H ASN 98 H ASN 98 97.774 1.848 13.993 780 HA ASN 98 HA ASN 98 96.091 0.790 16.269 781 HB2 ASN 98 HB2 ASN 98 96.148 -0.862 14.389 782 HB3 ASN 98 HB3 ASN 98 97.926 -0.863 14.474 783 HD21 ASN 98 HD21 ASN 98 95.282 -0.990 16.975 784 HD22 ASN 98 HD22 ASN 98 95.941 -2.390 17.792 785 H GLY 99 H GLY 99 98.774 2.489 15.403 786 HA2 GLY 99 HA2 GLY 99 100.824 2.936 16.497 787 HA3 GLY 99 HA3 GLY 99 99.965 2.468 17.985 788 H ASN 100 H ASN 100 100.828 0.529 15.090 789 HA ASN 100 HA ASN 100 101.939 -1.544 16.922 790 HB2 ASN 100 HB3 ASN 100 100.442 -2.082 14.935 791 HB3 ASN 100 HB2 ASN 100 101.776 -1.561 13.878 792 HD21 ASN 100 HD21 ASN 100 101.133 -3.817 16.653 793 HD22 ASN 100 HD22 ASN 100 102.254 -5.039 16.095 794 H GLU 101 H GLU 101 103.468 -1.913 14.105 795 HA GLU 101 HA GLU 101 105.611 0.028 14.211 796 HB2 GLU 101 HB2 GLU 101 107.260 -1.003 15.483 797 HB3 GLU 101 HB3 GLU 101 105.813 -1.480 16.401 798 HG2 GLU 101 HG2 GLU 101 105.757 -3.585 14.912 799 HG3 GLU 101 HG3 GLU 101 107.401 -3.132 14.401 800 H LEU 102 H LEU 102 106.861 -0.172 12.375 801 HA LEU 102 HA LEU 102 106.891 -2.825 10.974 802 HB2 LEU 102 HB3 LEU 102 104.940 -1.485 10.078 803 HB3 LEU 102 HB2 LEU 102 106.100 -0.235 9.568 804 HG LEU 102 HG LEU 102 106.503 -3.121 8.745 805 HD11 LEU 102 HD11 LEU 102 105.231 -2.644 6.670 806 HD12 LEU 102 HD12 LEU 102 104.772 -1.052 7.319 807 HD13 LEU 102 HD13 LEU 102 104.184 -2.537 8.105 808 HD21 LEU 102 HD21 LEU 102 107.239 -1.458 6.664 809 HD22 LEU 102 HD22 LEU 102 108.346 -2.049 7.926 810 HD23 LEU 102 HD23 LEU 102 107.596 -0.442 8.081 811 H ASN 103 H ASN 103 108.997 -3.217 10.515 812 HA ASN 103 HA ASN 103 110.795 -0.807 10.170 813 HB2 ASN 103 HB3 ASN 103 112.000 -3.515 10.489 814 HB3 ASN 103 HB2 ASN 103 112.456 -1.968 11.242 815 HD21 ASN 103 HD21 ASN 103 109.864 -1.299 12.375 816 HD22 ASN 103 HD22 ASN 103 109.540 -2.456 13.646 817 H THR 104 H THR 104 110.963 -0.357 8.007 818 HA THR 104 HA THR 104 111.346 -2.748 6.191 819 HB THR 104 HB THR 104 109.211 -1.741 5.698 820 HG1 THR 104 HG1 THR 104 109.909 -1.995 3.709 821 HG21 THR 104 HG21 THR 104 109.273 0.787 5.028 822 HG22 THR 104 HG22 THR 104 109.284 0.370 6.758 823 HG23 THR 104 HG23 THR 104 110.798 0.829 5.943 824 H VAL 105 H VAL 105 112.318 -1.971 4.017 825 HA VAL 105 HA VAL 105 114.344 0.199 4.365 826 HB VAL 105 HB VAL 105 115.130 -2.657 3.635 827 HG11 VAL 105 HG11 VAL 105 117.436 -1.435 4.245 828 HG12 VAL 105 HG12 VAL 105 116.740 -1.339 2.610 829 HG13 VAL 105 HG13 VAL 105 116.518 0.008 3.752 830 HG21 VAL 105 HG21 VAL 105 116.251 -2.699 5.835 831 HG22 VAL 105 HG22 VAL 105 114.502 -2.436 6.034 832 HG23 VAL 105 HG23 VAL 105 115.631 -1.070 6.193 833 H ARG 106 H ARG 106 115.378 0.719 2.245 834 HA ARG 106 HA ARG 106 113.813 -0.393 -0.087 835 HB2 ARG 106 HB2 ARG 106 113.174 2.022 0.934 836 HB3 ARG 106 HB3 ARG 106 114.530 2.520 -0.105 837 HG2 ARG 106 HG2 ARG 106 113.466 1.502 -2.057 838 HG3 ARG 106 HG3 ARG 106 112.159 0.845 -1.042 839 HD2 ARG 106 HD3 ARG 106 112.694 3.809 -0.962 840 HD3 ARG 106 HD2 ARG 106 111.838 3.136 -2.370 841 HE ARG 106 HE ARG 106 110.680 2.147 0.124 842 HH11 ARG 106 HH11 ARG 106 108.667 3.005 0.683 843 HH12 ARG 106 HH12 ARG 106 108.107 4.484 -0.065 844 HH21 ARG 106 HH21 ARG 106 110.957 4.870 -2.029 845 HH22 ARG 106 HH22 ARG 106 109.398 5.535 -1.594 846 H GLU 107 H GLU 107 115.050 -0.775 -1.896 847 HA GLU 107 HA GLU 107 117.747 0.526 -2.068 848 HB2 GLU 107 HB2 GLU 107 118.811 -1.711 -2.535 849 HB3 GLU 107 HB3 GLU 107 118.249 -1.525 -0.857 850 HG2 GLU 107 HG3 GLU 107 116.145 -2.719 -1.453 851 HG3 GLU 107 HG2 GLU 107 116.763 -2.949 -3.106 852 H ILE 108 H ILE 108 118.700 0.253 -4.246 853 HA ILE 108 HA ILE 108 116.566 -0.368 -6.292 854 HB ILE 108 HB ILE 108 118.852 1.609 -6.619 855 HG12 ILE 108 HG12 ILE 108 116.378 1.836 -5.036 856 HG13 ILE 108 HG13 ILE 108 117.788 2.917 -5.091 857 HG21 ILE 108 HG21 ILE 108 117.655 0.639 -8.616 858 HG22 ILE 108 HG22 ILE 108 116.149 1.352 -7.990 859 HG23 ILE 108 HG23 ILE 108 117.502 2.406 -8.467 860 HD11 ILE 108 HD11 ILE 108 115.865 4.164 -5.886 861 HD12 ILE 108 HD12 ILE 108 115.428 2.863 -7.018 862 HD13 ILE 108 HD13 ILE 108 116.905 3.819 -7.289 863 H ILE 109 H ILE 109 117.402 -2.543 -6.312 864 HA ILE 109 HA ILE 109 120.194 -3.125 -6.794 865 HB ILE 109 HB ILE 109 117.621 -4.664 -7.292 866 HG12 ILE 109 HG13 ILE 109 119.971 -5.139 -5.405 867 HG13 ILE 109 HG12 ILE 109 118.481 -4.278 -4.948 868 HG21 ILE 109 HG21 ILE 109 119.376 -6.622 -7.556 869 HG22 ILE 109 HG22 ILE 109 118.967 -5.613 -8.964 870 HG23 ILE 109 HG23 ILE 109 120.472 -5.314 -8.063 871 HD11 ILE 109 HD11 ILE 109 118.923 -7.194 -5.479 872 HD12 ILE 109 HD12 ILE 109 117.373 -6.502 -6.016 873 HD13 ILE 109 HD13 ILE 109 117.847 -6.401 -4.303 874 H GLY 110 H GLY 110 120.939 -1.752 -8.422 875 HA2 GLY 110 HA2 GLY 110 121.242 -0.993 -10.644 876 HA3 GLY 110 HA3 GLY 110 121.059 -2.716 -11.042 877 H ASP 111 H ASP 111 118.820 -3.508 -11.456 878 HA ASP 111 HA ASP 111 117.100 -1.254 -12.513 879 HB2 ASP 111 HB3 ASP 111 116.296 -3.154 -14.133 880 HB3 ASP 111 HB2 ASP 111 117.849 -2.345 -14.449 881 H GLU 112 H GLU 112 116.961 -2.599 -9.834 882 HA GLU 112 HA GLU 112 114.068 -3.347 -10.086 883 HB2 GLU 112 HB2 GLU 112 115.659 -5.060 -8.227 884 HB3 GLU 112 HB3 GLU 112 114.257 -5.475 -9.241 885 HG2 GLU 112 HG3 GLU 112 115.726 -5.394 -11.259 886 HG3 GLU 112 HG2 GLU 112 117.121 -5.055 -10.207 887 H LEU 113 H LEU 113 112.882 -2.441 -8.442 888 HA LEU 113 HA LEU 113 114.470 -1.084 -6.267 889 HB2 LEU 113 HB2 LEU 113 112.463 -0.094 -7.814 890 HB3 LEU 113 HB3 LEU 113 111.499 -0.746 -6.468 891 HG LEU 113 HG LEU 113 113.939 0.845 -5.751 892 HD11 LEU 113 HD11 LEU 113 111.808 1.861 -7.483 893 HD12 LEU 113 HD12 LEU 113 111.859 2.739 -5.935 894 HD13 LEU 113 HD13 LEU 113 113.312 2.657 -6.960 895 HD21 LEU 113 HD21 LEU 113 112.454 -0.171 -4.043 896 HD22 LEU 113 HD22 LEU 113 111.071 0.727 -4.713 897 HD23 LEU 113 HD23 LEU 113 112.417 1.606 -3.948 898 H VAL 114 H VAL 114 114.713 -2.320 -4.432 899 HA VAL 114 HA VAL 114 112.472 -4.268 -3.871 900 HB VAL 114 HB VAL 114 115.178 -4.384 -2.533 901 HG11 VAL 114 HG11 VAL 114 113.341 -5.859 -1.754 902 HG12 VAL 114 HG12 VAL 114 113.141 -6.481 -3.409 903 HG13 VAL 114 HG13 VAL 114 114.645 -6.804 -2.513 904 HG21 VAL 114 HG21 VAL 114 115.704 -6.043 -4.486 905 HG22 VAL 114 HG22 VAL 114 115.903 -4.299 -4.779 906 HG23 VAL 114 HG23 VAL 114 114.454 -5.142 -5.377 907 H GLN 115 H GLN 115 111.079 -3.531 -2.419 908 HA GLN 115 HA GLN 115 112.167 -1.883 -0.128 909 HB2 GLN 115 HB2 GLN 115 110.344 -0.897 -1.654 910 HB3 GLN 115 HB3 GLN 115 109.256 -2.140 -0.991 911 HG2 GLN 115 HG3 GLN 115 109.474 -1.278 1.236 912 HG3 GLN 115 HG2 GLN 115 110.852 -0.248 0.779 913 HE21 GLN 115 HE21 GLN 115 109.987 1.024 -1.532 914 HE22 GLN 115 HE22 GLN 115 108.545 1.956 -1.200 915 H THR 116 H THR 116 112.628 -3.353 1.486 916 HA THR 116 HA THR 116 110.705 -5.639 1.848 917 HB THR 116 HB THR 116 113.162 -5.379 3.538 918 HG1 THR 116 HG1 THR 116 114.025 -4.777 1.572 919 HG21 THR 116 HG21 THR 116 113.271 -7.818 3.004 920 HG22 THR 116 HG22 THR 116 111.703 -7.347 3.703 921 HG23 THR 116 HG23 THR 116 111.848 -7.628 1.951 922 H TYR 117 H TYR 117 109.646 -5.998 3.809 923 HA TYR 117 HA TYR 117 109.948 -3.797 5.855 924 HB2 TYR 117 HB2 TYR 117 107.233 -5.007 5.479 925 HB3 TYR 117 HB3 TYR 117 107.687 -3.361 5.981 926 HD1 TYR 117 HD1 TYR 117 108.107 -5.621 3.038 927 HD2 TYR 117 HD2 TYR 117 107.277 -1.661 4.446 928 HE1 TYR 117 HE1 TYR 117 107.785 -4.865 0.700 929 HE2 TYR 117 HE2 TYR 117 106.951 -0.891 2.111 930 HH TYR 117 HH TYR 117 106.227 -2.326 -0.233 931 H VAL 118 H VAL 118 109.712 -4.408 7.951 932 HA VAL 118 HA VAL 118 109.532 -7.390 8.425 933 HB VAL 118 HB VAL 118 110.693 -5.328 10.330 934 HG11 VAL 118 HG11 VAL 118 111.384 -7.146 11.590 935 HG12 VAL 118 HG12 VAL 118 111.515 -8.214 10.173 936 HG13 VAL 118 HG13 VAL 118 109.917 -7.840 10.860 937 HG21 VAL 118 HG21 VAL 118 112.626 -7.039 8.923 938 HG22 VAL 118 HG22 VAL 118 112.667 -5.285 9.222 939 HG23 VAL 118 HG23 VAL 118 111.769 -5.929 7.827 940 H TYR 119 H TYR 119 108.226 -8.090 10.126 941 HA TYR 119 HA TYR 119 106.633 -5.981 11.511 942 HB2 TYR 119 HB3 TYR 119 105.623 -6.955 9.198 943 HB3 TYR 119 HB2 TYR 119 105.007 -8.182 10.331 944 HD1 TYR 119 HD1 TYR 119 103.677 -7.475 12.306 945 HD2 TYR 119 HD2 TYR 119 104.748 -4.719 9.199 946 HE1 TYR 119 HE1 TYR 119 101.913 -5.918 13.085 947 HE2 TYR 119 HE2 TYR 119 102.992 -3.150 9.981 948 HH TYR 119 HH TYR 119 101.174 -3.725 12.945 949 H GLU 120 H GLU 120 106.901 -6.496 13.547 950 HA GLU 120 HA GLU 120 107.041 -7.757 15.524 951 HB2 GLU 120 HB2 GLU 120 104.845 -9.070 13.931 952 HB3 GLU 120 HB3 GLU 120 105.368 -9.808 15.464 953 HG2 GLU 120 HG3 GLU 120 104.653 -6.859 15.219 954 HG3 GLU 120 HG2 GLU 120 103.455 -8.107 15.637 955 H GLY 121 H GLY 121 108.631 -8.629 12.986 956 HA2 GLY 121 HA3 GLY 121 110.584 -10.146 13.376 957 HA3 GLY 121 HA2 GLY 121 109.476 -11.267 14.206 958 H VAL 122 H VAL 122 108.512 -9.544 11.318 959 HA VAL 122 HA VAL 122 108.787 -12.131 9.786 960 HB VAL 122 HB VAL 122 106.392 -11.079 10.479 961 HG11 VAL 122 HG11 VAL 122 106.774 -9.933 7.707 962 HG12 VAL 122 HG12 VAL 122 105.510 -9.574 8.908 963 HG13 VAL 122 HG13 VAL 122 107.163 -8.956 9.143 964 HG21 VAL 122 HG21 VAL 122 105.474 -12.262 8.506 965 HG22 VAL 122 HG22 VAL 122 106.788 -13.192 9.266 966 HG23 VAL 122 HG23 VAL 122 107.094 -12.281 7.768 967 H GLU 123 H GLU 123 108.558 -11.483 7.311 968 HA GLU 123 HA GLU 123 109.778 -8.827 6.809 969 HB2 GLU 123 HB3 GLU 123 111.854 -9.624 5.906 970 HB3 GLU 123 HB2 GLU 123 111.671 -10.381 7.506 971 HG2 GLU 123 HG2 GLU 123 110.471 -12.296 6.098 972 HG3 GLU 123 HG3 GLU 123 111.433 -11.614 4.765 973 H ALA 124 H ALA 124 108.572 -8.150 5.132 974 HA ALA 124 HA ALA 124 107.893 -10.165 2.988 975 HB1 ALA 124 HB1 ALA 124 106.578 -7.659 2.544 976 HB2 ALA 124 HB2 ALA 124 105.847 -9.207 3.032 977 HB3 ALA 124 HB3 ALA 124 106.399 -8.054 4.270 978 H LYS 125 H LYS 125 108.171 -9.436 0.720 979 HA LYS 125 HA LYS 125 110.147 -7.167 0.505 980 HB2 LYS 125 HB2 LYS 125 111.141 -9.595 0.476 981 HB3 LYS 125 HB3 LYS 125 110.459 -9.666 -1.166 982 HG2 LYS 125 HG2 LYS 125 111.809 -7.865 -1.928 983 HG3 LYS 125 HG3 LYS 125 112.189 -7.336 -0.271 984 HD2 LYS 125 HD3 LYS 125 114.064 -8.589 -1.466 985 HD3 LYS 125 HD2 LYS 125 113.588 -9.264 0.111 986 HE2 LYS 125 HE2 LYS 125 112.292 -11.008 -0.934 987 HE3 LYS 125 HE3 LYS 125 112.437 -10.242 -2.534 988 HZ1 LYS 125 HZ1 LYS 125 113.992 -12.058 -2.274 989 HZ2 LYS 125 HZ2 LYS 125 114.673 -11.344 -0.952 990 HZ3 LYS 125 HZ3 LYS 125 114.808 -10.634 -2.435 991 H ARG 126 H ARG 126 109.824 -5.840 -1.181 992 HA ARG 126 HA ARG 126 107.838 -6.717 -3.292 993 HB2 ARG 126 HB2 ARG 126 108.144 -4.005 -1.926 994 HB3 ARG 126 HB3 ARG 126 107.142 -4.285 -3.371 995 HG2 ARG 126 HG3 ARG 126 106.778 -6.037 -0.933 996 HG3 ARG 126 HG2 ARG 126 106.042 -4.417 -0.971 997 HD2 ARG 126 HD3 ARG 126 105.609 -5.871 -3.483 998 HD3 ARG 126 HD2 ARG 126 104.961 -6.758 -2.082 999 HE ARG 126 HE ARG 126 103.894 -4.371 -1.520 1000 HH11 ARG 126 HH11 ARG 126 102.157 -3.332 -2.515 1001 HH12 ARG 126 HH12 ARG 126 101.814 -3.621 -4.206 1002 HH21 ARG 126 HH21 ARG 126 104.453 -5.849 -4.629 1003 HH22 ARG 126 HH22 ARG 126 103.106 -5.038 -5.395 1004 H ILE 127 H ILE 127 108.919 -6.855 -5.208 1005 HA ILE 127 HA ILE 127 111.307 -5.029 -5.563 1006 HB ILE 127 HB ILE 127 110.678 -7.587 -7.087 1007 HG12 ILE 127 HG12 ILE 127 112.810 -7.494 -4.980 1008 HG13 ILE 127 HG13 ILE 127 111.122 -7.603 -4.423 1009 HG21 ILE 127 HG21 ILE 127 112.243 -5.997 -8.173 1010 HG22 ILE 127 HG22 ILE 127 113.088 -7.471 -7.642 1011 HG23 ILE 127 HG23 ILE 127 113.237 -5.970 -6.697 1012 HD11 ILE 127 HD11 ILE 127 112.103 -9.859 -4.740 1013 HD12 ILE 127 HD12 ILE 127 112.456 -9.466 -6.440 1014 HD13 ILE 127 HD13 ILE 127 110.768 -9.575 -5.884 1015 H PHE 128 H PHE 128 111.088 -3.415 -7.020 1016 HA PHE 128 HA PHE 128 108.839 -3.630 -9.012 1017 HB2 PHE 128 HB2 PHE 128 110.631 -1.236 -8.399 1018 HB3 PHE 128 HB3 PHE 128 109.156 -1.231 -9.388 1019 HD1 PHE 128 HD1 PHE 128 108.110 -3.415 -7.094 1020 HD2 PHE 128 HD2 PHE 128 109.352 0.687 -7.223 1021 HE1 PHE 128 HE1 PHE 128 106.728 -2.938 -5.093 1022 HE2 PHE 128 HE2 PHE 128 107.980 1.168 -5.211 1023 HZ PHE 128 HZ PHE 128 106.662 -0.646 -4.149 1024 H LYS 129 H LYS 129 109.474 -2.441 -11.171 1025 HA LYS 129 HA LYS 129 112.280 -2.910 -12.025 1026 HB2 LYS 129 HB2 LYS 129 110.964 -5.148 -12.201 1027 HB3 LYS 129 HB3 LYS 129 110.079 -4.363 -13.530 1028 HG2 LYS 129 HG2 LYS 129 111.836 -5.361 -14.700 1029 HG3 LYS 129 HG3 LYS 129 112.523 -3.751 -14.373 1030 HD2 LYS 129 HD3 LYS 129 114.265 -5.122 -13.644 1031 HD3 LYS 129 HD2 LYS 129 113.352 -4.915 -12.130 1032 HE2 LYS 129 HE2 LYS 129 112.058 -7.042 -12.817 1033 HE3 LYS 129 HE3 LYS 129 113.340 -7.289 -14.028 1034 HZ1 LYS 129 HZ1 LYS 129 113.423 -7.942 -11.353 1035 HZ2 LYS 129 HZ2 LYS 129 114.462 -6.673 -11.528 1036 HZ3 LYS 129 HZ3 LYS 129 114.660 -8.032 -12.441 1037 H LYS 130 H LYS 130 112.719 -1.831 -14.038 1038 HA LYS 130 HA LYS 130 111.363 0.589 -14.502 1039 HB2 LYS 130 HB2 LYS 130 113.458 -0.845 -15.736 1040 HB3 LYS 130 HB3 LYS 130 112.282 -0.542 -17.036 1041 HG2 LYS 130 HG3 LYS 130 112.219 1.888 -16.260 1042 HG3 LYS 130 HG2 LYS 130 113.601 1.506 -15.205 1043 HD2 LYS 130 HD2 LYS 130 114.961 0.867 -17.119 1044 HD3 LYS 130 HD3 LYS 130 113.568 1.023 -18.217 1045 HE2 LYS 130 HE2 LYS 130 113.430 3.474 -17.461 1046 HE3 LYS 130 HE3 LYS 130 115.025 3.230 -16.710 1047 HZ1 LYS 130 HZ1 LYS 130 115.217 4.082 -18.951 1048 HZ2 LYS 130 HZ2 LYS 130 115.864 2.568 -18.864 1049 HZ3 LYS 130 HZ3 LYS 130 114.386 2.794 -19.559 1050 H ASP 131 H ASP 131 109.520 1.214 -15.546 1051 HA ASP 131 HA ASP 131 107.567 -0.854 -16.250 1052 HB2 ASP 131 HB3 ASP 131 106.803 1.277 -15.345 1053 HB3 ASP 131 HB2 ASP 131 107.593 2.168 -16.667 Start of MODEL 15 1 H1 ALA 1 H1 ALA 1 117.003 9.610 -7.652 2 H2 ALA 1 H2 ALA 1 116.440 9.488 -6.106 3 H3 ALA 1 H3 ALA 1 118.063 9.564 -6.389 4 HA ALA 1 HA ALA 1 118.032 7.441 -7.517 5 HB1 ALA 1 HB1 ALA 1 117.541 6.053 -5.523 6 HB2 ALA 1 HB2 ALA 1 116.703 7.431 -4.770 7 HB3 ALA 1 HB3 ALA 1 118.455 7.513 -5.076 8 H PHE 2 H PHE 2 116.757 5.511 -8.012 9 HA PHE 2 HA PHE 2 114.858 4.707 -9.220 10 HB2 PHE 2 HB3 PHE 2 114.508 4.531 -6.528 11 HB3 PHE 2 HB2 PHE 2 113.104 5.542 -6.945 12 HD1 PHE 2 HD1 PHE 2 114.859 2.674 -8.672 13 HD2 PHE 2 HD2 PHE 2 111.185 4.268 -7.116 14 HE1 PHE 2 HE1 PHE 2 113.637 0.687 -9.513 15 HE2 PHE 2 HE2 PHE 2 109.970 2.274 -7.946 16 HZ PHE 2 HZ PHE 2 111.195 0.490 -9.150 17 H ASP 3 H ASP 3 115.474 7.548 -9.658 18 HA ASP 3 HA ASP 3 112.958 9.044 -9.634 19 HB2 ASP 3 HB2 ASP 3 115.674 9.390 -10.910 20 HB3 ASP 3 HB3 ASP 3 114.320 10.414 -11.444 21 H SER 4 H SER 4 111.324 7.863 -10.689 22 HA SER 4 HA SER 4 110.873 8.194 -13.415 23 HB2 SER 4 HB3 SER 4 112.815 5.974 -12.900 24 HB3 SER 4 HB2 SER 4 111.533 5.658 -14.094 25 HG SER 4 HG SER 4 112.540 6.951 -15.428 26 H THR 5 H THR 5 109.751 5.785 -14.280 27 HA THR 5 HA THR 5 107.651 5.396 -12.147 28 HB THR 5 HB THR 5 107.634 4.971 -15.165 29 HG1 THR 5 HG1 THR 5 105.989 6.591 -14.970 30 HG21 THR 5 HG21 THR 5 105.154 4.448 -14.713 31 HG22 THR 5 HG22 THR 5 105.625 4.209 -13.014 32 HG23 THR 5 HG23 THR 5 106.321 3.175 -14.284 33 H TRP 6 H TRP 6 107.170 3.341 -11.382 34 HA TRP 6 HA TRP 6 108.526 0.998 -12.662 35 HB2 TRP 6 HB3 TRP 6 108.851 1.481 -9.686 36 HB3 TRP 6 HB2 TRP 6 109.718 0.325 -10.724 37 HD1 TRP 6 HD1 TRP 6 109.290 4.179 -10.461 38 HE1 TRP 6 HE1 TRP 6 111.535 5.301 -11.062 39 HE3 TRP 6 HE3 TRP 6 111.999 0.010 -11.600 40 HZ2 TRP 6 HZ2 TRP 6 114.164 4.470 -11.916 41 HZ3 TRP 6 HZ3 TRP 6 114.368 0.196 -12.295 42 HH2 TRP 6 HH2 TRP 6 115.455 2.419 -12.457 43 H LYS 7 H LYS 7 107.797 -1.083 -11.494 44 HA LYS 7 HA LYS 7 105.256 -0.778 -9.969 45 HB2 LYS 7 HB2 LYS 7 103.845 -1.874 -11.545 46 HB3 LYS 7 HB3 LYS 7 104.737 -0.669 -12.503 47 HG2 LYS 7 HG2 LYS 7 106.462 -2.594 -12.896 48 HG3 LYS 7 HG3 LYS 7 105.148 -3.670 -12.363 49 HD2 LYS 7 HD2 LYS 7 103.699 -2.324 -14.099 50 HD3 LYS 7 HD3 LYS 7 105.275 -1.870 -14.792 51 HE2 LYS 7 HE3 LYS 7 104.839 -3.835 -15.969 52 HE3 LYS 7 HE2 LYS 7 105.751 -4.479 -14.583 53 HZ1 LYS 7 HZ1 LYS 7 103.718 -5.707 -14.958 54 HZ2 LYS 7 HZ2 LYS 7 103.655 -4.939 -13.500 55 HZ3 LYS 7 HZ3 LYS 7 102.809 -4.342 -14.783 56 H VAL 8 H VAL 8 105.075 -2.455 -8.532 57 HA VAL 8 HA VAL 8 107.096 -4.220 -7.901 58 HB VAL 8 HB VAL 8 105.313 -4.362 -6.423 59 HG11 VAL 8 HG11 VAL 8 102.934 -4.886 -7.328 60 HG12 VAL 8 HG12 VAL 8 103.603 -4.472 -8.924 61 HG13 VAL 8 HG13 VAL 8 103.593 -3.259 -7.622 62 HG21 VAL 8 HG21 VAL 8 104.583 -6.620 -6.364 63 HG22 VAL 8 HG22 VAL 8 104.562 -6.751 -8.138 64 HG23 VAL 8 HG23 VAL 8 106.114 -6.685 -7.269 65 H ASP 9 H ASP 9 108.294 -5.321 -9.350 66 HA ASP 9 HA ASP 9 106.898 -6.805 -11.552 67 HB2 ASP 9 HB2 ASP 9 108.923 -5.452 -12.094 68 HB3 ASP 9 HB3 ASP 9 109.872 -6.441 -10.959 69 H ARG 10 H ARG 10 108.618 -7.258 -8.518 70 HA ARG 10 HA ARG 10 107.800 -10.133 -8.602 71 HB2 ARG 10 HB3 ARG 10 110.615 -9.620 -7.702 72 HB3 ARG 10 HB2 ARG 10 109.908 -11.065 -8.463 73 HG2 ARG 10 HG2 ARG 10 109.809 -9.904 -10.632 74 HG3 ARG 10 HG3 ARG 10 110.444 -8.418 -9.886 75 HD2 ARG 10 HD3 ARG 10 112.016 -10.296 -11.105 76 HD3 ARG 10 HD2 ARG 10 112.588 -9.219 -9.809 77 HE ARG 10 HE ARG 10 111.370 -11.806 -8.940 78 HH11 ARG 10 HH11 ARG 10 112.787 -13.082 -7.728 79 HH12 ARG 10 HH12 ARG 10 114.483 -12.665 -7.639 80 HH21 ARG 10 HH21 ARG 10 114.162 -9.854 -9.669 81 HH22 ARG 10 HH22 ARG 10 115.258 -10.846 -8.733 82 H SER 11 H SER 11 108.375 -11.174 -6.375 83 HA SER 11 HA SER 11 108.778 -9.398 -4.098 84 HB2 SER 11 HB2 SER 11 106.567 -8.551 -4.542 85 HB3 SER 11 HB3 SER 11 105.925 -10.190 -4.813 86 HG SER 11 HG SER 11 105.490 -10.132 -2.741 87 H GLU 12 H GLU 12 107.914 -10.681 -1.997 88 HA GLU 12 HA GLU 12 107.941 -13.626 -2.456 89 HB2 GLU 12 HB2 GLU 12 110.005 -14.102 -1.546 90 HB3 GLU 12 HB3 GLU 12 110.386 -12.503 -2.225 91 HG2 GLU 12 HG2 GLU 12 109.594 -11.562 0.065 92 HG3 GLU 12 HG3 GLU 12 109.746 -13.236 0.651 93 H ASN 13 H ASN 13 107.245 -14.812 -0.610 94 HA ASN 13 HA ASN 13 105.951 -15.102 1.337 95 HB2 ASN 13 HB2 ASN 13 107.871 -14.304 2.558 96 HB3 ASN 13 HB3 ASN 13 107.532 -12.616 2.107 97 HD21 ASN 13 HD21 ASN 13 107.674 -12.664 4.714 98 HD22 ASN 13 HD22 ASN 13 106.124 -12.832 5.506 99 H TYR 14 H TYR 14 105.705 -11.861 2.355 100 HA TYR 14 HA TYR 14 103.982 -10.255 2.115 101 HB2 TYR 14 HB2 TYR 14 104.182 -11.242 -0.423 102 HB3 TYR 14 HB3 TYR 14 102.518 -11.730 -0.021 103 HD1 TYR 14 HD1 TYR 14 104.451 -8.736 1.143 104 HD2 TYR 14 HD2 TYR 14 101.163 -10.202 -1.201 105 HE1 TYR 14 HE1 TYR 14 103.680 -6.409 0.767 106 HE2 TYR 14 HE2 TYR 14 100.392 -7.877 -1.577 107 HH TYR 14 HH TYR 14 101.528 -5.231 0.201 108 H ASP 15 H ASP 15 102.710 -13.571 1.457 109 HA ASP 15 HA ASP 15 100.212 -13.078 2.822 110 HB2 ASP 15 HB2 ASP 15 101.782 -15.595 2.184 111 HB3 ASP 15 HB3 ASP 15 100.258 -15.662 3.102 112 H LYS 16 H LYS 16 103.303 -14.499 3.958 113 HA LYS 16 HA LYS 16 102.353 -14.885 6.679 114 HB2 LYS 16 HB2 LYS 16 105.211 -14.385 5.731 115 HB3 LYS 16 HB3 LYS 16 104.717 -15.150 7.260 116 HG2 LYS 16 HG2 LYS 16 103.729 -16.299 4.649 117 HG3 LYS 16 HG3 LYS 16 105.392 -16.648 5.178 118 HD2 LYS 16 HD2 LYS 16 103.115 -16.968 7.136 119 HD3 LYS 16 HD3 LYS 16 103.407 -18.235 5.921 120 HE2 LYS 16 HE2 LYS 16 105.732 -17.166 7.522 121 HE3 LYS 16 HE3 LYS 16 104.626 -18.340 8.275 122 HZ1 LYS 16 HZ1 LYS 16 106.451 -19.431 7.152 123 HZ2 LYS 16 HZ2 LYS 16 106.051 -18.723 5.717 124 HZ3 LYS 16 HZ3 LYS 16 105.025 -19.811 6.414 125 H PHE 17 H PHE 17 103.706 -12.157 4.890 126 HA PHE 17 HA PHE 17 104.211 -10.520 7.263 127 HB2 PHE 17 HB2 PHE 17 105.380 -9.873 5.319 128 HB3 PHE 17 HB3 PHE 17 103.935 -10.013 4.291 129 HD1 PHE 17 HD1 PHE 17 105.644 -7.980 6.854 130 HD2 PHE 17 HD2 PHE 17 102.312 -8.218 4.162 131 HE1 PHE 17 HE1 PHE 17 105.188 -5.572 7.211 132 HE2 PHE 17 HE2 PHE 17 101.848 -5.808 4.520 133 HZ PHE 17 HZ PHE 17 103.288 -4.483 6.046 134 H MET 18 H MET 18 101.666 -10.384 4.726 135 HA MET 18 HA MET 18 100.029 -8.470 6.112 136 HB2 MET 18 HB2 MET 18 99.420 -10.634 4.072 137 HB3 MET 18 HB3 MET 18 98.133 -9.606 4.741 138 HG2 MET 18 HG2 MET 18 98.682 -8.156 3.072 139 HG3 MET 18 HG3 MET 18 100.090 -7.752 4.083 140 HE1 MET 18 HE1 MET 18 99.709 -11.290 1.545 141 HE2 MET 18 HE2 MET 18 99.464 -9.992 0.352 142 HE3 MET 18 HE3 MET 18 98.472 -10.042 1.828 143 H GLU 19 H GLU 19 100.430 -11.954 6.519 144 HA GLU 19 HA GLU 19 98.007 -12.233 8.174 145 HB2 GLU 19 HB2 GLU 19 99.049 -14.140 6.917 146 HB3 GLU 19 HB3 GLU 19 100.459 -14.042 7.999 147 HG2 GLU 19 HG3 GLU 19 98.884 -14.366 9.953 148 HG3 GLU 19 HG2 GLU 19 97.577 -14.660 8.781 149 H LYS 20 H LYS 20 101.385 -11.382 8.685 150 HA LYS 20 HA LYS 20 101.345 -11.855 11.574 151 HB2 LYS 20 HB3 LYS 20 103.358 -11.461 9.865 152 HB3 LYS 20 HB2 LYS 20 103.118 -9.761 10.334 153 HG2 LYS 20 HG2 LYS 20 104.625 -10.456 11.975 154 HG3 LYS 20 HG3 LYS 20 103.077 -10.779 12.790 155 HD2 LYS 20 HD2 LYS 20 103.172 -13.140 11.976 156 HD3 LYS 20 HD3 LYS 20 104.758 -12.802 11.241 157 HE2 LYS 20 HE3 LYS 20 105.827 -12.613 13.307 158 HE3 LYS 20 HE2 LYS 20 104.330 -12.156 14.156 159 HZ1 LYS 20 HZ1 LYS 20 104.991 -14.411 14.670 160 HZ2 LYS 20 HZ2 LYS 20 104.939 -14.836 13.077 161 HZ3 LYS 20 HZ3 LYS 20 103.552 -14.412 13.863 162 H MET 21 H MET 21 100.800 -8.992 9.489 163 HA MET 21 HA MET 21 100.390 -7.186 11.743 164 HB2 MET 21 HB2 MET 21 98.980 -6.702 9.137 165 HB3 MET 21 HB3 MET 21 99.930 -5.580 10.140 166 HG2 MET 21 HG3 MET 21 101.912 -7.269 9.450 167 HG3 MET 21 HG2 MET 21 100.848 -7.527 8.047 168 HE1 MET 21 HE1 MET 21 100.392 -4.064 6.494 169 HE2 MET 21 HE2 MET 21 99.341 -4.939 7.633 170 HE3 MET 21 HE3 MET 21 100.178 -5.824 6.335 171 H GLY 22 H GLY 22 98.614 -9.829 10.672 172 HA2 GLY 22 HA2 GLY 22 96.528 -10.587 11.553 173 HA3 GLY 22 HA3 GLY 22 96.320 -9.016 12.362 174 H VAL 23 H VAL 23 97.113 -9.129 8.946 175 HA VAL 23 HA VAL 23 94.739 -7.586 8.268 176 HB VAL 23 HB VAL 23 96.613 -9.185 6.464 177 HG11 VAL 23 HG11 VAL 23 95.796 -7.644 4.700 178 HG12 VAL 23 HG12 VAL 23 94.683 -6.896 5.870 179 HG13 VAL 23 HG13 VAL 23 94.459 -8.595 5.389 180 HG21 VAL 23 HG21 VAL 23 97.786 -7.487 7.844 181 HG22 VAL 23 HG22 VAL 23 97.741 -7.000 6.133 182 HG23 VAL 23 HG23 VAL 23 96.629 -6.247 7.302 183 H ASN 24 H ASN 24 92.701 -8.390 8.202 184 HA ASN 24 HA ASN 24 91.877 -11.038 8.454 185 HB2 ASN 24 HB2 ASN 24 90.435 -9.338 6.420 186 HB3 ASN 24 HB3 ASN 24 89.768 -10.353 7.722 187 HD21 ASN 24 HD21 ASN 24 89.979 -7.184 6.881 188 HD22 ASN 24 HD22 ASN 24 90.127 -6.455 8.465 189 H ILE 25 H ILE 25 91.204 -12.702 6.911 190 HA ILE 25 HA ILE 25 93.180 -13.089 4.808 191 HB ILE 25 HB ILE 25 90.694 -14.513 5.732 192 HG12 ILE 25 HG12 ILE 25 93.154 -14.758 6.598 193 HG13 ILE 25 HG13 ILE 25 92.209 -16.231 6.279 194 HG21 ILE 25 HG21 ILE 25 91.086 -16.184 3.860 195 HG22 ILE 25 HG22 ILE 25 90.405 -14.626 3.335 196 HG23 ILE 25 HG23 ILE 25 92.134 -14.970 3.088 197 HD11 ILE 25 HD11 ILE 25 94.651 -16.061 5.327 198 HD12 ILE 25 HD12 ILE 25 93.915 -15.006 4.097 199 HD13 ILE 25 HD13 ILE 25 93.361 -16.688 4.274 200 H VAL 26 H VAL 26 90.602 -11.075 4.985 201 HA VAL 26 HA VAL 26 89.649 -11.363 2.191 202 HB VAL 26 HB VAL 26 89.169 -8.962 3.978 203 HG11 VAL 26 HG11 VAL 26 88.331 -8.931 1.644 204 HG12 VAL 26 HG12 VAL 26 87.478 -10.466 1.931 205 HG13 VAL 26 HG13 VAL 26 86.984 -8.997 2.806 206 HG21 VAL 26 HG21 VAL 26 87.087 -10.397 4.696 207 HG22 VAL 26 HG22 VAL 26 88.644 -10.669 5.514 208 HG23 VAL 26 HG23 VAL 26 88.103 -11.784 4.237 209 H LYS 27 H LYS 27 91.246 -8.710 4.029 210 HA LYS 27 HA LYS 27 92.001 -7.228 1.678 211 HB2 LYS 27 HB3 LYS 27 92.833 -7.306 4.554 212 HB3 LYS 27 HB2 LYS 27 93.981 -6.563 3.415 213 HG2 LYS 27 HG2 LYS 27 92.450 -4.850 4.289 214 HG3 LYS 27 HG3 LYS 27 92.140 -5.106 2.555 215 HD2 LYS 27 HD2 LYS 27 90.193 -6.446 3.011 216 HD3 LYS 27 HD3 LYS 27 90.589 -6.548 4.744 217 HE2 LYS 27 HE3 LYS 27 90.114 -3.875 3.383 218 HE3 LYS 27 HE2 LYS 27 88.765 -4.841 4.029 219 HZ1 LYS 27 HZ1 LYS 27 89.604 -3.284 5.658 220 HZ2 LYS 27 HZ2 LYS 27 89.866 -4.831 6.166 221 HZ3 LYS 27 HZ3 LYS 27 91.116 -3.936 5.568 222 H ARG 28 H ARG 28 93.435 -9.997 3.329 223 HA ARG 28 HA ARG 28 96.015 -9.875 1.987 224 HB2 ARG 28 HB3 ARG 28 95.722 -11.256 3.980 225 HB3 ARG 28 HB2 ARG 28 94.454 -12.212 3.177 226 HG2 ARG 28 HG2 ARG 28 96.057 -13.073 1.553 227 HG3 ARG 28 HG3 ARG 28 97.332 -12.004 2.185 228 HD2 ARG 28 HD2 ARG 28 97.894 -13.594 3.689 229 HD3 ARG 28 HD3 ARG 28 96.268 -13.475 4.403 230 HE ARG 28 HE ARG 28 95.773 -15.103 2.246 231 HH11 ARG 28 HH11 ARG 28 96.119 -17.335 2.216 232 HH12 ARG 28 HH12 ARG 28 97.328 -18.048 3.260 233 HH21 ARG 28 HH21 ARG 28 98.279 -15.006 4.663 234 HH22 ARG 28 HH22 ARG 28 98.546 -16.734 4.640 235 H LYS 29 H LYS 29 93.016 -11.760 1.313 236 HA LYS 29 HA LYS 29 93.964 -13.032 -1.067 237 HB2 LYS 29 HB2 LYS 29 91.245 -12.193 -0.055 238 HB3 LYS 29 HB3 LYS 29 91.402 -12.797 -1.722 239 HG2 LYS 29 HG2 LYS 29 92.605 -14.821 -0.790 240 HG3 LYS 29 HG3 LYS 29 92.203 -14.238 0.843 241 HD2 LYS 29 HD3 LYS 29 89.763 -14.203 0.121 242 HD3 LYS 29 HD2 LYS 29 90.266 -15.035 -1.369 243 HE2 LYS 29 HE2 LYS 29 90.647 -16.039 1.486 244 HE3 LYS 29 HE3 LYS 29 89.517 -16.692 0.275 245 HZ1 LYS 29 HZ1 LYS 29 91.293 -18.057 -0.006 246 HZ2 LYS 29 HZ2 LYS 29 91.710 -16.886 -1.090 247 HZ3 LYS 29 HZ3 LYS 29 92.418 -16.920 0.399 248 H LEU 30 H LEU 30 92.710 -9.755 -0.524 249 HA LEU 30 HA LEU 30 92.756 -9.192 -3.447 250 HB2 LEU 30 HB2 LEU 30 92.209 -7.401 -1.044 251 HB3 LEU 30 HB3 LEU 30 92.076 -6.890 -2.743 252 HG LEU 30 HG LEU 30 90.615 -9.372 -1.847 253 HD11 LEU 30 HD11 LEU 30 90.063 -7.658 -0.142 254 HD12 LEU 30 HD12 LEU 30 88.670 -7.976 -1.203 255 HD13 LEU 30 HD13 LEU 30 89.647 -6.507 -1.434 256 HD21 LEU 30 HD21 LEU 30 90.690 -8.719 -4.239 257 HD22 LEU 30 HD22 LEU 30 89.036 -8.595 -3.593 258 HD23 LEU 30 HD23 LEU 30 90.013 -7.126 -3.824 259 H ALA 31 H ALA 31 94.896 -9.190 -0.853 260 HA ALA 31 HA ALA 31 96.611 -6.996 -1.887 261 HB1 ALA 31 HB1 ALA 31 98.210 -8.029 -0.089 262 HB2 ALA 31 HB2 ALA 31 96.782 -8.973 0.401 263 HB3 ALA 31 HB3 ALA 31 96.737 -7.194 0.460 264 H ALA 32 H ALA 32 96.555 -10.565 -1.859 265 HA ALA 32 HA ALA 32 99.124 -11.174 -2.791 266 HB1 ALA 32 HB1 ALA 32 98.103 -13.072 -4.019 267 HB2 ALA 32 HB2 ALA 32 97.354 -12.871 -2.417 268 HB3 ALA 32 HB3 ALA 32 96.503 -12.304 -3.874 269 H HIS 33 H HIS 33 96.804 -9.150 -4.317 270 HA HIS 33 HA HIS 33 97.672 -9.554 -7.079 271 HB2 HIS 33 HB3 HIS 33 96.127 -7.429 -5.585 272 HB3 HIS 33 HB2 HIS 33 96.691 -7.102 -7.241 273 HD2 HIS 33 HD2 HIS 33 93.925 -9.155 -5.432 274 HE1 HIS 33 HE1 HIS 33 93.742 -10.163 -9.529 275 HE2 HIS 33 HE2 HIS 33 92.543 -10.398 -7.287 276 H ASP 34 H ASP 34 99.981 -9.474 -5.548 277 HA ASP 34 HA ASP 34 101.225 -6.938 -5.184 278 HB2 ASP 34 HB2 ASP 34 102.206 -9.722 -5.782 279 HB3 ASP 34 HB3 ASP 34 103.365 -8.375 -5.883 280 H ASN 35 H ASN 35 100.135 -5.862 -7.133 281 HA ASN 35 HA ASN 35 102.147 -5.808 -9.347 282 HB2 ASN 35 HB2 ASN 35 100.187 -7.447 -9.875 283 HB3 ASN 35 HB3 ASN 35 99.195 -5.977 -10.027 284 HD21 ASN 35 HD21 ASN 35 102.182 -4.880 -10.875 285 HD22 ASN 35 HD22 ASN 35 102.142 -5.192 -12.596 286 H LEU 36 H LEU 36 101.683 -3.924 -7.275 287 HA LEU 36 HA LEU 36 99.869 -1.854 -8.387 288 HB2 LEU 36 HB2 LEU 36 100.023 -0.836 -6.339 289 HB3 LEU 36 HB3 LEU 36 100.559 -2.456 -5.843 290 HG LEU 36 HG LEU 36 102.929 -1.323 -6.705 291 HD11 LEU 36 HD11 LEU 36 101.832 0.884 -7.000 292 HD12 LEU 36 HD12 LEU 36 101.284 0.835 -5.307 293 HD13 LEU 36 HD13 LEU 36 103.023 0.932 -5.677 294 HD21 LEU 36 HD21 LEU 36 102.536 -2.595 -4.608 295 HD22 LEU 36 HD22 LEU 36 101.694 -1.188 -3.915 296 HD23 LEU 36 HD23 LEU 36 103.432 -1.091 -4.286 297 H LYS 37 H LYS 37 100.615 0.334 -8.857 298 HA LYS 37 HA LYS 37 103.416 0.336 -10.020 299 HB2 LYS 37 HB2 LYS 37 101.340 0.374 -11.599 300 HB3 LYS 37 HB3 LYS 37 101.103 2.036 -11.010 301 HG2 LYS 37 HG2 LYS 37 102.958 2.832 -12.110 302 HG3 LYS 37 HG3 LYS 37 103.875 1.325 -11.875 303 HD2 LYS 37 HD3 LYS 37 103.375 1.554 -14.248 304 HD3 LYS 37 HD2 LYS 37 102.383 0.230 -13.593 305 HE2 LYS 37 HE2 LYS 37 100.587 2.105 -13.202 306 HE3 LYS 37 HE3 LYS 37 101.541 3.027 -14.388 307 HZ1 LYS 37 HZ1 LYS 37 99.813 1.735 -15.449 308 HZ2 LYS 37 HZ2 LYS 37 100.412 0.334 -14.818 309 HZ3 LYS 37 HZ3 LYS 37 101.297 1.188 -15.917 310 H LEU 38 H LEU 38 104.647 2.247 -9.688 311 HA LEU 38 HA LEU 38 103.326 4.533 -8.325 312 HB2 LEU 38 HB2 LEU 38 104.803 4.458 -6.356 313 HB3 LEU 38 HB3 LEU 38 103.823 2.977 -6.458 314 HG LEU 38 HG LEU 38 106.677 3.228 -7.504 315 HD11 LEU 38 HD11 LEU 38 107.293 1.873 -5.521 316 HD12 LEU 38 HD12 LEU 38 106.589 3.434 -5.036 317 HD13 LEU 38 HD13 LEU 38 105.610 1.950 -4.946 318 HD21 LEU 38 HD21 LEU 38 106.231 0.579 -7.142 319 HD22 LEU 38 HD22 LEU 38 105.862 1.412 -8.671 320 HD23 LEU 38 HD23 LEU 38 104.566 1.102 -7.491 321 H THR 39 H THR 39 104.450 6.438 -8.594 322 HA THR 39 HA THR 39 106.990 6.214 -10.220 323 HB THR 39 HB THR 39 105.235 8.680 -9.928 324 HG1 THR 39 HG1 THR 39 104.257 7.946 -11.898 325 HG21 THR 39 HG21 THR 39 106.282 9.250 -12.102 326 HG22 THR 39 HG22 THR 39 107.181 7.714 -12.071 327 HG23 THR 39 HG23 THR 39 107.517 8.967 -10.852 328 H ILE 40 H ILE 40 108.848 6.819 -9.194 329 HA ILE 40 HA ILE 40 108.501 8.400 -6.640 330 HB ILE 40 HB ILE 40 110.800 6.591 -7.500 331 HG12 ILE 40 HG13 ILE 40 109.836 5.200 -5.549 332 HG13 ILE 40 HG12 ILE 40 108.376 6.204 -5.706 333 HG21 ILE 40 HG21 ILE 40 111.467 8.422 -5.966 334 HG22 ILE 40 HG22 ILE 40 110.151 7.971 -4.856 335 HG23 ILE 40 HG23 ILE 40 111.505 6.849 -5.134 336 HD11 ILE 40 HD11 ILE 40 108.857 3.884 -7.130 337 HD12 ILE 40 HD12 ILE 40 107.728 5.167 -7.627 338 HD13 ILE 40 HD13 ILE 40 109.384 5.138 -8.278 339 H THR 41 H THR 41 109.216 10.430 -6.631 340 HA THR 41 HA THR 41 111.323 11.196 -8.663 341 HB THR 41 HB THR 41 109.533 13.237 -7.360 342 HG1 THR 41 HG1 THR 41 108.000 11.790 -8.052 343 HG21 THR 41 HG21 THR 41 109.794 14.308 -9.581 344 HG22 THR 41 HG22 THR 41 110.688 12.884 -10.162 345 HG23 THR 41 HG23 THR 41 111.377 13.904 -8.877 346 H GLN 42 H GLN 42 112.987 12.660 -7.865 347 HA GLN 42 HA GLN 42 113.007 12.946 -4.859 348 HB2 GLN 42 HB2 GLN 42 114.346 10.929 -5.560 349 HB3 GLN 42 HB3 GLN 42 115.387 12.009 -6.518 350 HG2 GLN 42 HG2 GLN 42 116.281 13.050 -4.619 351 HG3 GLN 42 HG3 GLN 42 114.878 12.632 -3.605 352 HE21 GLN 42 HE21 GLN 42 114.582 10.122 -3.296 353 HE22 GLN 42 HE22 GLN 42 116.055 9.211 -3.049 354 H GLU 43 H GLU 43 114.185 14.758 -4.090 355 HA GLU 43 HA GLU 43 115.525 16.485 -6.134 356 HB2 GLU 43 HB3 GLU 43 112.972 17.178 -4.671 357 HB3 GLU 43 HB2 GLU 43 114.138 18.462 -5.070 358 HG2 GLU 43 HG2 GLU 43 114.093 17.697 -7.460 359 HG3 GLU 43 HG3 GLU 43 112.830 16.520 -7.025 360 H GLY 44 H GLY 44 117.335 15.739 -4.747 361 HA2 GLY 44 HA2 GLY 44 118.916 16.230 -3.065 362 HA3 GLY 44 HA3 GLY 44 118.035 17.750 -2.786 363 H ASN 45 H ASN 45 116.352 17.794 -1.206 364 HA ASN 45 HA ASN 45 116.325 15.363 0.599 365 HB2 ASN 45 HB2 ASN 45 115.714 17.577 2.212 366 HB3 ASN 45 HB3 ASN 45 117.261 16.698 2.170 367 HD21 ASN 45 HD21 ASN 45 118.723 17.449 0.167 368 HD22 ASN 45 HD22 ASN 45 118.796 19.181 -0.067 369 H LYS 46 H LYS 46 114.490 16.211 -1.600 370 HA LYS 46 HA LYS 46 111.993 16.092 0.041 371 HB2 LYS 46 HB2 LYS 46 112.148 18.461 -0.419 372 HB3 LYS 46 HB3 LYS 46 112.640 18.162 -2.103 373 HG2 LYS 46 HG2 LYS 46 110.121 16.817 -1.497 374 HG3 LYS 46 HG3 LYS 46 110.012 18.559 -1.151 375 HD2 LYS 46 HD2 LYS 46 110.987 19.006 -3.437 376 HD3 LYS 46 HD3 LYS 46 110.886 17.260 -3.769 377 HE2 LYS 46 HE2 LYS 46 108.541 17.262 -3.769 378 HE3 LYS 46 HE3 LYS 46 108.442 18.745 -2.789 379 HZ1 LYS 46 HZ1 LYS 46 107.908 19.165 -5.097 380 HZ2 LYS 46 HZ2 LYS 46 109.377 18.595 -5.586 381 HZ3 LYS 46 HZ3 LYS 46 109.286 19.970 -4.679 382 H PHE 47 H PHE 47 111.232 14.200 -0.653 383 HA PHE 47 HA PHE 47 111.480 13.571 -3.598 384 HB2 PHE 47 HB2 PHE 47 110.866 11.176 -2.587 385 HB3 PHE 47 HB3 PHE 47 112.540 11.778 -2.568 386 HD1 PHE 47 HD1 PHE 47 113.591 12.503 -0.509 387 HD2 PHE 47 HD2 PHE 47 109.491 11.224 -0.541 388 HE1 PHE 47 HE1 PHE 47 113.608 12.385 1.968 389 HE2 PHE 47 HE2 PHE 47 109.508 11.105 1.935 390 HZ PHE 47 HZ PHE 47 111.568 11.685 3.191 391 H THR 48 H THR 48 109.621 12.018 -4.297 392 HA THR 48 HA THR 48 107.054 12.626 -2.905 393 HB THR 48 HB THR 48 107.561 13.396 -5.817 394 HG1 THR 48 HG1 THR 48 107.212 15.525 -4.967 395 HG21 THR 48 HG21 THR 48 105.257 14.308 -5.698 396 HG22 THR 48 HG22 THR 48 105.105 13.706 -4.030 397 HG23 THR 48 HG23 THR 48 105.268 12.557 -5.380 398 H VAL 49 H VAL 49 106.559 10.507 -2.632 399 HA VAL 49 HA VAL 49 106.954 8.598 -4.898 400 HB VAL 49 HB VAL 49 105.754 8.079 -2.145 401 HG11 VAL 49 HG11 VAL 49 107.337 6.010 -3.555 402 HG12 VAL 49 HG12 VAL 49 105.845 6.483 -4.403 403 HG13 VAL 49 HG13 VAL 49 105.764 5.877 -2.732 404 HG21 VAL 49 HG21 VAL 49 108.037 7.362 -1.492 405 HG22 VAL 49 HG22 VAL 49 108.654 7.884 -3.077 406 HG23 VAL 49 HG23 VAL 49 108.009 9.086 -1.933 407 H LYS 50 H LYS 50 105.374 8.715 -6.441 408 HA LYS 50 HA LYS 50 102.549 9.205 -5.515 409 HB2 LYS 50 HB2 LYS 50 103.719 10.478 -7.477 410 HB3 LYS 50 HB3 LYS 50 103.453 8.981 -8.402 411 HG2 LYS 50 HG2 LYS 50 100.986 9.192 -7.461 412 HG3 LYS 50 HG3 LYS 50 101.429 10.903 -7.247 413 HD2 LYS 50 HD3 LYS 50 102.305 10.707 -9.723 414 HD3 LYS 50 HD2 LYS 50 101.238 9.284 -9.795 415 HE2 LYS 50 HE3 LYS 50 100.379 12.091 -8.959 416 HE3 LYS 50 HE2 LYS 50 100.070 11.350 -10.549 417 HZ1 LYS 50 HZ1 LYS 50 98.194 11.090 -9.066 418 HZ2 LYS 50 HZ2 LYS 50 98.838 9.616 -9.428 419 HZ3 LYS 50 HZ3 LYS 50 99.125 10.301 -7.956 420 H GLU 51 H GLU 51 101.787 7.208 -4.797 421 HA GLU 51 HA GLU 51 102.429 4.741 -6.290 422 HB2 GLU 51 HB2 GLU 51 100.379 5.289 -4.097 423 HB3 GLU 51 HB3 GLU 51 100.827 3.678 -4.707 424 HG2 GLU 51 HG3 GLU 51 102.162 3.986 -2.755 425 HG3 GLU 51 HG2 GLU 51 103.259 4.322 -4.116 426 H SER 52 H SER 52 100.744 3.372 -7.295 427 HA SER 52 HA SER 52 98.177 4.647 -7.992 428 HB2 SER 52 HB2 SER 52 99.998 3.969 -10.316 429 HB3 SER 52 HB3 SER 52 98.531 4.978 -10.300 430 HG SER 52 HG SER 52 100.669 6.099 -10.342 431 H SER 53 H SER 53 97.022 2.924 -7.470 432 HA SER 53 HA SER 53 97.711 0.319 -8.838 433 HB2 SER 53 HB2 SER 53 97.382 -0.882 -6.889 434 HB3 SER 53 HB3 SER 53 97.942 0.641 -6.158 435 HG SER 53 HG SER 53 96.056 0.476 -5.161 436 H ALA 54 H ALA 54 95.918 -0.780 -9.705 437 HA ALA 54 HA ALA 54 93.673 0.822 -10.497 438 HB1 ALA 54 HB1 ALA 54 92.650 -1.324 -11.205 439 HB2 ALA 54 HB2 ALA 54 93.870 -2.215 -10.264 440 HB3 ALA 54 HB3 ALA 54 94.365 -1.247 -11.674 441 H PHE 55 H PHE 55 94.370 0.132 -7.408 442 HA PHE 55 HA PHE 55 91.452 -0.262 -6.716 443 HB2 PHE 55 HB2 PHE 55 92.546 -2.264 -6.041 444 HB3 PHE 55 HB3 PHE 55 93.951 -1.377 -5.404 445 HD1 PHE 55 HD1 PHE 55 90.241 -0.907 -4.971 446 HD2 PHE 55 HD2 PHE 55 94.031 -1.643 -3.087 447 HE1 PHE 55 HE1 PHE 55 89.158 -0.786 -2.743 448 HE2 PHE 55 HE2 PHE 55 92.947 -1.522 -0.860 449 HZ PHE 55 HZ PHE 55 90.511 -1.091 -0.688 450 H ARG 56 H ARG 56 94.185 1.855 -6.416 451 HA ARG 56 HA ARG 56 92.787 3.917 -5.131 452 HB2 ARG 56 HB2 ARG 56 93.427 1.744 -3.255 453 HB3 ARG 56 HB3 ARG 56 94.107 3.304 -2.737 454 HG2 ARG 56 HG3 ARG 56 91.263 3.224 -3.734 455 HG3 ARG 56 HG2 ARG 56 91.612 2.629 -2.094 456 HD2 ARG 56 HD2 ARG 56 92.464 4.730 -1.388 457 HD3 ARG 56 HD3 ARG 56 92.663 5.307 -3.060 458 HE ARG 56 HE ARG 56 89.870 4.752 -2.631 459 HH11 ARG 56 HH11 ARG 56 88.502 6.499 -2.195 460 HH12 ARG 56 HH12 ARG 56 89.168 8.005 -1.605 461 HH21 ARG 56 HH21 ARG 56 92.453 6.855 -1.616 462 HH22 ARG 56 HH22 ARG 56 91.395 8.206 -1.279 463 H ASN 57 H ASN 57 94.330 4.872 -6.611 464 HA ASN 57 HA ASN 57 97.192 4.657 -6.231 465 HB2 ASN 57 HB3 ASN 57 97.312 6.704 -7.608 466 HB3 ASN 57 HB2 ASN 57 96.128 5.565 -8.293 467 HD21 ASN 57 HD21 ASN 57 95.956 8.352 -8.891 468 HD22 ASN 57 HD22 ASN 57 94.531 8.996 -8.107 469 H ILE 58 H ILE 58 98.647 6.034 -5.115 470 HA ILE 58 HA ILE 58 97.380 8.024 -3.242 471 HB ILE 58 HB ILE 58 99.597 6.260 -2.239 472 HG12 ILE 58 HG13 ILE 58 96.674 5.514 -2.542 473 HG13 ILE 58 HG12 ILE 58 98.116 4.548 -2.941 474 HG21 ILE 58 HG21 ILE 58 98.499 8.386 -1.120 475 HG22 ILE 58 HG22 ILE 58 98.825 6.944 -0.129 476 HG23 ILE 58 HG23 ILE 58 97.178 7.261 -0.723 477 HD11 ILE 58 HD11 ILE 58 97.452 3.611 -0.893 478 HD12 ILE 58 HD12 ILE 58 96.926 5.179 -0.235 479 HD13 ILE 58 HD13 ILE 58 98.662 4.810 -0.378 480 H GLU 59 H GLU 59 99.218 9.232 -2.055 481 HA GLU 59 HA GLU 59 101.747 9.440 -3.590 482 HB2 GLU 59 HB2 GLU 59 101.114 11.121 -4.957 483 HB3 GLU 59 HB3 GLU 59 99.484 11.118 -4.246 484 HG2 GLU 59 HG2 GLU 59 100.250 12.614 -2.439 485 HG3 GLU 59 HG3 GLU 59 101.905 12.579 -3.093 486 H CYS 60 H CYS 60 103.365 10.168 -2.250 487 HA CYS 60 HA CYS 60 102.569 11.715 0.197 488 HB2 CYS 60 HB2 CYS 60 102.857 8.967 0.341 489 HB3 CYS 60 HB3 CYS 60 104.493 9.531 0.757 490 HG CYS 60 HG CYS 60 102.003 11.278 2.278 491 H VAL 61 H VAL 61 103.836 13.493 -0.081 492 HA VAL 61 HA VAL 61 106.671 13.064 -1.006 493 HB VAL 61 HB VAL 61 105.711 14.660 -2.407 494 HG11 VAL 61 HG11 VAL 61 104.235 16.533 -1.374 495 HG12 VAL 61 HG12 VAL 61 104.156 15.485 0.062 496 HG13 VAL 61 HG13 VAL 61 103.537 14.900 -1.501 497 HG21 VAL 61 HG21 VAL 61 106.595 16.852 -1.768 498 HG22 VAL 61 HG22 VAL 61 107.740 15.588 -1.259 499 HG23 VAL 61 HG23 VAL 61 106.672 16.356 -0.060 500 H PHE 62 H PHE 62 108.387 14.125 0.142 501 HA PHE 62 HA PHE 62 108.006 15.715 2.490 502 HB2 PHE 62 HB2 PHE 62 107.566 12.820 2.882 503 HB3 PHE 62 HB3 PHE 62 108.767 13.516 3.995 504 HD1 PHE 62 HD1 PHE 62 107.986 16.062 4.760 505 HD2 PHE 62 HD2 PHE 62 105.399 12.793 3.722 506 HE1 PHE 62 HE1 PHE 62 106.161 17.083 6.093 507 HE2 PHE 62 HE2 PHE 62 103.573 13.816 5.053 508 HZ PHE 62 HZ PHE 62 103.955 15.961 6.238 509 H GLU 63 H GLU 63 109.982 15.337 4.106 510 HA GLU 63 HA GLU 63 112.426 14.917 2.364 511 HB2 GLU 63 HB2 GLU 63 112.335 17.242 2.918 512 HB3 GLU 63 HB3 GLU 63 111.818 16.904 4.587 513 HG2 GLU 63 HG3 GLU 63 113.984 16.033 5.173 514 HG3 GLU 63 HG2 GLU 63 114.504 16.005 3.471 515 H LEU 64 H LEU 64 113.998 13.526 3.183 516 HA LEU 64 HA LEU 64 113.246 11.705 5.294 517 HB2 LEU 64 HB2 LEU 64 115.426 10.750 5.044 518 HB3 LEU 64 HB3 LEU 64 114.974 11.338 3.427 519 HG LEU 64 HG LEU 64 116.173 13.576 4.429 520 HD11 LEU 64 HD11 LEU 64 116.772 12.442 6.554 521 HD12 LEU 64 HD12 LEU 64 117.645 11.190 5.638 522 HD13 LEU 64 HD13 LEU 64 118.228 12.872 5.624 523 HD21 LEU 64 HD21 LEU 64 116.665 12.445 2.274 524 HD22 LEU 64 HD22 LEU 64 118.165 12.874 3.131 525 HD23 LEU 64 HD23 LEU 64 117.583 11.192 3.144 526 H GLY 65 H GLY 65 113.774 11.627 7.481 527 HA2 GLY 65 HA2 GLY 65 115.213 12.427 9.356 528 HA3 GLY 65 HA3 GLY 65 115.311 14.007 8.544 529 H VAL 66 H VAL 66 112.447 14.089 7.841 530 HA VAL 66 HA VAL 66 111.442 14.752 10.605 531 HB VAL 66 HB VAL 66 111.545 16.513 8.731 532 HG11 VAL 66 HG11 VAL 66 109.990 16.419 6.955 533 HG12 VAL 66 HG12 VAL 66 109.003 15.177 7.763 534 HG13 VAL 66 HG13 VAL 66 110.581 14.743 7.062 535 HG21 VAL 66 HG21 VAL 66 110.179 16.767 10.785 536 HG22 VAL 66 HG22 VAL 66 108.850 15.871 10.011 537 HG23 VAL 66 HG23 VAL 66 109.344 17.457 9.372 538 H THR 67 H THR 67 109.907 13.485 11.497 539 HA THR 67 HA THR 67 108.874 11.140 10.197 540 HB THR 67 HB THR 67 107.247 12.474 12.337 541 HG1 THR 67 HG1 THR 67 109.283 12.982 13.065 542 HG21 THR 67 HG21 THR 67 107.038 10.243 13.160 543 HG22 THR 67 HG22 THR 67 106.947 10.092 11.389 544 HG23 THR 67 HG23 THR 67 108.457 9.687 12.239 545 H PHE 68 H PHE 68 107.000 10.714 9.145 546 HA PHE 68 HA PHE 68 104.954 12.863 8.857 547 HB2 PHE 68 HB3 PHE 68 105.042 12.166 6.259 548 HB3 PHE 68 HB2 PHE 68 105.988 13.527 6.905 549 HD1 PHE 68 HD1 PHE 68 106.268 9.784 6.528 550 HD2 PHE 68 HD2 PHE 68 108.243 13.597 6.409 551 HE1 PHE 68 HE1 PHE 68 108.371 8.679 5.803 552 HE2 PHE 68 HE2 PHE 68 110.341 12.489 5.696 553 HZ PHE 68 HZ PHE 68 110.402 10.033 5.391 554 H ASN 69 H ASN 69 103.320 11.682 6.991 555 HA ASN 69 HA ASN 69 103.090 8.834 7.949 556 HB2 ASN 69 HB2 ASN 69 100.742 9.098 8.440 557 HB3 ASN 69 HB3 ASN 69 101.607 10.397 9.296 558 HD21 ASN 69 HD21 ASN 69 99.596 9.690 6.402 559 HD22 ASN 69 HD22 ASN 69 99.118 11.352 6.139 560 H CYS 70 H CYS 70 101.992 7.441 6.532 561 HA CYS 70 HA CYS 70 100.932 8.500 3.971 562 HB2 CYS 70 HB3 CYS 70 103.356 6.644 3.989 563 HB3 CYS 70 HB2 CYS 70 102.497 7.253 2.554 564 HG CYS 70 HG CYS 70 104.882 8.773 4.385 565 H ASN 71 H ASN 71 99.369 7.074 3.210 566 HA ASN 71 HA ASN 71 99.000 4.634 4.914 567 HB2 ASN 71 HB2 ASN 71 96.777 4.597 3.482 568 HB3 ASN 71 HB3 ASN 71 96.966 5.770 4.807 569 HD21 ASN 71 HD21 ASN 71 95.687 7.472 3.886 570 HD22 ASN 71 HD22 ASN 71 96.149 8.292 2.411 571 H LEU 72 H LEU 72 98.884 2.555 4.091 572 HA LEU 72 HA LEU 72 100.193 2.213 1.422 573 HB2 LEU 72 HB2 LEU 72 99.347 0.120 3.477 574 HB3 LEU 72 HB3 LEU 72 100.409 -0.141 2.073 575 HG LEU 72 HG LEU 72 101.082 1.957 4.154 576 HD11 LEU 72 HD11 LEU 72 101.677 -1.033 4.231 577 HD12 LEU 72 HD12 LEU 72 102.537 0.176 5.213 578 HD13 LEU 72 HD13 LEU 72 100.792 -0.081 5.447 579 HD21 LEU 72 HD21 LEU 72 102.306 1.938 1.996 580 HD22 LEU 72 HD22 LEU 72 102.733 0.229 2.254 581 HD23 LEU 72 HD23 LEU 72 103.377 1.482 3.342 582 H ALA 73 H ALA 73 99.220 1.082 -0.303 583 HA ALA 73 HA ALA 73 96.532 1.516 -0.902 584 HB1 ALA 73 HB1 ALA 73 96.680 -0.396 -2.473 585 HB2 ALA 73 HB2 ALA 73 98.167 0.580 -2.510 586 HB3 ALA 73 HB3 ALA 73 98.142 -0.970 -1.636 587 H ASP 74 H ASP 74 97.877 -1.123 1.070 588 HA ASP 74 HA ASP 74 95.511 -2.737 1.233 589 HB2 ASP 74 HB3 ASP 74 97.268 -2.298 3.652 590 HB3 ASP 74 HB2 ASP 74 96.555 -3.808 3.036 591 H GLY 75 H GLY 75 95.658 0.468 1.878 592 HA2 GLY 75 HA2 GLY 75 94.029 1.841 2.939 593 HA3 GLY 75 HA3 GLY 75 93.192 0.370 3.492 594 H THR 76 H THR 76 96.624 0.801 4.083 595 HA THR 76 HA THR 76 95.987 0.952 7.017 596 HB THR 76 HB THR 76 98.809 0.656 6.173 597 HG1 THR 76 HG1 THR 76 97.875 -0.562 4.529 598 HG21 THR 76 HG21 THR 76 98.712 -1.153 7.864 599 HG22 THR 76 HG22 THR 76 96.946 -0.959 7.969 600 HG23 THR 76 HG23 THR 76 98.019 0.358 8.499 601 H GLU 77 H GLU 77 97.384 2.359 8.343 602 HA GLU 77 HA GLU 77 98.405 4.759 6.823 603 HB2 GLU 77 HB3 GLU 77 96.085 5.126 7.829 604 HB3 GLU 77 HB2 GLU 77 96.834 4.911 9.429 605 HG2 GLU 77 HG2 GLU 77 98.255 6.819 9.123 606 HG3 GLU 77 HG3 GLU 77 97.866 6.917 7.389 607 H LEU 78 H LEU 78 100.535 5.073 7.371 608 HA LEU 78 HA LEU 78 101.306 4.389 10.214 609 HB2 LEU 78 HB3 LEU 78 103.234 3.816 7.969 610 HB3 LEU 78 HB2 LEU 78 103.120 3.073 9.582 611 HG LEU 78 HG LEU 78 100.746 2.267 8.666 612 HD11 LEU 78 HD11 LEU 78 101.295 3.620 6.489 613 HD12 LEU 78 HD12 LEU 78 100.604 1.988 6.326 614 HD13 LEU 78 HD13 LEU 78 102.351 2.243 6.095 615 HD21 LEU 78 HD21 LEU 78 101.846 0.172 7.922 616 HD22 LEU 78 HD22 LEU 78 102.611 0.806 9.398 617 HD23 LEU 78 HD23 LEU 78 103.404 1.026 7.820 618 H ARG 79 H ARG 79 103.391 5.402 10.869 619 HA ARG 79 HA ARG 79 104.179 7.757 9.177 620 HB2 ARG 79 HB3 ARG 79 103.977 9.307 11.072 621 HB3 ARG 79 HB2 ARG 79 102.400 8.553 10.739 622 HG2 ARG 79 HG2 ARG 79 102.781 6.921 12.551 623 HG3 ARG 79 HG3 ARG 79 104.382 7.630 12.868 624 HD2 ARG 79 HD2 ARG 79 102.035 8.382 14.129 625 HD3 ARG 79 HD3 ARG 79 103.500 9.387 14.020 626 HE ARG 79 HE ARG 79 101.562 9.604 11.752 627 HH11 ARG 79 HH11 ARG 79 100.799 11.708 11.449 628 HH12 ARG 79 HH12 ARG 79 101.117 12.936 12.654 629 HH21 ARG 79 HH21 ARG 79 102.891 10.791 14.746 630 HH22 ARG 79 HH22 ARG 79 102.296 12.419 14.511 631 H GLY 80 H GLY 80 106.338 8.369 9.461 632 HA2 GLY 80 HA3 GLY 80 107.989 7.805 11.687 633 HA3 GLY 80 HA2 GLY 80 108.094 6.373 10.629 634 H THR 81 H THR 81 109.692 6.490 9.117 635 HA THR 81 HA THR 81 110.036 8.646 7.299 636 HB THR 81 HB THR 81 112.416 9.163 8.796 637 HG1 THR 81 HG1 THR 81 111.666 9.681 10.781 638 HG21 THR 81 HG21 THR 81 111.352 11.472 8.939 639 HG22 THR 81 HG22 THR 81 109.899 10.763 8.194 640 HG23 THR 81 HG23 THR 81 111.439 10.779 7.301 641 H TRP 82 H TRP 82 111.968 8.463 5.987 642 HA TRP 82 HA TRP 82 113.195 5.720 6.243 643 HB2 TRP 82 HB2 TRP 82 113.479 7.592 3.868 644 HB3 TRP 82 HB3 TRP 82 113.666 5.823 3.913 645 HD1 TRP 82 HD1 TRP 82 110.977 8.556 4.112 646 HE1 TRP 82 HE1 TRP 82 108.691 7.552 3.474 647 HE3 TRP 82 HE3 TRP 82 112.348 3.663 3.678 648 HZ2 TRP 82 HZ2 TRP 82 107.620 4.942 2.833 649 HZ3 TRP 82 HZ3 TRP 82 110.688 1.938 3.045 650 HH2 TRP 82 HH2 TRP 82 108.326 2.569 2.622 651 H SER 83 H SER 83 115.430 5.483 6.422 652 HA SER 83 HA SER 83 117.065 8.014 6.385 653 HB2 SER 83 HB3 SER 83 117.020 7.975 8.672 654 HB3 SER 83 HB2 SER 83 116.451 6.289 8.725 655 HG SER 83 HG SER 83 118.588 6.417 9.506 656 H LEU 84 H LEU 84 119.405 7.528 6.097 657 HA LEU 84 HA LEU 84 119.668 4.927 4.636 658 HB2 LEU 84 HB3 LEU 84 120.730 6.370 3.228 659 HB3 LEU 84 HB2 LEU 84 120.928 7.599 4.499 660 HG LEU 84 HG LEU 84 122.792 6.194 5.460 661 HD11 LEU 84 HD11 LEU 84 123.307 4.766 2.962 662 HD12 LEU 84 HD12 LEU 84 123.260 4.144 4.629 663 HD13 LEU 84 HD13 LEU 84 121.757 4.269 3.683 664 HD21 LEU 84 HD21 LEU 84 124.434 6.848 3.719 665 HD22 LEU 84 HD22 LEU 84 123.238 8.138 3.990 666 HD23 LEU 84 HD23 LEU 84 123.105 7.088 2.559 667 H GLU 85 H GLU 85 120.651 3.227 5.579 668 HA GLU 85 HA GLU 85 122.500 3.786 7.905 669 HB2 GLU 85 HB3 GLU 85 120.119 1.953 7.708 670 HB3 GLU 85 HB2 GLU 85 121.528 1.401 8.644 671 HG2 GLU 85 HG2 GLU 85 120.391 4.178 9.060 672 HG3 GLU 85 HG3 GLU 85 119.668 2.770 9.875 673 H GLY 86 H GLY 86 124.488 3.002 7.429 674 HA2 GLY 86 HA2 GLY 86 126.139 1.616 6.449 675 HA3 GLY 86 HA3 GLY 86 124.906 0.332 6.396 676 H ASN 87 H ASN 87 124.114 -0.237 4.409 677 HA ASN 87 HA ASN 87 124.589 1.733 2.161 678 HB2 ASN 87 HB2 ASN 87 124.958 -0.275 0.690 679 HB3 ASN 87 HB3 ASN 87 126.200 -0.081 1.950 680 HD21 ASN 87 HD21 ASN 87 123.108 -1.836 1.258 681 HD22 ASN 87 HD22 ASN 87 123.502 -3.214 2.260 682 H LYS 88 H LYS 88 122.103 1.375 3.749 683 HA LYS 88 HA LYS 88 120.370 0.681 1.401 684 HB2 LYS 88 HB2 LYS 88 118.934 -0.792 2.735 685 HB3 LYS 88 HB3 LYS 88 120.604 -1.408 2.759 686 HG2 LYS 88 HG2 LYS 88 120.652 0.272 4.923 687 HG3 LYS 88 HG3 LYS 88 118.958 -0.272 4.967 688 HD2 LYS 88 HD3 LYS 88 120.093 -1.911 6.241 689 HD3 LYS 88 HD2 LYS 88 119.953 -2.664 4.635 690 HE2 LYS 88 HE2 LYS 88 122.296 -1.380 4.276 691 HE3 LYS 88 HE3 LYS 88 122.373 -1.587 6.042 692 HZ1 LYS 88 HZ1 LYS 88 123.319 -3.470 4.883 693 HZ2 LYS 88 HZ2 LYS 88 121.904 -3.743 4.081 694 HZ3 LYS 88 HZ3 LYS 88 121.974 -3.936 5.718 695 H LEU 89 H LEU 89 118.108 1.408 1.721 696 HA LEU 89 HA LEU 89 118.077 3.869 3.462 697 HB2 LEU 89 HB2 LEU 89 116.426 2.982 1.061 698 HB3 LEU 89 HB3 LEU 89 115.989 4.388 2.061 699 HG LEU 89 HG LEU 89 118.812 4.166 1.020 700 HD11 LEU 89 HD11 LEU 89 117.376 3.712 -0.951 701 HD12 LEU 89 HD12 LEU 89 118.125 5.323 -1.062 702 HD13 LEU 89 HD13 LEU 89 116.417 5.166 -0.586 703 HD21 LEU 89 HD21 LEU 89 118.160 5.960 2.605 704 HD22 LEU 89 HD22 LEU 89 118.582 6.635 1.013 705 HD23 LEU 89 HD23 LEU 89 116.874 6.478 1.488 706 H ILE 90 H ILE 90 117.288 3.373 5.461 707 HA ILE 90 HA ILE 90 115.405 1.148 5.820 708 HB ILE 90 HB ILE 90 115.250 2.352 8.192 709 HG12 ILE 90 HG13 ILE 90 117.913 3.342 7.117 710 HG13 ILE 90 HG12 ILE 90 116.468 4.376 7.248 711 HG21 ILE 90 HG21 ILE 90 116.268 0.142 7.712 712 HG22 ILE 90 HG22 ILE 90 117.272 1.080 8.843 713 HG23 ILE 90 HG23 ILE 90 117.745 0.950 7.132 714 HD11 ILE 90 HD11 ILE 90 116.336 3.966 9.645 715 HD12 ILE 90 HD12 ILE 90 117.671 2.793 9.552 716 HD13 ILE 90 HD13 ILE 90 117.981 4.519 9.249 717 H GLY 91 H GLY 91 113.338 1.437 6.962 718 HA2 GLY 91 HA2 GLY 91 111.939 4.029 6.429 719 HA3 GLY 91 HA3 GLY 91 111.304 2.576 5.617 720 H LYS 92 H LYS 92 111.668 4.251 8.665 721 HA LYS 92 HA LYS 92 110.488 1.966 10.179 722 HB2 LYS 92 HB2 LYS 92 111.846 4.523 10.814 723 HB3 LYS 92 HB3 LYS 92 110.478 4.147 11.888 724 HG2 LYS 92 HG2 LYS 92 111.468 1.828 12.190 725 HG3 LYS 92 HG3 LYS 92 112.903 2.394 11.302 726 HD2 LYS 92 HD2 LYS 92 111.878 3.996 13.650 727 HD3 LYS 92 HD3 LYS 92 112.851 2.535 13.944 728 HE2 LYS 92 HE3 LYS 92 113.848 4.490 11.892 729 HE3 LYS 92 HE2 LYS 92 113.990 4.944 13.607 730 HZ1 LYS 92 HZ1 LYS 92 115.922 3.734 12.845 731 HZ2 LYS 92 HZ2 LYS 92 115.127 2.863 13.997 732 HZ3 LYS 92 HZ3 LYS 92 114.996 2.442 12.408 733 H PHE 93 H PHE 93 108.352 1.685 9.636 734 HA PHE 93 HA PHE 93 106.615 4.161 9.761 735 HB2 PHE 93 HB3 PHE 93 106.541 1.695 8.029 736 HB3 PHE 93 HB2 PHE 93 105.009 2.492 8.449 737 HD1 PHE 93 HD1 PHE 93 107.356 5.055 8.577 738 HD2 PHE 93 HD2 PHE 93 105.366 2.537 5.719 739 HE1 PHE 93 HE1 PHE 93 107.748 6.747 6.810 740 HE2 PHE 93 HE2 PHE 93 105.761 4.231 3.954 741 HZ PHE 93 HZ PHE 93 106.953 6.336 4.498 742 H LYS 94 H LYS 94 105.123 4.222 11.310 743 HA LYS 94 HA LYS 94 104.589 1.655 12.815 744 HB2 LYS 94 HB2 LYS 94 104.720 4.558 13.683 745 HB3 LYS 94 HB3 LYS 94 103.846 3.345 14.650 746 HG2 LYS 94 HG2 LYS 94 105.895 1.959 14.770 747 HG3 LYS 94 HG3 LYS 94 106.770 3.163 13.794 748 HD2 LYS 94 HD3 LYS 94 105.353 4.071 16.297 749 HD3 LYS 94 HD2 LYS 94 106.908 3.219 16.452 750 HE2 LYS 94 HE3 LYS 94 108.014 4.852 15.027 751 HE3 LYS 94 HE2 LYS 94 106.463 5.639 14.650 752 HZ1 LYS 94 HZ1 LYS 94 107.660 6.812 16.375 753 HZ2 LYS 94 HZ2 LYS 94 106.255 6.196 16.980 754 HZ3 LYS 94 HZ3 LYS 94 107.692 5.467 17.329 755 H ARG 95 H ARG 95 102.607 0.839 12.407 756 HA ARG 95 HA ARG 95 100.584 2.107 10.882 757 HB2 ARG 95 HB2 ARG 95 100.503 -0.060 13.001 758 HB3 ARG 95 HB3 ARG 95 99.007 0.506 12.220 759 HG2 ARG 95 HG2 ARG 95 100.124 0.071 9.980 760 HG3 ARG 95 HG3 ARG 95 101.458 -0.702 10.869 761 HD2 ARG 95 HD3 ARG 95 99.959 -2.472 10.231 762 HD3 ARG 95 HD2 ARG 95 99.690 -2.192 11.968 763 HE ARG 95 HE ARG 95 97.815 -0.520 10.726 764 HH11 ARG 95 HH11 ARG 95 95.731 -1.239 10.223 765 HH12 ARG 95 HH12 ARG 95 95.428 -2.947 9.995 766 HH21 ARG 95 HH21 ARG 95 98.730 -3.877 10.591 767 HH22 ARG 95 HH22 ARG 95 97.117 -4.433 10.202 768 H THR 96 H THR 96 99.581 3.996 11.300 769 HA THR 96 HA THR 96 99.344 4.960 14.100 770 HB THR 96 HB THR 96 97.872 6.690 12.503 771 HG1 THR 96 HG1 THR 96 99.072 6.840 10.575 772 HG21 THR 96 HG21 THR 96 99.916 8.086 12.541 773 HG22 THR 96 HG22 THR 96 99.662 7.283 14.109 774 HG23 THR 96 HG23 THR 96 100.884 6.657 12.976 775 H ASP 97 H ASP 97 97.633 3.063 11.970 776 HA ASP 97 HA ASP 97 94.941 3.741 13.066 777 HB2 ASP 97 HB3 ASP 97 95.208 3.196 10.653 778 HB3 ASP 97 HB2 ASP 97 95.814 1.582 11.094 779 H ASN 98 H ASN 98 97.542 1.450 13.551 780 HA ASN 98 HA ASN 98 95.798 0.083 15.605 781 HB2 ASN 98 HB2 ASN 98 97.493 -1.122 13.421 782 HB3 ASN 98 HB3 ASN 98 97.361 -1.976 14.976 783 HD21 ASN 98 HD21 ASN 98 95.608 -3.375 15.128 784 HD22 ASN 98 HD22 ASN 98 94.141 -3.234 14.187 785 H GLY 99 H GLY 99 98.466 1.959 15.009 786 HA2 GLY 99 HA3 GLY 99 100.402 2.436 16.278 787 HA3 GLY 99 HA2 GLY 99 99.482 1.813 17.668 788 H ASN 100 H ASN 100 100.567 0.098 14.711 789 HA ASN 100 HA ASN 100 101.771 -1.974 16.495 790 HB2 ASN 100 HB2 ASN 100 100.277 -2.510 14.479 791 HB3 ASN 100 HB3 ASN 100 101.629 -1.969 13.454 792 HD21 ASN 100 HD21 ASN 100 100.480 -4.538 15.601 793 HD22 ASN 100 HD22 ASN 100 101.835 -5.613 15.336 794 H GLU 101 H GLU 101 103.307 -2.218 13.669 795 HA GLU 101 HA GLU 101 105.333 -0.152 13.804 796 HB2 GLU 101 HB2 GLU 101 107.041 -1.108 15.054 797 HB3 GLU 101 HB3 GLU 101 105.626 -1.688 15.963 798 HG2 GLU 101 HG3 GLU 101 105.694 -3.761 14.427 799 HG3 GLU 101 HG2 GLU 101 107.311 -3.202 13.935 800 H LEU 102 H LEU 102 106.573 -0.229 11.965 801 HA LEU 102 HA LEU 102 106.659 -2.838 10.454 802 HB2 LEU 102 HB3 LEU 102 104.844 -1.436 9.478 803 HB3 LEU 102 HB2 LEU 102 106.004 -0.105 9.255 804 HG LEU 102 HG LEU 102 107.414 -1.899 7.943 805 HD11 LEU 102 HD11 LEU 102 105.993 -3.826 8.584 806 HD12 LEU 102 HD12 LEU 102 104.601 -3.066 7.776 807 HD13 LEU 102 HD13 LEU 102 106.005 -3.595 6.819 808 HD21 LEU 102 HD21 LEU 102 106.351 0.104 6.936 809 HD22 LEU 102 HD22 LEU 102 106.214 -1.306 5.859 810 HD23 LEU 102 HD23 LEU 102 104.809 -0.777 6.815 811 H ASN 103 H ASN 103 108.824 -3.277 10.420 812 HA ASN 103 HA ASN 103 110.692 -0.926 10.069 813 HB2 ASN 103 HB2 ASN 103 111.471 -2.098 11.941 814 HB3 ASN 103 HB3 ASN 103 110.963 -3.676 11.293 815 HD21 ASN 103 HD21 ASN 103 112.879 -1.145 9.576 816 HD22 ASN 103 HD22 ASN 103 114.305 -2.142 9.390 817 H THR 104 H THR 104 111.054 -0.589 7.916 818 HA THR 104 HA THR 104 111.448 -3.073 6.234 819 HB THR 104 HB THR 104 109.378 -2.006 5.596 820 HG1 THR 104 HG1 THR 104 110.141 -2.400 3.658 821 HG21 THR 104 HG21 THR 104 109.721 0.502 4.731 822 HG22 THR 104 HG22 THR 104 109.380 0.160 6.444 823 HG23 THR 104 HG23 THR 104 111.050 0.478 5.915 824 H VAL 105 H VAL 105 112.544 -2.444 4.085 825 HA VAL 105 HA VAL 105 114.649 -0.339 4.431 826 HB VAL 105 HB VAL 105 115.302 -3.250 3.782 827 HG11 VAL 105 HG11 VAL 105 116.774 -1.570 2.706 828 HG12 VAL 105 HG12 VAL 105 117.642 -2.456 3.982 829 HG13 VAL 105 HG13 VAL 105 117.055 -0.804 4.288 830 HG21 VAL 105 HG21 VAL 105 116.400 -3.280 5.998 831 HG22 VAL 105 HG22 VAL 105 115.845 -1.616 6.302 832 HG23 VAL 105 HG23 VAL 105 114.661 -2.938 6.165 833 H ARG 106 H ARG 106 115.454 0.390 2.383 834 HA ARG 106 HA ARG 106 114.010 -0.839 0.019 835 HB2 ARG 106 HB2 ARG 106 114.369 2.036 0.858 836 HB3 ARG 106 HB3 ARG 106 114.287 1.647 -0.877 837 HG2 ARG 106 HG2 ARG 106 112.154 0.347 -0.377 838 HG3 ARG 106 HG3 ARG 106 112.207 1.035 1.264 839 HD2 ARG 106 HD3 ARG 106 112.206 2.685 -1.302 840 HD3 ARG 106 HD2 ARG 106 110.761 2.354 -0.317 841 HE ARG 106 HE ARG 106 112.412 3.434 1.576 842 HH11 ARG 106 HH11 ARG 106 112.761 5.643 1.900 843 HH12 ARG 106 HH12 ARG 106 112.571 6.763 0.569 844 HH21 ARG 106 HH21 ARG 106 111.711 4.292 -1.726 845 HH22 ARG 106 HH22 ARG 106 111.980 6.002 -1.473 846 H GLU 107 H GLU 107 115.273 -1.392 -1.678 847 HA GLU 107 HA GLU 107 118.066 -0.238 -1.785 848 HB2 GLU 107 HB2 GLU 107 117.171 -3.113 -1.742 849 HB3 GLU 107 HB3 GLU 107 118.559 -2.678 -2.769 850 HG2 GLU 107 HG2 GLU 107 118.471 -1.647 0.062 851 HG3 GLU 107 HG3 GLU 107 118.915 -3.348 -0.214 852 H ILE 108 H ILE 108 118.986 -0.313 -4.002 853 HA ILE 108 HA ILE 108 116.807 -0.506 -6.087 854 HB ILE 108 HB ILE 108 119.167 1.412 -6.128 855 HG12 ILE 108 HG13 ILE 108 116.638 1.517 -4.612 856 HG13 ILE 108 HG12 ILE 108 118.088 2.536 -4.469 857 HG21 ILE 108 HG21 ILE 108 118.009 0.732 -8.270 858 HG22 ILE 108 HG22 ILE 108 117.913 2.472 -7.910 859 HG23 ILE 108 HG23 ILE 108 116.508 1.422 -7.609 860 HD11 ILE 108 HD11 ILE 108 116.256 3.961 -5.156 861 HD12 ILE 108 HD12 ILE 108 117.333 3.755 -6.558 862 HD13 ILE 108 HD13 ILE 108 115.808 2.841 -6.466 863 H ILE 109 H ILE 109 117.578 -2.705 -6.393 864 HA ILE 109 HA ILE 109 120.342 -3.278 -7.035 865 HB ILE 109 HB ILE 109 117.707 -4.674 -7.592 866 HG12 ILE 109 HG12 ILE 109 120.184 -5.496 -6.012 867 HG13 ILE 109 HG13 ILE 109 118.778 -4.670 -5.299 868 HG21 ILE 109 HG21 ILE 109 119.339 -6.611 -8.308 869 HG22 ILE 109 HG22 ILE 109 118.894 -5.369 -9.503 870 HG23 ILE 109 HG23 ILE 109 120.467 -5.284 -8.676 871 HD11 ILE 109 HD11 ILE 109 119.006 -7.471 -6.387 872 HD12 ILE 109 HD12 ILE 109 118.194 -6.891 -4.913 873 HD13 ILE 109 HD13 ILE 109 117.438 -6.637 -6.504 874 H GLY 110 H GLY 110 121.079 -1.713 -8.494 875 HA2 GLY 110 HA2 GLY 110 121.418 -0.748 -10.622 876 HA3 GLY 110 HA3 GLY 110 120.931 -2.336 -11.260 877 H ASP 111 H ASP 111 118.598 -2.708 -11.621 878 HA ASP 111 HA ASP 111 117.106 -0.100 -11.987 879 HB2 ASP 111 HB3 ASP 111 116.806 -2.495 -13.828 880 HB3 ASP 111 HB2 ASP 111 116.313 -0.808 -14.111 881 H GLU 112 H GLU 112 117.025 -2.104 -9.778 882 HA GLU 112 HA GLU 112 114.073 -2.687 -10.003 883 HB2 GLU 112 HB2 GLU 112 116.320 -4.595 -9.339 884 HB3 GLU 112 HB3 GLU 112 114.727 -4.818 -8.578 885 HG2 GLU 112 HG3 GLU 112 113.681 -4.789 -10.855 886 HG3 GLU 112 HG2 GLU 112 115.308 -4.684 -11.569 887 H LEU 113 H LEU 113 112.944 -2.220 -8.104 888 HA LEU 113 HA LEU 113 114.665 -1.132 -5.871 889 HB2 LEU 113 HB2 LEU 113 112.790 0.265 -6.994 890 HB3 LEU 113 HB3 LEU 113 111.661 -0.795 -6.117 891 HG LEU 113 HG LEU 113 113.191 -0.208 -4.038 892 HD11 LEU 113 HD11 LEU 113 114.896 1.003 -5.370 893 HD12 LEU 113 HD12 LEU 113 114.114 2.087 -4.195 894 HD13 LEU 113 HD13 LEU 113 113.653 2.155 -5.913 895 HD21 LEU 113 HD21 LEU 113 111.781 1.946 -3.761 896 HD22 LEU 113 HD22 LEU 113 110.893 0.426 -4.021 897 HD23 LEU 113 HD23 LEU 113 111.115 1.569 -5.367 898 H VAL 114 H VAL 114 115.049 -2.630 -4.320 899 HA VAL 114 HA VAL 114 112.915 -4.679 -3.808 900 HB VAL 114 HB VAL 114 115.620 -4.519 -2.441 901 HG11 VAL 114 HG11 VAL 114 113.934 -6.112 -1.563 902 HG12 VAL 114 HG12 VAL 114 115.298 -6.973 -2.315 903 HG13 VAL 114 HG13 VAL 114 113.755 -6.816 -3.188 904 HG21 VAL 114 HG21 VAL 114 116.211 -6.236 -4.351 905 HG22 VAL 114 HG22 VAL 114 116.325 -4.491 -4.682 906 HG23 VAL 114 HG23 VAL 114 114.909 -5.413 -5.242 907 H GLN 115 H GLN 115 111.372 -3.979 -2.414 908 HA GLN 115 HA GLN 115 112.312 -2.337 -0.051 909 HB2 GLN 115 HB3 GLN 115 110.630 -1.257 -1.595 910 HB3 GLN 115 HB2 GLN 115 109.495 -2.571 -1.204 911 HG2 GLN 115 HG2 GLN 115 109.326 -1.908 1.067 912 HG3 GLN 115 HG3 GLN 115 110.808 -0.925 0.981 913 HE21 GLN 115 HE21 GLN 115 108.434 0.267 1.950 914 HE22 GLN 115 HE22 GLN 115 107.849 1.412 0.764 915 H THR 116 H THR 116 112.701 -3.837 1.544 916 HA THR 116 HA THR 116 110.661 -6.031 1.873 917 HB THR 116 HB THR 116 113.124 -5.911 3.571 918 HG1 THR 116 HG1 THR 116 114.032 -5.396 1.604 919 HG21 THR 116 HG21 THR 116 113.072 -8.356 3.095 920 HG22 THR 116 HG22 THR 116 111.687 -8.100 2.006 921 HG23 THR 116 HG23 THR 116 111.522 -7.774 3.748 922 H TYR 117 H TYR 117 109.505 -6.253 3.767 923 HA TYR 117 HA TYR 117 109.949 -4.074 5.816 924 HB2 TYR 117 HB3 TYR 117 107.196 -5.142 5.665 925 HB3 TYR 117 HB2 TYR 117 107.761 -3.462 5.816 926 HD1 TYR 117 HD1 TYR 117 107.839 -6.246 3.317 927 HD2 TYR 117 HD2 TYR 117 107.324 -2.051 4.029 928 HE1 TYR 117 HE1 TYR 117 107.361 -5.901 0.908 929 HE2 TYR 117 HE2 TYR 117 106.850 -1.693 1.622 930 HH TYR 117 HH TYR 117 107.445 -2.958 -0.598 931 H VAL 118 H VAL 118 109.663 -4.656 7.944 932 HA VAL 118 HA VAL 118 109.437 -7.636 8.422 933 HB VAL 118 HB VAL 118 110.731 -5.600 10.271 934 HG11 VAL 118 HG11 VAL 118 111.399 -7.418 11.535 935 HG12 VAL 118 HG12 VAL 118 111.460 -8.509 10.130 936 HG13 VAL 118 HG13 VAL 118 109.893 -8.084 10.860 937 HG21 VAL 118 HG21 VAL 118 111.922 -5.597 8.101 938 HG22 VAL 118 HG22 VAL 118 112.064 -7.369 8.179 939 HG23 VAL 118 HG23 VAL 118 112.904 -6.356 9.377 940 H TYR 119 H TYR 119 108.188 -8.290 10.198 941 HA TYR 119 HA TYR 119 106.636 -6.120 11.560 942 HB2 TYR 119 HB2 TYR 119 105.542 -7.273 9.366 943 HB3 TYR 119 HB3 TYR 119 105.020 -8.438 10.607 944 HD1 TYR 119 HD1 TYR 119 103.807 -7.592 12.641 945 HD2 TYR 119 HD2 TYR 119 104.544 -5.113 9.218 946 HE1 TYR 119 HE1 TYR 119 102.033 -6.033 13.392 947 HE2 TYR 119 HE2 TYR 119 102.777 -3.544 9.971 948 HH TYR 119 HH TYR 119 100.593 -3.802 11.498 949 H GLU 120 H GLU 120 107.052 -6.508 13.612 950 HA GLU 120 HA GLU 120 107.368 -7.668 15.634 951 HB2 GLU 120 HB3 GLU 120 105.046 -9.107 14.325 952 HB3 GLU 120 HB2 GLU 120 105.637 -9.581 15.936 953 HG2 GLU 120 HG2 GLU 120 105.390 -7.167 16.652 954 HG3 GLU 120 HG3 GLU 120 104.611 -6.839 15.085 955 H GLY 121 H GLY 121 108.755 -8.715 13.062 956 HA2 GLY 121 HA2 GLY 121 110.673 -10.287 13.420 957 HA3 GLY 121 HA3 GLY 121 109.566 -11.335 14.339 958 H VAL 122 H VAL 122 108.528 -9.691 11.424 959 HA VAL 122 HA VAL 122 108.682 -12.342 9.986 960 HB VAL 122 HB VAL 122 106.335 -11.238 10.736 961 HG11 VAL 122 HG11 VAL 122 106.637 -10.156 7.925 962 HG12 VAL 122 HG12 VAL 122 105.406 -9.767 9.151 963 HG13 VAL 122 HG13 VAL 122 107.067 -9.154 9.332 964 HG21 VAL 122 HG21 VAL 122 105.322 -12.452 8.830 965 HG22 VAL 122 HG22 VAL 122 106.909 -12.510 8.028 966 HG23 VAL 122 HG23 VAL 122 106.653 -13.383 9.558 967 H GLU 123 H GLU 123 108.384 -11.787 7.493 968 HA GLU 123 HA GLU 123 109.601 -9.158 6.860 969 HB2 GLU 123 HB2 GLU 123 111.678 -9.944 6.019 970 HB3 GLU 123 HB3 GLU 123 111.483 -10.763 7.587 971 HG2 GLU 123 HG3 GLU 123 110.348 -12.663 6.193 972 HG3 GLU 123 HG2 GLU 123 111.136 -11.892 4.796 973 H ALA 124 H ALA 124 108.690 -8.483 5.029 974 HA ALA 124 HA ALA 124 107.942 -10.580 2.973 975 HB1 ALA 124 HB1 ALA 124 106.438 -8.246 2.450 976 HB2 ALA 124 HB2 ALA 124 106.358 -8.460 4.215 977 HB3 ALA 124 HB3 ALA 124 105.831 -9.772 3.134 978 H LYS 125 H LYS 125 108.294 -9.900 0.710 979 HA LYS 125 HA LYS 125 110.087 -7.472 0.535 980 HB2 LYS 125 HB3 LYS 125 111.241 -9.832 0.549 981 HB3 LYS 125 HB2 LYS 125 110.639 -9.934 -1.122 982 HG2 LYS 125 HG2 LYS 125 111.864 -7.990 -1.791 983 HG3 LYS 125 HG3 LYS 125 112.196 -7.526 -0.105 984 HD2 LYS 125 HD2 LYS 125 114.232 -8.501 -0.771 985 HD3 LYS 125 HD3 LYS 125 113.403 -9.857 0.029 986 HE2 LYS 125 HE2 LYS 125 112.462 -10.384 -2.353 987 HE3 LYS 125 HE3 LYS 125 113.781 -9.339 -2.933 988 HZ1 LYS 125 HZ1 LYS 125 115.318 -10.832 -2.305 989 HZ2 LYS 125 HZ2 LYS 125 114.490 -11.344 -0.974 990 HZ3 LYS 125 HZ3 LYS 125 114.084 -11.914 -2.468 991 H ARG 126 H ARG 126 109.848 -6.212 -1.242 992 HA ARG 126 HA ARG 126 108.042 -7.222 -3.445 993 HB2 ARG 126 HB2 ARG 126 107.217 -5.382 -1.543 994 HB3 ARG 126 HB3 ARG 126 107.840 -4.327 -2.834 995 HG2 ARG 126 HG2 ARG 126 106.403 -5.429 -4.483 996 HG3 ARG 126 HG3 ARG 126 105.847 -6.597 -3.261 997 HD2 ARG 126 HD2 ARG 126 105.410 -3.577 -3.205 998 HD3 ARG 126 HD3 ARG 126 104.174 -4.815 -3.535 999 HE ARG 126 HE ARG 126 105.259 -5.515 -1.021 1000 HH11 ARG 126 HH11 ARG 126 104.303 -4.772 0.889 1001 HH12 ARG 126 HH12 ARG 126 103.315 -3.328 0.868 1002 HH21 ARG 126 HH21 ARG 126 103.735 -2.780 -2.546 1003 HH22 ARG 126 HH22 ARG 126 102.995 -2.206 -1.069 1004 H ILE 127 H ILE 127 109.319 -7.208 -5.253 1005 HA ILE 127 HA ILE 127 111.489 -5.112 -5.370 1006 HB ILE 127 HB ILE 127 111.196 -7.624 -7.064 1007 HG12 ILE 127 HG12 ILE 127 113.339 -7.704 -5.106 1008 HG13 ILE 127 HG13 ILE 127 111.787 -7.418 -4.283 1009 HG21 ILE 127 HG21 ILE 127 113.606 -7.221 -7.497 1010 HG22 ILE 127 HG22 ILE 127 112.622 -5.830 -8.009 1011 HG23 ILE 127 HG23 ILE 127 113.542 -5.757 -6.487 1012 HD11 ILE 127 HD11 ILE 127 112.231 -9.846 -4.526 1013 HD12 ILE 127 HD12 ILE 127 110.801 -9.361 -5.468 1014 HD13 ILE 127 HD13 ILE 127 112.353 -9.646 -6.291 1015 H PHE 128 H PHE 128 111.232 -3.441 -6.716 1016 HA PHE 128 HA PHE 128 109.085 -3.613 -8.811 1017 HB2 PHE 128 HB2 PHE 128 110.800 -1.205 -8.072 1018 HB3 PHE 128 HB3 PHE 128 109.264 -1.207 -8.967 1019 HD1 PHE 128 HD1 PHE 128 108.211 -3.499 -6.965 1020 HD2 PHE 128 HD2 PHE 128 109.779 0.463 -6.502 1021 HE1 PHE 128 HE1 PHE 128 106.956 -3.256 -4.843 1022 HE2 PHE 128 HE2 PHE 128 108.527 0.712 -4.373 1023 HZ PHE 128 HZ PHE 128 107.113 -1.150 -3.544 1024 H LYS 129 H LYS 129 109.730 -2.289 -10.884 1025 HA LYS 129 HA LYS 129 112.549 -2.462 -11.707 1026 HB2 LYS 129 HB2 LYS 129 111.683 -4.880 -11.831 1027 HB3 LYS 129 HB3 LYS 129 110.601 -4.320 -13.128 1028 HG2 LYS 129 HG3 LYS 129 112.860 -3.280 -14.095 1029 HG3 LYS 129 HG2 LYS 129 113.604 -4.559 -13.105 1030 HD2 LYS 129 HD2 LYS 129 112.238 -6.264 -14.231 1031 HD3 LYS 129 HD3 LYS 129 111.407 -5.004 -15.175 1032 HE2 LYS 129 HE2 LYS 129 113.527 -4.370 -16.245 1033 HE3 LYS 129 HE3 LYS 129 114.406 -5.559 -15.254 1034 HZ1 LYS 129 HZ1 LYS 129 113.886 -6.428 -17.435 1035 HZ2 LYS 129 HZ2 LYS 129 113.087 -7.289 -16.278 1036 HZ3 LYS 129 HZ3 LYS 129 112.272 -6.187 -17.196 1037 H LYS 130 H LYS 130 112.871 -1.359 -13.711 1038 HA LYS 130 HA LYS 130 111.119 0.757 -14.332 1039 HB2 LYS 130 HB2 LYS 130 113.075 -0.777 -16.083 1040 HB3 LYS 130 HB3 LYS 130 112.197 0.653 -16.674 1041 HG2 LYS 130 HG3 LYS 130 113.089 1.732 -14.409 1042 HG3 LYS 130 HG2 LYS 130 114.320 0.453 -14.541 1043 HD2 LYS 130 HD2 LYS 130 113.649 2.284 -16.873 1044 HD3 LYS 130 HD3 LYS 130 114.868 2.722 -15.652 1045 HE2 LYS 130 HE3 LYS 130 115.005 -0.005 -16.934 1046 HE3 LYS 130 HE2 LYS 130 115.574 1.407 -17.855 1047 HZ1 LYS 130 HZ1 LYS 130 116.902 1.953 -15.823 1048 HZ2 LYS 130 HZ2 LYS 130 117.398 0.614 -16.647 1049 HZ3 LYS 130 HZ3 LYS 130 116.543 0.450 -15.246 1050 H ASP 131 H ASP 131 109.227 0.972 -15.462 1051 HA ASP 131 HA ASP 131 107.786 -1.471 -16.212 1052 HB2 ASP 131 HB2 ASP 131 106.565 0.469 -15.354 1053 HB3 ASP 131 HB3 ASP 131 107.172 1.479 -16.688 Start of MODEL 16 1 H1 ALA 1 H1 ALA 1 113.029 4.274 -4.159 2 H2 ALA 1 H2 ALA 1 113.817 3.593 -5.438 3 H3 ALA 1 H3 ALA 1 112.337 4.288 -5.656 4 HA ALA 1 HA ALA 1 113.122 6.448 -5.403 5 HB1 ALA 1 HB1 ALA 1 115.433 6.877 -4.612 6 HB2 ALA 1 HB2 ALA 1 114.503 5.956 -3.407 7 HB3 ALA 1 HB3 ALA 1 115.696 5.126 -4.434 8 H PHE 2 H PHE 2 113.059 4.378 -7.511 9 HA PHE 2 HA PHE 2 115.514 4.545 -9.083 10 HB2 PHE 2 HB3 PHE 2 112.705 3.636 -9.490 11 HB3 PHE 2 HB2 PHE 2 113.555 4.169 -10.955 12 HD1 PHE 2 HD1 PHE 2 112.723 1.353 -9.273 13 HD2 PHE 2 HD2 PHE 2 116.243 3.308 -10.764 14 HE1 PHE 2 HE1 PHE 2 113.867 -0.839 -9.431 15 HE2 PHE 2 HE2 PHE 2 117.397 1.118 -10.909 16 HZ PHE 2 HZ PHE 2 116.210 -0.956 -10.243 17 H ASP 3 H ASP 3 113.899 7.045 -8.052 18 HA ASP 3 HA ASP 3 113.224 9.144 -8.972 19 HB2 ASP 3 HB3 ASP 3 115.798 9.041 -9.073 20 HB3 ASP 3 HB2 ASP 3 115.608 8.673 -10.804 21 H SER 4 H SER 4 111.646 7.154 -10.097 22 HA SER 4 HA SER 4 110.890 8.364 -12.631 23 HB2 SER 4 HB3 SER 4 111.866 7.049 -14.217 24 HB3 SER 4 HB2 SER 4 113.062 6.704 -12.944 25 HG SER 4 HG SER 4 112.369 4.715 -13.484 26 H THR 5 H THR 5 109.843 5.865 -13.798 27 HA THR 5 HA THR 5 107.645 5.403 -11.774 28 HB THR 5 HB THR 5 107.700 5.172 -14.812 29 HG1 THR 5 HG1 THR 5 106.358 6.933 -14.684 30 HG21 THR 5 HG21 THR 5 105.304 4.568 -14.615 31 HG22 THR 5 HG22 THR 5 105.454 4.558 -12.841 32 HG23 THR 5 HG23 THR 5 106.337 3.358 -13.816 33 H TRP 6 H TRP 6 107.392 3.405 -10.927 34 HA TRP 6 HA TRP 6 108.493 1.043 -12.428 35 HB2 TRP 6 HB2 TRP 6 109.192 1.788 -9.552 36 HB3 TRP 6 HB3 TRP 6 109.560 0.217 -10.308 37 HD1 TRP 6 HD1 TRP 6 110.162 3.978 -11.050 38 HE1 TRP 6 HE1 TRP 6 112.444 4.243 -12.212 39 HE3 TRP 6 HE3 TRP 6 111.530 -0.932 -11.281 40 HZ2 TRP 6 HZ2 TRP 6 114.599 2.537 -13.076 41 HZ3 TRP 6 HZ3 TRP 6 113.709 -1.585 -12.265 42 HH2 TRP 6 HH2 TRP 6 115.244 0.141 -13.165 43 H LYS 7 H LYS 7 107.705 -1.062 -11.288 44 HA LYS 7 HA LYS 7 105.268 -0.623 -9.621 45 HB2 LYS 7 HB3 LYS 7 103.682 -1.377 -11.158 46 HB3 LYS 7 HB2 LYS 7 104.774 -0.456 -12.219 47 HG2 LYS 7 HG2 LYS 7 106.038 -2.680 -12.572 48 HG3 LYS 7 HG3 LYS 7 104.625 -3.468 -11.829 49 HD2 LYS 7 HD2 LYS 7 103.211 -2.147 -13.550 50 HD3 LYS 7 HD3 LYS 7 104.749 -1.839 -14.391 51 HE2 LYS 7 HE3 LYS 7 103.822 -3.825 -15.384 52 HE3 LYS 7 HE2 LYS 7 105.144 -4.367 -14.323 53 HZ1 LYS 7 HZ1 LYS 7 103.152 -5.675 -14.002 54 HZ2 LYS 7 HZ2 LYS 7 102.279 -4.332 -13.610 55 HZ3 LYS 7 HZ3 LYS 7 103.505 -4.835 -12.627 56 H VAL 8 H VAL 8 104.826 -2.367 -8.325 57 HA VAL 8 HA VAL 8 106.664 -4.323 -7.677 58 HB VAL 8 HB VAL 8 104.805 -4.354 -6.284 59 HG11 VAL 8 HG11 VAL 8 102.432 -4.633 -7.312 60 HG12 VAL 8 HG12 VAL 8 103.207 -4.221 -8.860 61 HG13 VAL 8 HG13 VAL 8 103.242 -3.060 -7.511 62 HG21 VAL 8 HG21 VAL 8 103.876 -6.540 -6.345 63 HG22 VAL 8 HG22 VAL 8 103.928 -6.606 -8.123 64 HG23 VAL 8 HG23 VAL 8 105.437 -6.710 -7.184 65 H ASP 9 H ASP 9 107.822 -5.483 -9.119 66 HA ASP 9 HA ASP 9 106.367 -6.806 -11.390 67 HB2 ASP 9 HB3 ASP 9 108.530 -5.546 -11.794 68 HB3 ASP 9 HB2 ASP 9 109.357 -6.751 -10.779 69 H ARG 10 H ARG 10 108.144 -7.428 -8.400 70 HA ARG 10 HA ARG 10 107.026 -10.198 -8.408 71 HB2 ARG 10 HB2 ARG 10 110.001 -9.807 -7.925 72 HB3 ARG 10 HB3 ARG 10 109.111 -11.331 -8.150 73 HG2 ARG 10 HG2 ARG 10 108.567 -10.614 -10.494 74 HG3 ARG 10 HG3 ARG 10 109.579 -9.170 -10.253 75 HD2 ARG 10 HD2 ARG 10 111.558 -10.389 -10.238 76 HD3 ARG 10 HD3 ARG 10 110.768 -11.863 -9.628 77 HE ARG 10 HE ARG 10 111.075 -11.099 -12.458 78 HH11 ARG 10 HH11 ARG 10 110.184 -12.559 -13.935 79 HH12 ARG 10 HH12 ARG 10 109.059 -13.782 -13.387 80 HH21 ARG 10 HH21 ARG 10 109.184 -12.771 -10.057 81 HH22 ARG 10 HH22 ARG 10 108.496 -13.902 -11.202 82 H SER 11 H SER 11 107.882 -11.296 -6.208 83 HA SER 11 HA SER 11 108.512 -9.482 -4.011 84 HB2 SER 11 HB3 SER 11 105.607 -10.352 -4.346 85 HB3 SER 11 HB2 SER 11 106.284 -9.665 -2.849 86 HG SER 11 HG SER 11 105.945 -8.432 -5.381 87 H GLU 12 H GLU 12 107.883 -10.737 -1.809 88 HA GLU 12 HA GLU 12 107.890 -13.691 -2.250 89 HB2 GLU 12 HB2 GLU 12 110.034 -14.123 -1.571 90 HB3 GLU 12 HB3 GLU 12 110.328 -12.478 -2.178 91 HG2 GLU 12 HG2 GLU 12 109.707 -11.681 0.207 92 HG3 GLU 12 HG3 GLU 12 109.897 -13.383 0.690 93 H ASN 13 H ASN 13 107.295 -14.867 -0.378 94 HA ASN 13 HA ASN 13 106.224 -15.164 1.703 95 HB2 ASN 13 HB2 ASN 13 108.346 -13.944 2.473 96 HB3 ASN 13 HB3 ASN 13 107.367 -12.458 2.496 97 HD21 ASN 13 HD21 ASN 13 108.550 -13.703 4.876 98 HD22 ASN 13 HD22 ASN 13 107.218 -14.203 5.894 99 H TYR 14 H TYR 14 105.901 -11.823 2.494 100 HA TYR 14 HA TYR 14 104.042 -10.370 2.390 101 HB2 TYR 14 HB2 TYR 14 104.051 -11.731 -0.133 102 HB3 TYR 14 HB3 TYR 14 102.365 -11.650 0.428 103 HD1 TYR 14 HD1 TYR 14 105.110 -9.226 1.192 104 HD2 TYR 14 HD2 TYR 14 101.484 -9.959 -0.992 105 HE1 TYR 14 HE1 TYR 14 105.014 -6.835 0.547 106 HE2 TYR 14 HE2 TYR 14 101.388 -7.566 -1.634 107 HH TYR 14 HH TYR 14 103.135 -5.170 -0.154 108 H ASP 15 H ASP 15 103.175 -13.850 2.066 109 HA ASP 15 HA ASP 15 100.593 -13.530 3.336 110 HB2 ASP 15 HB2 ASP 15 102.462 -15.941 3.281 111 HB3 ASP 15 HB3 ASP 15 100.752 -15.981 3.773 112 H LYS 16 H LYS 16 103.813 -14.438 4.645 113 HA LYS 16 HA LYS 16 102.932 -14.616 7.388 114 HB2 LYS 16 HB2 LYS 16 105.652 -13.670 6.376 115 HB3 LYS 16 HB3 LYS 16 105.291 -14.360 7.976 116 HG2 LYS 16 HG3 LYS 16 104.592 -15.941 5.502 117 HG3 LYS 16 HG2 LYS 16 106.283 -15.896 6.053 118 HD2 LYS 16 HD2 LYS 16 105.477 -16.587 8.348 119 HD3 LYS 16 HD3 LYS 16 103.851 -16.800 7.656 120 HE2 LYS 16 HE2 LYS 16 105.224 -18.929 7.765 121 HE3 LYS 16 HE3 LYS 16 104.652 -18.511 6.132 122 HZ1 LYS 16 HZ1 LYS 16 107.126 -19.110 6.553 123 HZ2 LYS 16 HZ2 LYS 16 107.255 -17.530 7.009 124 HZ3 LYS 16 HZ3 LYS 16 106.737 -17.911 5.490 125 H PHE 17 H PHE 17 103.986 -11.915 5.342 126 HA PHE 17 HA PHE 17 103.969 -9.924 7.475 127 HB2 PHE 17 HB2 PHE 17 105.122 -9.596 5.311 128 HB3 PHE 17 HB3 PHE 17 103.561 -9.664 4.462 129 HD1 PHE 17 HD1 PHE 17 105.705 -7.710 6.709 130 HD2 PHE 17 HD2 PHE 17 101.981 -7.801 4.588 131 HE1 PHE 17 HE1 PHE 17 105.430 -5.277 7.097 132 HE2 PHE 17 HE2 PHE 17 101.695 -5.367 4.978 133 HZ PHE 17 HZ PHE 17 103.424 -4.103 6.232 134 H MET 18 H MET 18 101.721 -10.377 4.724 135 HA MET 18 HA MET 18 99.620 -8.759 5.773 136 HB2 MET 18 HB3 MET 18 99.713 -11.110 3.876 137 HB3 MET 18 HB2 MET 18 98.137 -10.476 4.406 138 HG2 MET 18 HG2 MET 18 98.583 -9.228 2.452 139 HG3 MET 18 HG3 MET 18 99.120 -8.139 3.753 140 HE1 MET 18 HE1 MET 18 100.665 -6.720 2.933 141 HE2 MET 18 HE2 MET 18 102.036 -7.033 1.843 142 HE3 MET 18 HE3 MET 18 100.369 -7.157 1.233 143 H GLU 19 H GLU 19 100.673 -11.988 6.668 144 HA GLU 19 HA GLU 19 98.158 -12.625 8.089 145 HB2 GLU 19 HB3 GLU 19 99.532 -14.457 7.239 146 HB3 GLU 19 HB2 GLU 19 100.938 -13.879 8.164 147 HG2 GLU 19 HG2 GLU 19 99.837 -14.354 10.270 148 HG3 GLU 19 HG3 GLU 19 98.300 -14.708 9.445 149 H LYS 20 H LYS 20 101.207 -11.027 8.799 150 HA LYS 20 HA LYS 20 100.929 -11.222 11.712 151 HB2 LYS 20 HB3 LYS 20 102.846 -10.196 9.834 152 HB3 LYS 20 HB2 LYS 20 102.418 -8.878 10.951 153 HG2 LYS 20 HG2 LYS 20 104.227 -10.048 11.999 154 HG3 LYS 20 HG3 LYS 20 102.757 -10.577 12.853 155 HD2 LYS 20 HD3 LYS 20 102.681 -12.641 11.575 156 HD3 LYS 20 HD2 LYS 20 104.000 -12.089 10.515 157 HE2 LYS 20 HE2 LYS 20 104.253 -13.575 12.908 158 HE3 LYS 20 HE3 LYS 20 105.566 -12.810 11.981 159 HZ1 LYS 20 HZ1 LYS 20 105.472 -12.089 14.304 160 HZ2 LYS 20 HZ2 LYS 20 105.276 -10.829 13.258 161 HZ3 LYS 20 HZ3 LYS 20 103.972 -11.447 14.057 162 H MET 21 H MET 21 100.134 -8.735 9.255 163 HA MET 21 HA MET 21 99.090 -6.848 11.218 164 HB2 MET 21 HB2 MET 21 97.788 -6.722 8.583 165 HB3 MET 21 HB3 MET 21 98.790 -5.508 9.409 166 HG2 MET 21 HG2 MET 21 100.836 -6.713 8.705 167 HG3 MET 21 HG3 MET 21 99.835 -7.935 7.884 168 HE1 MET 21 HE1 MET 21 100.435 -3.514 6.752 169 HE2 MET 21 HE2 MET 21 99.731 -4.034 8.302 170 HE3 MET 21 HE3 MET 21 101.406 -4.476 7.893 171 H GLY 22 H GLY 22 98.009 -9.887 10.271 172 HA2 GLY 22 HA2 GLY 22 96.009 -10.997 10.920 173 HA3 GLY 22 HA3 GLY 22 95.448 -9.483 11.669 174 H VAL 23 H VAL 23 96.524 -9.713 8.298 175 HA VAL 23 HA VAL 23 93.941 -8.591 7.417 176 HB VAL 23 HB VAL 23 96.178 -9.723 5.686 177 HG11 VAL 23 HG11 VAL 23 95.196 -7.598 4.349 178 HG12 VAL 23 HG12 VAL 23 94.476 -9.219 4.203 179 HG13 VAL 23 HG13 VAL 23 93.743 -8.015 5.289 180 HG21 VAL 23 HG21 VAL 23 97.100 -8.104 7.325 181 HG22 VAL 23 HG22 VAL 23 95.858 -6.920 6.855 182 HG23 VAL 23 HG23 VAL 23 97.100 -7.420 5.682 183 H ASN 24 H ASN 24 92.556 -9.639 5.789 184 HA ASN 24 HA ASN 24 92.056 -12.449 6.498 185 HB2 ASN 24 HB3 ASN 24 90.381 -10.554 5.730 186 HB3 ASN 24 HB2 ASN 24 90.831 -11.088 4.092 187 HD21 ASN 24 HD21 ASN 24 90.556 -13.501 3.640 188 HD22 ASN 24 HD22 ASN 24 89.267 -14.342 4.471 189 H ILE 25 H ILE 25 91.631 -14.010 4.498 190 HA ILE 25 HA ILE 25 94.260 -14.182 3.117 191 HB ILE 25 HB ILE 25 91.869 -15.973 3.492 192 HG12 ILE 25 HG12 ILE 25 94.059 -15.823 4.920 193 HG13 ILE 25 HG13 ILE 25 93.452 -17.429 4.454 194 HG21 ILE 25 HG21 ILE 25 92.948 -17.576 1.843 195 HG22 ILE 25 HG22 ILE 25 93.948 -16.216 1.280 196 HG23 ILE 25 HG23 ILE 25 92.178 -16.153 1.103 197 HD11 ILE 25 HD11 ILE 25 95.995 -16.881 4.098 198 HD12 ILE 25 HD12 ILE 25 95.105 -17.713 2.800 199 HD13 ILE 25 HD13 ILE 25 95.424 -15.966 2.682 200 H VAL 26 H VAL 26 91.471 -12.569 2.589 201 HA VAL 26 HA VAL 26 91.170 -13.060 -0.307 202 HB VAL 26 HB VAL 26 90.135 -10.755 1.403 203 HG11 VAL 26 HG11 VAL 26 90.090 -10.342 -1.042 204 HG12 VAL 26 HG12 VAL 26 88.445 -10.564 -0.401 205 HG13 VAL 26 HG13 VAL 26 89.241 -11.886 -1.287 206 HG21 VAL 26 HG21 VAL 26 88.051 -12.095 1.533 207 HG22 VAL 26 HG22 VAL 26 89.417 -12.965 2.271 208 HG23 VAL 26 HG23 VAL 26 88.848 -13.418 0.646 209 H LYS 27 H LYS 27 92.167 -10.173 1.601 210 HA LYS 27 HA LYS 27 93.282 -8.808 -0.697 211 HB2 LYS 27 HB2 LYS 27 94.177 -8.521 2.204 212 HB3 LYS 27 HB3 LYS 27 94.291 -7.303 0.911 213 HG2 LYS 27 HG2 LYS 27 91.702 -7.544 0.746 214 HG3 LYS 27 HG3 LYS 27 91.818 -8.329 2.339 215 HD2 LYS 27 HD3 LYS 27 93.308 -6.203 2.919 216 HD3 LYS 27 HD2 LYS 27 92.417 -5.477 1.561 217 HE2 LYS 27 HE2 LYS 27 91.001 -4.969 3.351 218 HE3 LYS 27 HE3 LYS 27 90.308 -6.510 2.794 219 HZ1 LYS 27 HZ1 LYS 27 90.655 -6.499 5.174 220 HZ2 LYS 27 HZ2 LYS 27 91.623 -7.631 4.466 221 HZ3 LYS 27 HZ3 LYS 27 92.266 -6.202 4.982 222 H ARG 28 H ARG 28 94.488 -11.297 1.463 223 HA ARG 28 HA ARG 28 97.312 -10.960 0.793 224 HB2 ARG 28 HB2 ARG 28 96.420 -12.217 2.796 225 HB3 ARG 28 HB3 ARG 28 95.864 -13.492 1.685 226 HG2 ARG 28 HG3 ARG 28 98.375 -13.389 0.819 227 HG3 ARG 28 HG2 ARG 28 98.676 -12.692 2.428 228 HD2 ARG 28 HD2 ARG 28 98.924 -14.972 2.877 229 HD3 ARG 28 HD3 ARG 28 97.199 -14.738 3.250 230 HE ARG 28 HE ARG 28 97.152 -15.404 0.551 231 HH11 ARG 28 HH11 ARG 28 97.085 -17.541 -0.184 232 HH12 ARG 28 HH12 ARG 28 97.711 -18.830 0.819 233 HH21 ARG 28 HH21 ARG 28 98.641 -16.706 3.417 234 HH22 ARG 28 HH22 ARG 28 98.588 -18.360 2.848 235 H LYS 29 H LYS 29 94.660 -13.003 -0.491 236 HA LYS 29 HA LYS 29 96.351 -14.419 -2.388 237 HB2 LYS 29 HB2 LYS 29 94.000 -15.071 -1.630 238 HB3 LYS 29 HB3 LYS 29 93.387 -13.796 -2.710 239 HG2 LYS 29 HG2 LYS 29 94.896 -14.966 -4.519 240 HG3 LYS 29 HG3 LYS 29 94.835 -16.359 -3.413 241 HD2 LYS 29 HD3 LYS 29 92.340 -16.235 -3.437 242 HD3 LYS 29 HD2 LYS 29 92.437 -14.895 -4.604 243 HE2 LYS 29 HE3 LYS 29 92.078 -16.918 -5.876 244 HE3 LYS 29 HE2 LYS 29 93.777 -16.446 -6.115 245 HZ1 LYS 29 HZ1 LYS 29 93.568 -18.788 -5.607 246 HZ2 LYS 29 HZ2 LYS 29 92.813 -18.456 -4.179 247 HZ3 LYS 29 HZ3 LYS 29 94.387 -18.018 -4.401 248 H LEU 30 H LEU 30 94.568 -11.347 -2.503 249 HA LEU 30 HA LEU 30 95.214 -11.016 -5.390 250 HB2 LEU 30 HB2 LEU 30 93.986 -9.024 -3.439 251 HB3 LEU 30 HB3 LEU 30 94.006 -8.902 -5.215 252 HG LEU 30 HG LEU 30 92.651 -11.104 -3.593 253 HD11 LEU 30 HD11 LEU 30 91.485 -8.917 -3.477 254 HD12 LEU 30 HD12 LEU 30 90.562 -10.082 -4.456 255 HD13 LEU 30 HD13 LEU 30 91.515 -8.807 -5.253 256 HD21 LEU 30 HD21 LEU 30 91.644 -11.375 -6.066 257 HD22 LEU 30 HD22 LEU 30 93.150 -12.190 -5.581 258 HD23 LEU 30 HD23 LEU 30 93.218 -10.677 -6.515 259 H ALA 31 H ALA 31 96.674 -10.487 -2.414 260 HA ALA 31 HA ALA 31 98.223 -8.094 -3.162 261 HB1 ALA 31 HB1 ALA 31 99.632 -8.997 -1.109 262 HB2 ALA 31 HB2 ALA 31 98.014 -8.306 -0.842 263 HB3 ALA 31 HB3 ALA 31 98.232 -10.072 -0.880 264 H ALA 32 H ALA 32 98.924 -11.613 -2.883 265 HA ALA 32 HA ALA 32 101.670 -11.521 -3.601 266 HB1 ALA 32 HB1 ALA 32 100.892 -13.650 -2.987 267 HB2 ALA 32 HB2 ALA 32 101.083 -13.819 -4.749 268 HB3 ALA 32 HB3 ALA 32 99.469 -13.545 -4.051 269 H HIS 33 H HIS 33 99.005 -12.278 -5.900 270 HA HIS 33 HA HIS 33 100.756 -11.583 -8.176 271 HB2 HIS 33 HB2 HIS 33 97.777 -11.815 -8.491 272 HB3 HIS 33 HB3 HIS 33 99.081 -12.475 -9.507 273 HD2 HIS 33 HD2 HIS 33 100.650 -14.417 -7.480 274 HE1 HIS 33 HE1 HIS 33 96.882 -15.993 -6.404 275 HE2 HIS 33 HE2 HIS 33 99.399 -16.422 -6.336 276 H ASP 34 H ASP 34 100.641 -9.387 -6.470 277 HA ASP 34 HA ASP 34 98.574 -7.536 -7.572 278 HB2 ASP 34 HB2 ASP 34 99.017 -7.304 -5.213 279 HB3 ASP 34 HB3 ASP 34 100.774 -7.230 -5.488 280 H ASN 35 H ASN 35 99.241 -5.436 -8.492 281 HA ASN 35 HA ASN 35 101.998 -5.421 -9.686 282 HB2 ASN 35 HB3 ASN 35 99.377 -5.568 -11.180 283 HB3 ASN 35 HB2 ASN 35 100.718 -4.625 -11.873 284 HD21 ASN 35 HD21 ASN 35 101.156 -6.136 -13.605 285 HD22 ASN 35 HD22 ASN 35 101.817 -7.725 -13.287 286 H LEU 36 H LEU 36 101.013 -3.866 -7.556 287 HA LEU 36 HA LEU 36 99.774 -1.405 -8.273 288 HB2 LEU 36 HB2 LEU 36 100.067 -1.027 -6.073 289 HB3 LEU 36 HB3 LEU 36 101.016 -2.526 -5.984 290 HG LEU 36 HG LEU 36 102.999 -1.024 -6.832 291 HD11 LEU 36 HD11 LEU 36 101.984 1.261 -5.358 292 HD12 LEU 36 HD12 LEU 36 100.889 0.886 -6.710 293 HD13 LEU 36 HD13 LEU 36 102.614 1.196 -7.022 294 HD21 LEU 36 HD21 LEU 36 103.523 -0.425 -4.480 295 HD22 LEU 36 HD22 LEU 36 102.842 -2.066 -4.586 296 HD23 LEU 36 HD23 LEU 36 101.826 -0.715 -4.029 297 H LYS 37 H LYS 37 100.571 0.624 -8.875 298 HA LYS 37 HA LYS 37 103.359 0.587 -10.068 299 HB2 LYS 37 HB2 LYS 37 100.877 0.968 -11.358 300 HB3 LYS 37 HB3 LYS 37 101.538 2.609 -11.168 301 HG2 LYS 37 HG2 LYS 37 103.767 1.553 -12.054 302 HG3 LYS 37 HG3 LYS 37 102.720 0.238 -12.638 303 HD2 LYS 37 HD2 LYS 37 102.952 1.866 -14.429 304 HD3 LYS 37 HD3 LYS 37 101.296 1.986 -13.789 305 HE2 LYS 37 HE3 LYS 37 103.317 3.721 -12.450 306 HE3 LYS 37 HE2 LYS 37 102.947 4.139 -14.140 307 HZ1 LYS 37 HZ1 LYS 37 101.448 5.227 -12.605 308 HZ2 LYS 37 HZ2 LYS 37 100.615 4.166 -13.555 309 HZ3 LYS 37 HZ3 LYS 37 100.957 3.778 -11.989 310 H LEU 38 H LEU 38 104.682 2.353 -9.544 311 HA LEU 38 HA LEU 38 103.391 4.652 -8.118 312 HB2 LEU 38 HB3 LEU 38 105.046 4.484 -6.251 313 HB3 LEU 38 HB2 LEU 38 103.936 3.095 -6.307 314 HG LEU 38 HG LEU 38 106.474 2.849 -7.880 315 HD11 LEU 38 HD11 LEU 38 106.584 2.248 -4.926 316 HD12 LEU 38 HD12 LEU 38 107.913 2.566 -6.065 317 HD13 LEU 38 HD13 LEU 38 106.903 3.909 -5.480 318 HD21 LEU 38 HD21 LEU 38 104.768 1.049 -7.776 319 HD22 LEU 38 HD22 LEU 38 104.929 1.002 -6.004 320 HD23 LEU 38 HD23 LEU 38 106.299 0.526 -7.035 321 H THR 39 H THR 39 104.718 6.535 -8.050 322 HA THR 39 HA THR 39 107.082 6.396 -9.938 323 HB THR 39 HB THR 39 105.622 8.966 -9.338 324 HG1 THR 39 HG1 THR 39 103.912 7.678 -9.905 325 HG21 THR 39 HG21 THR 39 106.283 9.433 -11.680 326 HG22 THR 39 HG22 THR 39 107.690 8.953 -10.702 327 HG23 THR 39 HG23 THR 39 106.945 7.787 -11.822 328 H ILE 40 H ILE 40 108.900 6.406 -8.689 329 HA ILE 40 HA ILE 40 108.822 7.991 -6.134 330 HB ILE 40 HB ILE 40 111.199 6.342 -6.959 331 HG12 ILE 40 HG12 ILE 40 109.746 4.453 -5.693 332 HG13 ILE 40 HG13 ILE 40 108.412 5.338 -6.469 333 HG21 ILE 40 HG21 ILE 40 111.167 7.609 -4.826 334 HG22 ILE 40 HG22 ILE 40 111.197 5.855 -4.527 335 HG23 ILE 40 HG23 ILE 40 109.677 6.763 -4.347 336 HD11 ILE 40 HD11 ILE 40 110.255 3.466 -7.657 337 HD12 ILE 40 HD12 ILE 40 110.503 5.061 -8.408 338 HD13 ILE 40 HD13 ILE 40 108.889 4.312 -8.422 339 H THR 41 H THR 41 109.588 10.014 -6.177 340 HA THR 41 HA THR 41 111.784 10.639 -8.164 341 HB THR 41 HB THR 41 110.064 12.791 -6.948 342 HG1 THR 41 HG1 THR 41 108.482 11.411 -7.662 343 HG21 THR 41 HG21 THR 41 110.445 13.807 -9.177 344 HG22 THR 41 HG22 THR 41 111.284 12.330 -9.706 345 HG23 THR 41 HG23 THR 41 111.984 13.337 -8.416 346 H GLN 42 H GLN 42 113.493 12.026 -7.367 347 HA GLN 42 HA GLN 42 113.480 12.390 -4.368 348 HB2 GLN 42 HB2 GLN 42 114.793 10.303 -5.279 349 HB3 GLN 42 HB3 GLN 42 115.984 11.509 -5.825 350 HG2 GLN 42 HG2 GLN 42 116.156 12.394 -3.523 351 HG3 GLN 42 HG3 GLN 42 114.945 11.213 -2.970 352 HE21 GLN 42 HE21 GLN 42 117.959 11.553 -2.329 353 HE22 GLN 42 HE22 GLN 42 118.621 9.963 -2.637 354 H GLU 43 H GLU 43 114.438 14.304 -3.684 355 HA GLU 43 HA GLU 43 115.946 15.878 -5.763 356 HB2 GLU 43 HB2 GLU 43 113.825 17.163 -4.009 357 HB3 GLU 43 HB3 GLU 43 114.637 17.844 -5.439 358 HG2 GLU 43 HG3 GLU 43 113.575 15.746 -6.663 359 HG3 GLU 43 HG2 GLU 43 112.447 15.770 -5.286 360 H GLY 44 H GLY 44 117.732 15.113 -4.366 361 HA2 GLY 44 HA2 GLY 44 119.252 15.415 -2.585 362 HA3 GLY 44 HA3 GLY 44 118.726 17.113 -2.639 363 H ASN 45 H ASN 45 116.830 17.713 -1.317 364 HA ASN 45 HA ASN 45 116.557 15.865 1.065 365 HB2 ASN 45 HB3 ASN 45 116.085 18.064 2.325 366 HB3 ASN 45 HB2 ASN 45 117.765 17.774 1.817 367 HD21 ASN 45 HD21 ASN 45 116.726 20.435 2.293 368 HD22 ASN 45 HD22 ASN 45 116.707 21.273 0.757 369 H LYS 46 H LYS 46 114.863 16.045 -1.401 370 HA LYS 46 HA LYS 46 112.282 16.253 0.054 371 HB2 LYS 46 HB2 LYS 46 113.143 18.166 -2.125 372 HB3 LYS 46 HB3 LYS 46 111.436 17.677 -2.015 373 HG2 LYS 46 HG2 LYS 46 111.212 19.328 -0.471 374 HG3 LYS 46 HG3 LYS 46 112.118 18.268 0.634 375 HD2 LYS 46 HD2 LYS 46 114.238 19.287 -0.085 376 HD3 LYS 46 HD3 LYS 46 113.375 20.299 -1.267 377 HE2 LYS 46 HE2 LYS 46 112.002 21.154 0.764 378 HE3 LYS 46 HE3 LYS 46 113.285 20.433 1.764 379 HZ1 LYS 46 HZ1 LYS 46 113.743 22.738 1.256 380 HZ2 LYS 46 HZ2 LYS 46 114.882 21.768 0.562 381 HZ3 LYS 46 HZ3 LYS 46 113.693 22.437 -0.365 382 H PHE 47 H PHE 47 111.523 14.306 -0.442 383 HA PHE 47 HA PHE 47 111.941 13.287 -3.254 384 HB2 PHE 47 HB2 PHE 47 111.570 11.049 -2.331 385 HB3 PHE 47 HB3 PHE 47 112.832 11.874 -1.385 386 HD1 PHE 47 HD1 PHE 47 112.509 12.385 0.924 387 HD2 PHE 47 HD2 PHE 47 109.222 10.948 -1.436 388 HE1 PHE 47 HE1 PHE 47 111.163 12.082 2.985 389 HE2 PHE 47 HE2 PHE 47 107.874 10.645 0.624 390 HZ PHE 47 HZ PHE 47 108.846 11.213 2.834 391 H THR 48 H THR 48 110.037 11.746 -3.912 392 HA THR 48 HA THR 48 107.412 12.609 -2.827 393 HB THR 48 HB THR 48 108.246 13.232 -5.697 394 HG1 THR 48 HG1 THR 48 108.973 14.777 -4.188 395 HG21 THR 48 HG21 THR 48 105.961 14.171 -5.894 396 HG22 THR 48 HG22 THR 48 105.595 13.629 -4.239 397 HG23 THR 48 HG23 THR 48 105.908 12.432 -5.519 398 H VAL 49 H VAL 49 106.764 10.527 -2.504 399 HA VAL 49 HA VAL 49 107.154 8.553 -4.735 400 HB VAL 49 HB VAL 49 105.941 8.052 -1.988 401 HG11 VAL 49 HG11 VAL 49 105.592 6.314 -3.722 402 HG12 VAL 49 HG12 VAL 49 106.700 5.738 -2.454 403 HG13 VAL 49 HG13 VAL 49 107.345 6.266 -4.027 404 HG21 VAL 49 HG21 VAL 49 108.189 9.072 -1.732 405 HG22 VAL 49 HG22 VAL 49 108.216 7.347 -1.293 406 HG23 VAL 49 HG23 VAL 49 108.861 7.875 -2.865 407 H LYS 50 H LYS 50 105.564 8.679 -6.258 408 HA LYS 50 HA LYS 50 102.768 9.292 -5.319 409 HB2 LYS 50 HB2 LYS 50 103.948 10.505 -7.297 410 HB3 LYS 50 HB3 LYS 50 103.668 8.999 -8.203 411 HG2 LYS 50 HG2 LYS 50 101.200 9.239 -7.324 412 HG3 LYS 50 HG3 LYS 50 101.650 10.941 -7.058 413 HD2 LYS 50 HD3 LYS 50 102.261 11.200 -9.405 414 HD3 LYS 50 HD2 LYS 50 102.009 9.464 -9.702 415 HE2 LYS 50 HE2 LYS 50 99.590 9.849 -8.881 416 HE3 LYS 50 HE3 LYS 50 99.932 11.587 -9.057 417 HZ1 LYS 50 HZ1 LYS 50 98.968 10.662 -11.057 418 HZ2 LYS 50 HZ2 LYS 50 100.190 9.563 -11.191 419 HZ3 LYS 50 HZ3 LYS 50 100.507 11.173 -11.355 420 H GLU 51 H GLU 51 101.952 7.330 -4.554 421 HA GLU 51 HA GLU 51 102.487 4.809 -5.958 422 HB2 GLU 51 HB3 GLU 51 100.660 5.698 -3.724 423 HB3 GLU 51 HB2 GLU 51 100.391 4.117 -4.495 424 HG2 GLU 51 HG2 GLU 51 102.806 3.559 -4.071 425 HG3 GLU 51 HG3 GLU 51 102.964 5.091 -3.178 426 H SER 52 H SER 52 100.854 3.529 -7.107 427 HA SER 52 HA SER 52 98.369 4.865 -7.953 428 HB2 SER 52 HB2 SER 52 100.392 4.270 -10.137 429 HB3 SER 52 HB3 SER 52 98.885 5.211 -10.247 430 HG SER 52 HG SER 52 100.914 6.464 -10.083 431 H SER 53 H SER 53 97.150 3.148 -7.593 432 HA SER 53 HA SER 53 97.753 0.655 -9.160 433 HB2 SER 53 HB2 SER 53 97.570 -0.772 -7.318 434 HB3 SER 53 HB3 SER 53 98.401 0.617 -6.576 435 HG SER 53 HG SER 53 96.725 0.573 -5.265 436 H ALA 54 H ALA 54 95.855 -0.374 -9.896 437 HA ALA 54 HA ALA 54 93.535 1.259 -10.253 438 HB1 ALA 54 HB1 ALA 54 92.398 -0.833 -10.945 439 HB2 ALA 54 HB2 ALA 54 93.720 -1.787 -10.231 440 HB3 ALA 54 HB3 ALA 54 94.036 -0.737 -11.634 441 H PHE 55 H PHE 55 94.639 0.350 -7.344 442 HA PHE 55 HA PHE 55 91.898 -0.302 -6.262 443 HB2 PHE 55 HB2 PHE 55 94.712 -0.829 -5.276 444 HB3 PHE 55 HB3 PHE 55 93.334 -0.852 -4.149 445 HD1 PHE 55 HD1 PHE 55 95.231 -2.772 -6.466 446 HD2 PHE 55 HD2 PHE 55 91.249 -2.260 -4.940 447 HE1 PHE 55 HE1 PHE 55 94.645 -5.057 -7.228 448 HE2 PHE 55 HE2 PHE 55 90.664 -4.547 -5.700 449 HZ PHE 55 HZ PHE 55 92.362 -5.946 -6.844 450 H ARG 56 H ARG 56 94.451 2.136 -6.241 451 HA ARG 56 HA ARG 56 92.926 4.251 -5.287 452 HB2 ARG 56 HB2 ARG 56 93.485 2.328 -3.105 453 HB3 ARG 56 HB3 ARG 56 93.973 3.997 -2.728 454 HG2 ARG 56 HG2 ARG 56 91.799 4.795 -2.800 455 HG3 ARG 56 HG3 ARG 56 91.287 3.597 -4.012 456 HD2 ARG 56 HD2 ARG 56 90.225 3.056 -1.881 457 HD3 ARG 56 HD3 ARG 56 91.452 1.816 -2.237 458 HE ARG 56 HE ARG 56 91.686 3.973 -0.152 459 HH11 ARG 56 HH11 ARG 56 93.260 3.503 1.394 460 HH12 ARG 56 HH12 ARG 56 94.325 2.132 1.172 461 HH21 ARG 56 HH21 ARG 56 92.905 1.186 -1.860 462 HH22 ARG 56 HH22 ARG 56 94.125 0.829 -0.658 463 H ASN 57 H ASN 57 94.536 5.172 -6.648 464 HA ASN 57 HA ASN 57 97.373 4.990 -6.128 465 HB2 ASN 57 HB2 ASN 57 97.567 6.944 -7.598 466 HB3 ASN 57 HB3 ASN 57 96.353 5.824 -8.261 467 HD21 ASN 57 HD21 ASN 57 94.145 6.436 -6.534 468 HD22 ASN 57 HD22 ASN 57 93.654 8.086 -6.848 469 H ILE 58 H ILE 58 98.771 6.342 -4.967 470 HA ILE 58 HA ILE 58 97.483 8.477 -3.281 471 HB ILE 58 HB ILE 58 99.534 6.662 -2.042 472 HG12 ILE 58 HG13 ILE 58 96.587 6.056 -2.448 473 HG13 ILE 58 HG12 ILE 58 97.987 5.009 -2.790 474 HG21 ILE 58 HG21 ILE 58 98.460 8.901 -1.118 475 HG22 ILE 58 HG22 ILE 58 98.688 7.510 -0.031 476 HG23 ILE 58 HG23 ILE 58 97.084 7.842 -0.727 477 HD11 ILE 58 HD11 ILE 58 97.254 4.155 -0.736 478 HD12 ILE 58 HD12 ILE 58 98.485 5.332 -0.217 479 HD13 ILE 58 HD13 ILE 58 96.758 5.755 -0.136 480 H GLU 59 H GLU 59 99.317 9.650 -2.031 481 HA GLU 59 HA GLU 59 101.921 9.646 -3.466 482 HB2 GLU 59 HB2 GLU 59 101.791 11.803 -4.397 483 HB3 GLU 59 HB3 GLU 59 100.176 11.137 -4.736 484 HG2 GLU 59 HG3 GLU 59 99.564 12.183 -2.389 485 HG3 GLU 59 HG2 GLU 59 101.005 13.187 -2.676 486 H CYS 60 H CYS 60 103.564 10.536 -2.210 487 HA CYS 60 HA CYS 60 102.793 12.062 0.245 488 HB2 CYS 60 HB2 CYS 60 103.393 9.225 0.256 489 HB3 CYS 60 HB3 CYS 60 104.680 10.102 1.116 490 HG CYS 60 HG CYS 60 101.556 11.188 1.882 491 H VAL 61 H VAL 61 104.086 13.820 -0.089 492 HA VAL 61 HA VAL 61 106.915 13.308 -0.993 493 HB VAL 61 HB VAL 61 105.956 14.829 -2.488 494 HG11 VAL 61 HG11 VAL 61 104.589 16.830 -1.527 495 HG12 VAL 61 HG12 VAL 61 104.481 15.849 -0.047 496 HG13 VAL 61 HG13 VAL 61 103.815 15.228 -1.577 497 HG21 VAL 61 HG21 VAL 61 106.962 17.000 -2.023 498 HG22 VAL 61 HG22 VAL 61 107.021 16.642 -0.281 499 HG23 VAL 61 HG23 VAL 61 108.048 15.729 -1.412 500 H PHE 62 H PHE 62 108.631 14.348 0.117 501 HA PHE 62 HA PHE 62 108.295 16.102 2.354 502 HB2 PHE 62 HB2 PHE 62 107.805 13.230 2.935 503 HB3 PHE 62 HB3 PHE 62 108.954 14.028 4.034 504 HD1 PHE 62 HD1 PHE 62 108.120 16.621 4.556 505 HD2 PHE 62 HD2 PHE 62 105.606 13.248 3.687 506 HE1 PHE 62 HE1 PHE 62 106.233 17.723 5.730 507 HE2 PHE 62 HE2 PHE 62 103.719 14.353 4.856 508 HZ PHE 62 HZ PHE 62 104.032 16.591 5.877 509 H GLU 63 H GLU 63 110.265 15.739 4.003 510 HA GLU 63 HA GLU 63 112.675 15.302 2.234 511 HB2 GLU 63 HB3 GLU 63 112.645 17.552 3.059 512 HB3 GLU 63 HB2 GLU 63 112.171 17.026 4.691 513 HG2 GLU 63 HG3 GLU 63 114.330 16.047 5.098 514 HG3 GLU 63 HG2 GLU 63 114.798 16.210 3.389 515 H LEU 64 H LEU 64 114.652 14.491 3.505 516 HA LEU 64 HA LEU 64 113.821 12.051 4.960 517 HB2 LEU 64 HB3 LEU 64 116.577 13.213 4.357 518 HB3 LEU 64 HB2 LEU 64 116.274 11.601 5.048 519 HG LEU 64 HG LEU 64 114.862 12.358 2.498 520 HD11 LEU 64 HD11 LEU 64 117.220 13.024 2.117 521 HD12 LEU 64 HD12 LEU 64 117.762 11.425 2.681 522 HD13 LEU 64 HD13 LEU 64 116.810 11.564 1.184 523 HD21 LEU 64 HD21 LEU 64 114.382 10.221 3.663 524 HD22 LEU 64 HD22 LEU 64 115.153 9.930 2.086 525 HD23 LEU 64 HD23 LEU 64 116.107 9.790 3.583 526 H GLY 65 H GLY 65 113.717 11.810 7.148 527 HA2 GLY 65 HA2 GLY 65 114.701 12.213 9.381 528 HA3 GLY 65 HA3 GLY 65 115.196 13.832 8.836 529 H VAL 66 H VAL 66 112.552 14.320 7.515 530 HA VAL 66 HA VAL 66 111.182 15.269 9.976 531 HB VAL 66 HB VAL 66 110.408 15.540 7.036 532 HG11 VAL 66 HG11 VAL 66 108.517 15.848 8.613 533 HG12 VAL 66 HG12 VAL 66 108.988 17.395 7.868 534 HG13 VAL 66 HG13 VAL 66 109.481 17.025 9.538 535 HG21 VAL 66 HG21 VAL 66 112.603 16.568 7.564 536 HG22 VAL 66 HG22 VAL 66 111.865 17.444 8.926 537 HG23 VAL 66 HG23 VAL 66 111.371 17.815 7.257 538 H THR 67 H THR 67 109.926 13.816 11.055 539 HA THR 67 HA THR 67 108.820 11.425 9.929 540 HB THR 67 HB THR 67 107.327 12.873 12.102 541 HG1 THR 67 HG1 THR 67 109.404 13.338 12.709 542 HG21 THR 67 HG21 THR 67 107.061 10.686 12.993 543 HG22 THR 67 HG22 THR 67 108.443 10.050 12.069 544 HG23 THR 67 HG23 THR 67 106.926 10.460 11.233 545 H PHE 68 H PHE 68 106.875 10.941 9.027 546 HA PHE 68 HA PHE 68 104.814 13.069 8.746 547 HB2 PHE 68 HB3 PHE 68 104.802 12.287 6.166 548 HB3 PHE 68 HB2 PHE 68 105.748 13.683 6.730 549 HD1 PHE 68 HD1 PHE 68 106.070 9.937 6.449 550 HD2 PHE 68 HD2 PHE 68 107.988 13.770 6.165 551 HE1 PHE 68 HE1 PHE 68 108.164 8.837 5.689 552 HE2 PHE 68 HE2 PHE 68 110.077 12.670 5.416 553 HZ PHE 68 HZ PHE 68 110.163 10.206 5.173 554 H ASN 69 H ASN 69 103.111 11.829 6.992 555 HA ASN 69 HA ASN 69 102.957 8.995 7.991 556 HB2 ASN 69 HB2 ASN 69 100.676 9.233 8.695 557 HB3 ASN 69 HB3 ASN 69 101.564 10.590 9.429 558 HD21 ASN 69 HD21 ASN 69 101.783 12.403 7.306 559 HD22 ASN 69 HD22 ASN 69 100.185 12.887 6.783 560 H CYS 70 H CYS 70 101.802 7.588 6.640 561 HA CYS 70 HA CYS 70 100.523 8.648 4.182 562 HB2 CYS 70 HB2 CYS 70 102.982 6.851 3.974 563 HB3 CYS 70 HB3 CYS 70 102.013 7.495 2.626 564 HG CYS 70 HG CYS 70 104.351 9.090 4.548 565 H ASN 71 H ASN 71 98.985 7.168 3.465 566 HA ASN 71 HA ASN 71 98.755 4.729 5.185 567 HB2 ASN 71 HB2 ASN 71 96.513 4.636 3.701 568 HB3 ASN 71 HB3 ASN 71 96.654 5.680 5.135 569 HD21 ASN 71 HD21 ASN 71 97.604 5.851 1.623 570 HD22 ASN 71 HD22 ASN 71 97.047 7.497 1.417 571 H LEU 72 H LEU 72 98.712 2.639 4.384 572 HA LEU 72 HA LEU 72 99.929 2.343 1.658 573 HB2 LEU 72 HB3 LEU 72 99.406 0.273 3.839 574 HB3 LEU 72 HB2 LEU 72 100.345 0.012 2.350 575 HG LEU 72 HG LEU 72 101.033 2.170 4.384 576 HD11 LEU 72 HD11 LEU 72 101.155 -0.061 5.457 577 HD12 LEU 72 HD12 LEU 72 102.781 0.615 5.199 578 HD13 LEU 72 HD13 LEU 72 102.161 -0.652 4.113 579 HD21 LEU 72 HD21 LEU 72 101.918 2.457 2.082 580 HD22 LEU 72 HD22 LEU 72 102.607 0.817 2.144 581 HD23 LEU 72 HD23 LEU 72 103.228 2.084 3.229 582 H ALA 73 H ALA 73 98.965 1.089 0.021 583 HA ALA 73 HA ALA 73 96.241 1.285 -0.473 584 HB1 ALA 73 HB1 ALA 73 96.457 -0.697 -1.948 585 HB2 ALA 73 HB2 ALA 73 97.873 0.371 -2.098 586 HB3 ALA 73 HB3 ALA 73 97.986 -1.127 -1.145 587 H ASP 74 H ASP 74 97.812 -0.979 1.730 588 HA ASP 74 HA ASP 74 95.540 -2.772 2.021 589 HB2 ASP 74 HB2 ASP 74 97.911 -2.078 3.793 590 HB3 ASP 74 HB3 ASP 74 96.669 -3.250 4.295 591 H GLY 75 H GLY 75 95.245 0.332 2.262 592 HA2 GLY 75 HA3 GLY 75 93.810 1.754 3.488 593 HA3 GLY 75 HA2 GLY 75 93.030 0.280 4.112 594 H THR 76 H THR 76 96.475 0.799 4.545 595 HA THR 76 HA THR 76 95.954 1.008 7.498 596 HB THR 76 HB THR 76 98.747 0.753 6.554 597 HG1 THR 76 HG1 THR 76 97.778 -0.511 4.963 598 HG21 THR 76 HG21 THR 76 98.748 -1.032 8.274 599 HG22 THR 76 HG22 THR 76 96.983 -0.876 8.437 600 HG23 THR 76 HG23 THR 76 98.043 0.473 8.912 601 H GLU 77 H GLU 77 97.366 2.479 8.733 602 HA GLU 77 HA GLU 77 98.283 4.856 7.115 603 HB2 GLU 77 HB2 GLU 77 96.011 5.257 8.155 604 HB3 GLU 77 HB3 GLU 77 96.757 5.007 9.752 605 HG2 GLU 77 HG3 GLU 77 98.362 6.855 9.265 606 HG3 GLU 77 HG2 GLU 77 97.546 7.128 7.706 607 H LEU 78 H LEU 78 100.434 5.192 7.566 608 HA LEU 78 HA LEU 78 101.308 4.609 10.404 609 HB2 LEU 78 HB2 LEU 78 103.176 4.004 8.121 610 HB3 LEU 78 HB3 LEU 78 103.113 3.295 9.752 611 HG LEU 78 HG LEU 78 100.721 2.450 8.903 612 HD11 LEU 78 HD11 LEU 78 101.077 3.713 6.703 613 HD12 LEU 78 HD12 LEU 78 102.335 2.513 6.322 614 HD13 LEU 78 HD13 LEU 78 100.647 1.993 6.541 615 HD21 LEU 78 HD21 LEU 78 103.285 1.131 7.915 616 HD22 LEU 78 HD22 LEU 78 101.759 0.332 8.361 617 HD23 LEU 78 HD23 LEU 78 102.760 1.102 9.615 618 H ARG 79 H ARG 79 103.374 5.674 10.980 619 HA ARG 79 HA ARG 79 104.100 7.986 9.203 620 HB2 ARG 79 HB3 ARG 79 103.942 9.576 11.083 621 HB3 ARG 79 HB2 ARG 79 102.359 8.825 10.768 622 HG2 ARG 79 HG2 ARG 79 102.794 7.182 12.589 623 HG3 ARG 79 HG3 ARG 79 104.351 7.980 12.921 624 HD2 ARG 79 HD2 ARG 79 102.879 10.158 13.122 625 HD3 ARG 79 HD3 ARG 79 101.542 9.009 13.370 626 HE ARG 79 HE ARG 79 103.465 8.089 15.152 627 HH11 ARG 79 HH11 ARG 79 103.670 8.885 17.257 628 HH12 ARG 79 HH12 ARG 79 103.120 10.501 17.639 629 HH21 ARG 79 HH21 ARG 79 102.045 11.178 14.397 630 HH22 ARG 79 HH22 ARG 79 102.204 11.793 16.027 631 H GLY 80 H GLY 80 106.263 8.597 9.388 632 HA2 GLY 80 HA2 GLY 80 107.979 8.136 11.595 633 HA3 GLY 80 HA3 GLY 80 108.066 6.669 10.586 634 H THR 81 H THR 81 109.607 6.736 9.016 635 HA THR 81 HA THR 81 109.899 8.818 7.109 636 HB THR 81 HB THR 81 112.315 9.412 8.502 637 HG1 THR 81 HG1 THR 81 111.648 9.973 10.502 638 HG21 THR 81 HG21 THR 81 111.231 11.714 8.621 639 HG22 THR 81 HG22 THR 81 111.260 10.973 7.003 640 HG23 THR 81 HG23 THR 81 109.757 10.968 7.957 641 H TRP 82 H TRP 82 111.763 8.555 5.733 642 HA TRP 82 HA TRP 82 113.041 5.848 6.114 643 HB2 TRP 82 HB2 TRP 82 113.217 7.536 3.599 644 HB3 TRP 82 HB3 TRP 82 113.365 5.771 3.769 645 HD1 TRP 82 HD1 TRP 82 110.715 8.555 4.095 646 HE1 TRP 82 HE1 TRP 82 108.394 7.579 3.552 647 HE3 TRP 82 HE3 TRP 82 112.034 3.669 3.470 648 HZ2 TRP 82 HZ2 TRP 82 107.274 4.988 2.913 649 HZ3 TRP 82 HZ3 TRP 82 110.330 1.967 2.888 650 HH2 TRP 82 HH2 TRP 82 107.953 2.620 2.611 651 H SER 83 H SER 83 115.313 5.645 6.116 652 HA SER 83 HA SER 83 116.893 8.184 5.818 653 HB2 SER 83 HB2 SER 83 116.824 8.373 8.113 654 HB3 SER 83 HB3 SER 83 116.458 6.647 8.349 655 HG SER 83 HG SER 83 118.603 7.159 9.017 656 H LEU 84 H LEU 84 119.218 7.724 5.487 657 HA LEU 84 HA LEU 84 119.490 5.064 4.193 658 HB2 LEU 84 HB2 LEU 84 120.823 7.679 4.008 659 HB3 LEU 84 HB3 LEU 84 121.969 6.315 4.014 660 HG LEU 84 HG LEU 84 119.646 5.686 2.382 661 HD11 LEU 84 HD11 LEU 84 119.512 8.143 2.081 662 HD12 LEU 84 HD12 LEU 84 121.227 8.176 1.604 663 HD13 LEU 84 HD13 LEU 84 120.035 7.338 0.582 664 HD21 LEU 84 HD21 LEU 84 121.858 4.568 2.278 665 HD22 LEU 84 HD22 LEU 84 121.404 5.249 0.698 666 HD23 LEU 84 HD23 LEU 84 122.597 6.088 1.719 667 H GLU 85 H GLU 85 120.164 3.370 5.261 668 HA GLU 85 HA GLU 85 121.929 3.799 7.677 669 HB2 GLU 85 HB2 GLU 85 119.721 1.907 7.014 670 HB3 GLU 85 HB3 GLU 85 121.124 1.182 7.834 671 HG2 GLU 85 HG2 GLU 85 119.776 3.724 8.823 672 HG3 GLU 85 HG3 GLU 85 119.286 2.101 9.367 673 H GLY 86 H GLY 86 124.018 3.653 6.919 674 HA2 GLY 86 HA2 GLY 86 125.909 2.615 5.938 675 HA3 GLY 86 HA3 GLY 86 124.985 1.092 5.959 676 H ASN 87 H ASN 87 124.050 0.369 4.056 677 HA ASN 87 HA ASN 87 124.212 2.277 1.712 678 HB2 ASN 87 HB3 ASN 87 125.919 0.297 1.841 679 HB3 ASN 87 HB2 ASN 87 124.520 -0.722 1.425 680 HD21 ASN 87 HD21 ASN 87 126.895 -0.169 -0.293 681 HD22 ASN 87 HD22 ASN 87 126.269 0.609 -1.729 682 H LYS 88 H LYS 88 121.890 1.744 3.476 683 HA LYS 88 HA LYS 88 120.075 0.714 1.305 684 HB2 LYS 88 HB2 LYS 88 118.779 -0.370 3.347 685 HB3 LYS 88 HB3 LYS 88 120.143 -1.235 2.597 686 HG2 LYS 88 HG2 LYS 88 121.674 -0.377 4.313 687 HG3 LYS 88 HG3 LYS 88 120.365 0.592 5.031 688 HD2 LYS 88 HD2 LYS 88 119.225 -1.309 5.827 689 HD3 LYS 88 HD3 LYS 88 120.062 -2.400 4.697 690 HE2 LYS 88 HE3 LYS 88 122.144 -2.181 5.920 691 HE3 LYS 88 HE2 LYS 88 121.466 -0.892 6.943 692 HZ1 LYS 88 HZ1 LYS 88 121.431 -3.023 8.057 693 HZ2 LYS 88 HZ2 LYS 88 120.518 -3.686 6.854 694 HZ3 LYS 88 HZ3 LYS 88 119.890 -2.492 7.801 695 H LEU 89 H LEU 89 117.846 1.455 1.561 696 HA LEU 89 HA LEU 89 117.745 4.039 3.111 697 HB2 LEU 89 HB2 LEU 89 116.486 2.979 0.623 698 HB3 LEU 89 HB3 LEU 89 115.417 3.956 1.658 699 HG LEU 89 HG LEU 89 118.211 4.877 0.886 700 HD11 LEU 89 HD11 LEU 89 116.898 4.482 -1.181 701 HD12 LEU 89 HD12 LEU 89 115.565 5.459 -0.520 702 HD13 LEU 89 HD13 LEU 89 117.129 6.223 -0.892 703 HD21 LEU 89 HD21 LEU 89 117.118 5.981 2.822 704 HD22 LEU 89 HD22 LEU 89 115.693 6.334 1.815 705 HD23 LEU 89 HD23 LEU 89 117.258 7.098 1.443 706 H ILE 90 H ILE 90 117.130 3.495 5.204 707 HA ILE 90 HA ILE 90 115.248 1.310 5.697 708 HB ILE 90 HB ILE 90 115.135 2.585 8.027 709 HG12 ILE 90 HG12 ILE 90 117.789 3.567 6.952 710 HG13 ILE 90 HG13 ILE 90 116.325 4.582 6.919 711 HG21 ILE 90 HG21 ILE 90 116.188 0.383 7.594 712 HG22 ILE 90 HG22 ILE 90 117.188 1.376 8.681 713 HG23 ILE 90 HG23 ILE 90 117.638 1.203 6.967 714 HD11 ILE 90 HD11 ILE 90 116.139 4.604 9.267 715 HD12 ILE 90 HD12 ILE 90 117.894 4.734 8.998 716 HD13 ILE 90 HD13 ILE 90 117.177 3.170 9.455 717 H GLY 91 H GLY 91 113.202 1.611 6.859 718 HA2 GLY 91 HA2 GLY 91 111.772 4.181 6.302 719 HA3 GLY 91 HA3 GLY 91 111.129 2.704 5.539 720 H LYS 92 H LYS 92 111.533 4.460 8.526 721 HA LYS 92 HA LYS 92 110.419 2.196 10.119 722 HB2 LYS 92 HB3 LYS 92 111.888 3.247 11.531 723 HB3 LYS 92 HB2 LYS 92 111.783 4.788 10.651 724 HG2 LYS 92 HG2 LYS 92 109.858 5.472 11.817 725 HG3 LYS 92 HG3 LYS 92 109.443 3.810 12.302 726 HD2 LYS 92 HD3 LYS 92 111.492 3.761 13.744 727 HD3 LYS 92 HD2 LYS 92 111.800 5.461 13.316 728 HE2 LYS 92 HE2 LYS 92 109.074 4.737 14.363 729 HE3 LYS 92 HE3 LYS 92 110.424 4.809 15.521 730 HZ1 LYS 92 HZ1 LYS 92 109.341 6.943 15.284 731 HZ2 LYS 92 HZ2 LYS 92 110.894 7.032 14.735 732 HZ3 LYS 92 HZ3 LYS 92 109.643 6.966 13.662 733 H PHE 93 H PHE 93 108.265 1.908 9.718 734 HA PHE 93 HA PHE 93 106.544 4.397 9.781 735 HB2 PHE 93 HB2 PHE 93 106.454 1.897 8.112 736 HB3 PHE 93 HB3 PHE 93 104.910 2.652 8.567 737 HD1 PHE 93 HD1 PHE 93 107.261 5.252 8.551 738 HD2 PHE 93 HD2 PHE 93 105.103 2.699 5.849 739 HE1 PHE 93 HE1 PHE 93 107.551 6.918 6.741 740 HE2 PHE 93 HE2 PHE 93 105.394 4.370 4.043 741 HZ PHE 93 HZ PHE 93 106.617 6.479 4.487 742 H LYS 94 H LYS 94 105.229 4.536 11.463 743 HA LYS 94 HA LYS 94 104.699 2.025 13.049 744 HB2 LYS 94 HB3 LYS 94 104.782 4.973 13.739 745 HB3 LYS 94 HB2 LYS 94 103.886 3.829 14.767 746 HG2 LYS 94 HG2 LYS 94 105.986 2.420 14.889 747 HG3 LYS 94 HG3 LYS 94 106.846 3.730 14.046 748 HD2 LYS 94 HD3 LYS 94 105.987 5.294 15.890 749 HD3 LYS 94 HD2 LYS 94 105.490 3.829 16.769 750 HE2 LYS 94 HE2 LYS 94 107.599 3.673 17.568 751 HE3 LYS 94 HE3 LYS 94 108.149 3.344 15.907 752 HZ1 LYS 94 HZ1 LYS 94 107.953 5.962 17.244 753 HZ2 LYS 94 HZ2 LYS 94 109.313 5.221 16.676 754 HZ3 LYS 94 HZ3 LYS 94 108.188 5.803 15.620 755 H ARG 95 H ARG 95 102.748 1.129 12.636 756 HA ARG 95 HA ARG 95 100.671 2.365 11.120 757 HB2 ARG 95 HB3 ARG 95 100.759 0.084 13.098 758 HB3 ARG 95 HB2 ARG 95 99.183 0.663 12.510 759 HG2 ARG 95 HG2 ARG 95 100.205 0.469 10.135 760 HG3 ARG 95 HG3 ARG 95 101.488 -0.496 10.906 761 HD2 ARG 95 HD2 ARG 95 99.764 -2.017 10.100 762 HD3 ARG 95 HD3 ARG 95 99.690 -1.980 11.878 763 HE ARG 95 HE ARG 95 97.886 0.026 10.948 764 HH11 ARG 95 HH11 ARG 95 95.688 -0.469 10.767 765 HH12 ARG 95 HH12 ARG 95 95.176 -2.136 10.625 766 HH21 ARG 95 HH21 ARG 95 98.414 -3.410 10.762 767 HH22 ARG 95 HH22 ARG 95 96.713 -3.794 10.622 768 H THR 96 H THR 96 99.605 4.206 11.629 769 HA THR 96 HA THR 96 99.511 5.194 14.387 770 HB THR 96 HB THR 96 97.633 6.679 13.081 771 HG1 THR 96 HG1 THR 96 99.452 5.781 11.074 772 HG21 THR 96 HG21 THR 96 99.494 8.217 12.526 773 HG22 THR 96 HG22 THR 96 100.659 6.891 12.756 774 HG23 THR 96 HG23 THR 96 99.719 7.500 14.139 775 H ASP 97 H ASP 97 97.757 2.987 12.604 776 HA ASP 97 HA ASP 97 95.159 3.372 13.955 777 HB2 ASP 97 HB3 ASP 97 95.401 2.401 11.644 778 HB3 ASP 97 HB2 ASP 97 96.186 0.977 12.370 779 H ASN 98 H ASN 98 97.849 0.997 14.137 780 HA ASN 98 HA ASN 98 96.858 0.349 16.915 781 HB2 ASN 98 HB2 ASN 98 97.508 -1.519 14.634 782 HB3 ASN 98 HB3 ASN 98 97.798 -2.044 16.310 783 HD21 ASN 98 HD21 ASN 98 95.331 -1.392 13.889 784 HD22 ASN 98 HD22 ASN 98 93.962 -1.816 14.894 785 H GLY 99 H GLY 99 99.274 1.766 15.265 786 HA2 GLY 99 HA3 GLY 99 101.622 1.945 15.611 787 HA3 GLY 99 HA2 GLY 99 101.178 1.770 17.326 788 H ASN 100 H ASN 100 100.871 -0.624 14.675 789 HA ASN 100 HA ASN 100 102.134 -2.654 16.407 790 HB2 ASN 100 HB3 ASN 100 100.866 -2.593 13.687 791 HB3 ASN 100 HB2 ASN 100 101.997 -3.921 14.044 792 HD21 ASN 100 HD21 ASN 100 98.742 -3.067 14.238 793 HD22 ASN 100 HD22 ASN 100 98.265 -4.146 15.530 794 H GLU 101 H GLU 101 103.502 -0.158 15.087 795 HA GLU 101 HA GLU 101 105.626 0.333 14.181 796 HB2 GLU 101 HB2 GLU 101 105.922 -1.863 16.147 797 HB3 GLU 101 HB3 GLU 101 107.284 -1.710 15.013 798 HG2 GLU 101 HG3 GLU 101 107.748 0.510 15.677 799 HG3 GLU 101 HG2 GLU 101 106.132 0.731 16.391 800 H LEU 102 H LEU 102 106.454 0.144 12.174 801 HA LEU 102 HA LEU 102 106.531 -2.617 10.940 802 HB2 LEU 102 HB2 LEU 102 104.643 -1.137 10.041 803 HB3 LEU 102 HB3 LEU 102 105.907 -0.054 9.412 804 HG LEU 102 HG LEU 102 105.931 -3.027 8.794 805 HD11 LEU 102 HD11 LEU 102 103.722 -2.133 8.097 806 HD12 LEU 102 HD12 LEU 102 104.739 -2.513 6.687 807 HD13 LEU 102 HD13 LEU 102 104.536 -0.824 7.208 808 HD21 LEU 102 HD21 LEU 102 106.924 -1.699 6.615 809 HD22 LEU 102 HD22 LEU 102 107.931 -2.254 7.974 810 HD23 LEU 102 HD23 LEU 102 107.370 -0.566 7.913 811 H ASN 103 H ASN 103 108.624 -3.115 10.461 812 HA ASN 103 HA ASN 103 110.510 -0.782 10.067 813 HB2 ASN 103 HB2 ASN 103 110.690 -3.313 11.527 814 HB3 ASN 103 HB3 ASN 103 112.029 -3.138 10.368 815 HD21 ASN 103 HD21 ASN 103 110.260 -1.205 12.888 816 HD22 ASN 103 HD22 ASN 103 111.686 -0.346 13.425 817 H THR 104 H THR 104 110.699 -0.386 7.906 818 HA THR 104 HA THR 104 111.043 -2.818 6.138 819 HB THR 104 HB THR 104 108.919 -1.804 5.610 820 HG1 THR 104 HG1 THR 104 109.632 -2.094 3.630 821 HG21 THR 104 HG21 THR 104 108.953 0.699 4.933 822 HG22 THR 104 HG22 THR 104 109.053 0.324 6.670 823 HG23 THR 104 HG23 THR 104 110.522 0.771 5.770 824 H VAL 105 H VAL 105 112.037 -2.072 3.945 825 HA VAL 105 HA VAL 105 114.074 0.090 4.287 826 HB VAL 105 HB VAL 105 114.787 -2.825 3.724 827 HG11 VAL 105 HG11 VAL 105 117.167 -1.701 3.913 828 HG12 VAL 105 HG12 VAL 105 116.291 -0.215 3.475 829 HG13 VAL 105 HG13 VAL 105 116.276 -1.614 2.375 830 HG21 VAL 105 HG21 VAL 105 116.183 -2.515 5.801 831 HG22 VAL 105 HG22 VAL 105 114.432 -2.414 6.103 832 HG23 VAL 105 HG23 VAL 105 115.410 -0.929 6.030 833 H ARG 106 H ARG 106 115.130 0.586 2.174 834 HA ARG 106 HA ARG 106 113.540 -0.507 -0.156 835 HB2 ARG 106 HB2 ARG 106 112.799 1.820 0.640 836 HB3 ARG 106 HB3 ARG 106 114.396 2.401 0.110 837 HG2 ARG 106 HG2 ARG 106 113.947 1.526 -2.171 838 HG3 ARG 106 HG3 ARG 106 112.342 0.973 -1.637 839 HD2 ARG 106 HD2 ARG 106 113.369 3.834 -1.809 840 HD3 ARG 106 HD3 ARG 106 112.005 3.109 -2.694 841 HE ARG 106 HE ARG 106 111.954 4.102 0.095 842 HH11 ARG 106 HH11 ARG 106 109.924 3.983 1.080 843 HH12 ARG 106 HH12 ARG 106 108.653 3.026 0.352 844 HH21 ARG 106 HH21 ARG 106 110.613 2.000 -2.336 845 HH22 ARG 106 HH22 ARG 106 109.041 1.909 -1.574 846 H GLU 107 H GLU 107 114.765 -0.992 -1.951 847 HA GLU 107 HA GLU 107 117.589 0.057 -2.025 848 HB2 GLU 107 HB2 GLU 107 116.691 -2.824 -1.912 849 HB3 GLU 107 HB3 GLU 107 118.148 -2.397 -2.840 850 HG2 GLU 107 HG2 GLU 107 119.021 -1.204 -0.793 851 HG3 GLU 107 HG3 GLU 107 117.623 -1.832 0.111 852 H ILE 108 H ILE 108 118.549 -0.131 -4.197 853 HA ILE 108 HA ILE 108 116.435 -0.414 -6.340 854 HB ILE 108 HB ILE 108 118.869 1.421 -6.384 855 HG12 ILE 108 HG12 ILE 108 116.632 1.756 -4.753 856 HG13 ILE 108 HG13 ILE 108 117.697 3.061 -5.322 857 HG21 ILE 108 HG21 ILE 108 118.078 0.803 -8.581 858 HG22 ILE 108 HG22 ILE 108 116.386 1.094 -8.108 859 HG23 ILE 108 HG23 ILE 108 117.517 2.460 -8.251 860 HD11 ILE 108 HD11 ILE 108 115.233 3.460 -5.764 861 HD12 ILE 108 HD12 ILE 108 115.264 2.063 -6.866 862 HD13 ILE 108 HD13 ILE 108 116.251 3.500 -7.224 863 H ILE 109 H ILE 109 117.124 -2.654 -6.474 864 HA ILE 109 HA ILE 109 119.919 -3.333 -6.932 865 HB ILE 109 HB ILE 109 117.494 -4.921 -7.859 866 HG12 ILE 109 HG12 ILE 109 117.484 -4.063 -5.387 867 HG13 ILE 109 HG13 ILE 109 117.225 -5.798 -5.683 868 HG21 ILE 109 HG21 ILE 109 119.440 -5.974 -8.662 869 HG22 ILE 109 HG22 ILE 109 119.175 -6.787 -7.101 870 HG23 ILE 109 HG23 ILE 109 120.399 -5.502 -7.239 871 HD11 ILE 109 HD11 ILE 109 118.961 -5.064 -3.852 872 HD12 ILE 109 HD12 ILE 109 119.396 -6.374 -4.976 873 HD13 ILE 109 HD13 ILE 109 120.023 -4.729 -5.241 874 H GLY 110 H GLY 110 120.696 -1.964 -8.543 875 HA2 GLY 110 HA3 GLY 110 120.965 -1.152 -10.762 876 HA3 GLY 110 HA2 GLY 110 120.823 -2.878 -11.162 877 H ASP 111 H ASP 111 118.607 -3.723 -11.595 878 HA ASP 111 HA ASP 111 116.852 -1.507 -12.673 879 HB2 ASP 111 HB2 ASP 111 116.917 -4.336 -13.762 880 HB3 ASP 111 HB3 ASP 111 116.308 -2.856 -14.543 881 H GLU 112 H GLU 112 116.751 -2.827 -9.977 882 HA GLU 112 HA GLU 112 113.852 -3.552 -10.167 883 HB2 GLU 112 HB2 GLU 112 115.404 -5.315 -8.343 884 HB3 GLU 112 HB3 GLU 112 114.032 -5.702 -9.408 885 HG2 GLU 112 HG2 GLU 112 115.549 -5.634 -11.375 886 HG3 GLU 112 HG3 GLU 112 116.919 -5.266 -10.300 887 H LEU 113 H LEU 113 112.720 -2.698 -8.446 888 HA LEU 113 HA LEU 113 114.399 -1.330 -6.349 889 HB2 LEU 113 HB2 LEU 113 112.346 -0.329 -7.803 890 HB3 LEU 113 HB3 LEU 113 111.419 -1.003 -6.442 891 HG LEU 113 HG LEU 113 113.881 0.628 -5.839 892 HD11 LEU 113 HD11 LEU 113 111.582 1.602 -7.346 893 HD12 LEU 113 HD12 LEU 113 111.674 2.402 -5.759 894 HD13 LEU 113 HD13 LEU 113 113.062 2.468 -6.870 895 HD21 LEU 113 HD21 LEU 113 111.378 -0.304 -4.522 896 HD22 LEU 113 HD22 LEU 113 111.887 1.350 -4.105 897 HD23 LEU 113 HD23 LEU 113 112.992 -0.017 -3.829 898 H VAL 114 H VAL 114 114.705 -2.486 -4.496 899 HA VAL 114 HA VAL 114 112.626 -4.566 -3.853 900 HB VAL 114 HB VAL 114 115.550 -4.209 -3.225 901 HG11 VAL 114 HG11 VAL 114 115.180 -6.144 -1.527 902 HG12 VAL 114 HG12 VAL 114 114.792 -4.491 -0.993 903 HG13 VAL 114 HG13 VAL 114 113.486 -5.597 -1.484 904 HG21 VAL 114 HG21 VAL 114 114.786 -5.653 -5.091 905 HG22 VAL 114 HG22 VAL 114 115.564 -6.615 -3.811 906 HG23 VAL 114 HG23 VAL 114 113.790 -6.592 -3.954 907 H GLN 115 H GLN 115 111.112 -3.984 -2.439 908 HA GLN 115 HA GLN 115 111.905 -2.084 -0.218 909 HB2 GLN 115 HB3 GLN 115 110.158 -1.249 -1.882 910 HB3 GLN 115 HB2 GLN 115 109.103 -2.569 -1.323 911 HG2 GLN 115 HG2 GLN 115 109.062 -1.697 0.925 912 HG3 GLN 115 HG3 GLN 115 110.356 -0.530 0.561 913 HE21 GLN 115 HE21 GLN 115 107.903 0.431 1.590 914 HE22 GLN 115 HE22 GLN 115 107.053 1.287 0.323 915 H THR 116 H THR 116 112.375 -3.492 1.454 916 HA THR 116 HA THR 116 110.497 -5.818 1.842 917 HB THR 116 HB THR 116 112.992 -5.406 3.479 918 HG1 THR 116 HG1 THR 116 113.810 -5.091 1.448 919 HG21 THR 116 HG21 THR 116 113.035 -7.855 3.387 920 HG22 THR 116 HG22 THR 116 111.698 -7.860 2.212 921 HG23 THR 116 HG23 THR 116 111.415 -7.308 3.880 922 H TYR 117 H TYR 117 109.478 -6.168 3.835 923 HA TYR 117 HA TYR 117 109.685 -3.869 5.786 924 HB2 TYR 117 HB2 TYR 117 107.055 -5.284 5.500 925 HB3 TYR 117 HB3 TYR 117 107.397 -3.602 5.969 926 HD1 TYR 117 HD1 TYR 117 107.919 -5.876 3.053 927 HD2 TYR 117 HD2 TYR 117 106.850 -1.959 4.419 928 HE1 TYR 117 HE1 TYR 117 107.493 -5.183 0.712 929 HE2 TYR 117 HE2 TYR 117 106.423 -1.250 2.082 930 HH TYR 117 HH TYR 117 105.878 -3.183 -0.372 931 H VAL 118 H VAL 118 109.309 -4.401 7.935 932 HA VAL 118 HA VAL 118 109.405 -7.369 8.522 933 HB VAL 118 HB VAL 118 110.481 -5.184 10.333 934 HG11 VAL 118 HG11 VAL 118 111.343 -6.927 11.603 935 HG12 VAL 118 HG12 VAL 118 111.465 -8.025 10.207 936 HG13 VAL 118 HG13 VAL 118 109.881 -7.711 10.957 937 HG21 VAL 118 HG21 VAL 118 112.497 -6.790 8.925 938 HG22 VAL 118 HG22 VAL 118 111.535 -5.787 7.814 939 HG23 VAL 118 HG23 VAL 118 112.413 -5.028 9.163 940 H TYR 119 H TYR 119 108.166 -8.069 10.270 941 HA TYR 119 HA TYR 119 106.446 -5.990 11.563 942 HB2 TYR 119 HB2 TYR 119 105.505 -7.287 9.351 943 HB3 TYR 119 HB3 TYR 119 104.965 -8.390 10.641 944 HD1 TYR 119 HD1 TYR 119 103.631 -7.493 12.544 945 HD2 TYR 119 HD2 TYR 119 104.483 -5.142 9.059 946 HE1 TYR 119 HE1 TYR 119 101.784 -5.951 13.138 947 HE2 TYR 119 HE2 TYR 119 102.644 -3.586 9.655 948 HH TYR 119 HH TYR 119 100.525 -3.643 10.989 949 H GLU 120 H GLU 120 106.843 -6.327 13.621 950 HA GLU 120 HA GLU 120 107.195 -7.435 15.666 951 HB2 GLU 120 HB2 GLU 120 105.021 -9.132 14.384 952 HB3 GLU 120 HB3 GLU 120 105.538 -9.321 16.077 953 HG2 GLU 120 HG2 GLU 120 104.998 -6.938 16.506 954 HG3 GLU 120 HG3 GLU 120 104.477 -6.752 14.814 955 H GLY 121 H GLY 121 108.692 -8.448 13.153 956 HA2 GLY 121 HA2 GLY 121 110.668 -9.932 13.579 957 HA3 GLY 121 HA3 GLY 121 109.584 -11.019 14.481 958 H VAL 122 H VAL 122 108.557 -9.447 11.525 959 HA VAL 122 HA VAL 122 108.853 -12.098 10.115 960 HB VAL 122 HB VAL 122 106.444 -11.084 10.814 961 HG11 VAL 122 HG11 VAL 122 106.768 -10.047 7.987 962 HG12 VAL 122 HG12 VAL 122 105.479 -9.702 9.165 963 HG13 VAL 122 HG13 VAL 122 107.100 -9.000 9.387 964 HG21 VAL 122 HG21 VAL 122 105.520 -12.383 8.920 965 HG22 VAL 122 HG22 VAL 122 107.122 -12.390 8.146 966 HG23 VAL 122 HG23 VAL 122 106.877 -13.239 9.691 967 H GLU 123 H GLU 123 108.547 -11.568 7.613 968 HA GLU 123 HA GLU 123 109.678 -8.901 6.971 969 HB2 GLU 123 HB2 GLU 123 111.394 -11.196 7.381 970 HB3 GLU 123 HB3 GLU 123 111.465 -10.697 5.674 971 HG2 GLU 123 HG3 GLU 123 111.820 -8.316 6.476 972 HG3 GLU 123 HG2 GLU 123 111.968 -8.961 8.129 973 H ALA 124 H ALA 124 108.609 -8.281 5.204 974 HA ALA 124 HA ALA 124 107.872 -10.405 3.177 975 HB1 ALA 124 HB1 ALA 124 106.484 -7.970 2.642 976 HB2 ALA 124 HB2 ALA 124 106.365 -8.246 4.396 977 HB3 ALA 124 HB3 ALA 124 105.802 -9.494 3.259 978 H LYS 125 H LYS 125 108.323 -9.912 0.926 979 HA LYS 125 HA LYS 125 110.175 -7.537 0.625 980 HB2 LYS 125 HB2 LYS 125 111.167 -9.990 0.624 981 HB3 LYS 125 HB3 LYS 125 110.531 -10.029 -1.037 982 HG2 LYS 125 HG2 LYS 125 111.822 -8.048 -1.635 983 HG3 LYS 125 HG3 LYS 125 112.349 -7.833 0.051 984 HD2 LYS 125 HD2 LYS 125 114.195 -8.944 -0.851 985 HD3 LYS 125 HD3 LYS 125 113.241 -10.317 -0.240 986 HE2 LYS 125 HE3 LYS 125 113.733 -11.006 -2.429 987 HE3 LYS 125 HE2 LYS 125 112.132 -10.255 -2.631 988 HZ1 LYS 125 HZ1 LYS 125 114.730 -8.944 -3.126 989 HZ2 LYS 125 HZ2 LYS 125 113.256 -8.219 -3.276 990 HZ3 LYS 125 HZ3 LYS 125 113.671 -9.459 -4.281 991 H ARG 126 H ARG 126 109.889 -6.277 -1.136 992 HA ARG 126 HA ARG 126 107.902 -7.218 -3.217 993 HB2 ARG 126 HB2 ARG 126 107.863 -4.829 -1.465 994 HB3 ARG 126 HB3 ARG 126 107.670 -4.450 -3.192 995 HG2 ARG 126 HG3 ARG 126 106.085 -6.725 -1.994 996 HG3 ARG 126 HG2 ARG 126 105.547 -5.050 -1.721 997 HD2 ARG 126 HD2 ARG 126 105.303 -4.639 -4.062 998 HD3 ARG 126 HD3 ARG 126 106.223 -6.100 -4.494 999 HE ARG 126 HE ARG 126 104.281 -7.454 -3.987 1000 HH11 ARG 126 HH11 ARG 126 102.030 -7.551 -3.822 1001 HH12 ARG 126 HH12 ARG 126 101.116 -6.105 -3.454 1002 HH21 ARG 126 HH21 ARG 126 103.925 -4.056 -3.299 1003 HH22 ARG 126 HH22 ARG 126 102.183 -4.137 -3.160 1004 H ILE 127 H ILE 127 108.772 -7.107 -5.261 1005 HA ILE 127 HA ILE 127 111.243 -5.374 -5.556 1006 HB ILE 127 HB ILE 127 110.579 -7.870 -7.164 1007 HG12 ILE 127 HG12 ILE 127 112.724 -7.913 -5.077 1008 HG13 ILE 127 HG13 ILE 127 111.044 -7.975 -4.491 1009 HG21 ILE 127 HG21 ILE 127 112.997 -7.760 -7.704 1010 HG22 ILE 127 HG22 ILE 127 113.150 -6.292 -6.710 1011 HG23 ILE 127 HG23 ILE 127 112.161 -6.266 -8.189 1012 HD11 ILE 127 HD11 ILE 127 111.931 -10.256 -4.894 1013 HD12 ILE 127 HD12 ILE 127 112.268 -9.825 -6.587 1014 HD13 ILE 127 HD13 ILE 127 110.588 -9.888 -6.002 1015 H PHE 128 H PHE 128 110.999 -3.708 -6.956 1016 HA PHE 128 HA PHE 128 108.706 -3.851 -8.900 1017 HB2 PHE 128 HB3 PHE 128 110.529 -1.470 -8.362 1018 HB3 PHE 128 HB2 PHE 128 108.953 -1.468 -9.181 1019 HD1 PHE 128 HD1 PHE 128 108.000 -3.647 -6.954 1020 HD2 PHE 128 HD2 PHE 128 109.552 0.349 -6.896 1021 HE1 PHE 128 HE1 PHE 128 106.834 -3.229 -4.810 1022 HE2 PHE 128 HE2 PHE 128 108.399 0.766 -4.738 1023 HZ PHE 128 HZ PHE 128 107.036 -1.025 -3.697 1024 H LYS 129 H LYS 129 109.286 -2.598 -11.037 1025 HA LYS 129 HA LYS 129 112.055 -3.080 -11.998 1026 HB2 LYS 129 HB3 LYS 129 110.757 -5.295 -12.224 1027 HB3 LYS 129 HB2 LYS 129 109.755 -4.458 -13.433 1028 HG2 LYS 129 HG2 LYS 129 112.175 -3.771 -14.389 1029 HG3 LYS 129 HG3 LYS 129 112.640 -5.283 -13.574 1030 HD2 LYS 129 HD2 LYS 129 110.482 -6.236 -14.789 1031 HD3 LYS 129 HD3 LYS 129 110.743 -4.855 -15.882 1032 HE2 LYS 129 HE2 LYS 129 113.138 -5.619 -16.155 1033 HE3 LYS 129 HE3 LYS 129 112.725 -7.075 -15.218 1034 HZ1 LYS 129 HZ1 LYS 129 112.527 -7.453 -17.585 1035 HZ2 LYS 129 HZ2 LYS 129 111.431 -6.230 -17.734 1036 HZ3 LYS 129 HZ3 LYS 129 111.048 -7.579 -16.866 1037 H LYS 130 H LYS 130 112.511 -1.768 -13.779 1038 HA LYS 130 HA LYS 130 111.032 0.591 -14.183 1039 HB2 LYS 130 HB2 LYS 130 112.122 0.454 -16.597 1040 HB3 LYS 130 HB3 LYS 130 113.155 0.635 -15.159 1041 HG2 LYS 130 HG3 LYS 130 113.606 -1.755 -15.111 1042 HG3 LYS 130 HG2 LYS 130 112.427 -2.048 -16.411 1043 HD2 LYS 130 HD2 LYS 130 113.882 -0.374 -17.795 1044 HD3 LYS 130 HD3 LYS 130 115.133 -0.692 -16.569 1045 HE2 LYS 130 HE2 LYS 130 115.596 -2.335 -18.183 1046 HE3 LYS 130 HE3 LYS 130 114.565 -3.221 -17.033 1047 HZ1 LYS 130 HZ1 LYS 130 113.841 -3.539 -19.304 1048 HZ2 LYS 130 HZ2 LYS 130 112.682 -2.736 -18.448 1049 HZ3 LYS 130 HZ3 LYS 130 113.637 -1.916 -19.514 1050 H ASP 131 H ASP 131 109.175 1.130 -15.239 1051 HA ASP 131 HA ASP 131 108.180 -0.520 -17.481 1052 HB2 ASP 131 HB2 ASP 131 106.802 -0.549 -14.766 1053 HB3 ASP 131 HB3 ASP 131 105.959 -0.958 -16.279 Start of MODEL 17 1 H1 ALA 1 H1 ALA 1 114.946 3.300 -4.309 2 H2 ALA 1 H2 ALA 1 114.534 3.167 -5.900 3 H3 ALA 1 H3 ALA 1 113.367 3.432 -4.766 4 HA ALA 1 HA ALA 1 113.536 5.600 -5.029 5 HB1 ALA 1 HB1 ALA 1 115.645 6.689 -4.301 6 HB2 ALA 1 HB2 ALA 1 115.168 5.400 -3.171 7 HB3 ALA 1 HB3 ALA 1 116.473 5.114 -4.347 8 H PHE 2 H PHE 2 113.887 3.887 -7.373 9 HA PHE 2 HA PHE 2 116.049 4.733 -9.064 10 HB2 PHE 2 HB2 PHE 2 113.224 3.789 -9.573 11 HB3 PHE 2 HB3 PHE 2 114.231 4.350 -10.925 12 HD1 PHE 2 HD1 PHE 2 113.193 1.514 -9.271 13 HD2 PHE 2 HD2 PHE 2 116.795 3.363 -10.701 14 HE1 PHE 2 HE1 PHE 2 114.271 -0.713 -9.420 15 HE2 PHE 2 HE2 PHE 2 117.883 1.140 -10.830 16 HZ PHE 2 HZ PHE 2 116.622 -0.898 -10.194 17 H ASP 3 H ASP 3 114.109 6.745 -7.520 18 HA ASP 3 HA ASP 3 113.097 8.851 -8.039 19 HB2 ASP 3 HB3 ASP 3 114.763 10.316 -9.325 20 HB3 ASP 3 HB2 ASP 3 115.402 9.526 -7.863 21 H SER 4 H SER 4 111.809 7.011 -9.600 22 HA SER 4 HA SER 4 111.090 8.596 -11.955 23 HB2 SER 4 HB2 SER 4 112.236 5.903 -12.692 24 HB3 SER 4 HB3 SER 4 111.999 7.346 -13.707 25 HG SER 4 HG SER 4 114.244 6.815 -12.918 26 H THR 5 H THR 5 110.267 6.158 -13.476 27 HA THR 5 HA THR 5 107.893 5.488 -11.736 28 HB THR 5 HB THR 5 108.363 5.470 -14.740 29 HG1 THR 5 HG1 THR 5 106.537 6.891 -14.592 30 HG21 THR 5 HG21 THR 5 106.073 4.549 -14.960 31 HG22 THR 5 HG22 THR 5 105.974 4.373 -13.192 32 HG23 THR 5 HG23 THR 5 107.145 3.404 -14.118 33 H TRP 6 H TRP 6 107.627 3.443 -10.987 34 HA TRP 6 HA TRP 6 108.955 1.171 -12.420 35 HB2 TRP 6 HB2 TRP 6 109.513 1.922 -9.515 36 HB3 TRP 6 HB3 TRP 6 109.969 0.369 -10.258 37 HD1 TRP 6 HD1 TRP 6 110.527 4.162 -10.831 38 HE1 TRP 6 HE1 TRP 6 112.822 4.508 -11.945 39 HE3 TRP 6 HE3 TRP 6 111.924 -0.718 -11.345 40 HZ2 TRP 6 HZ2 TRP 6 114.998 2.868 -12.885 41 HZ3 TRP 6 HZ3 TRP 6 114.117 -1.300 -12.340 42 HH2 TRP 6 HH2 TRP 6 115.656 0.484 -13.112 43 H LYS 7 H LYS 7 108.215 -0.982 -11.343 44 HA LYS 7 HA LYS 7 105.718 -0.673 -9.739 45 HB2 LYS 7 HB2 LYS 7 104.231 -1.630 -11.324 46 HB3 LYS 7 HB3 LYS 7 105.160 -0.429 -12.253 47 HG2 LYS 7 HG2 LYS 7 106.772 -2.373 -12.818 48 HG3 LYS 7 HG3 LYS 7 105.491 -3.450 -12.214 49 HD2 LYS 7 HD3 LYS 7 103.898 -2.489 -13.836 50 HD3 LYS 7 HD2 LYS 7 105.153 -1.371 -14.421 51 HE2 LYS 7 HE2 LYS 7 106.452 -3.136 -15.347 52 HE3 LYS 7 HE3 LYS 7 105.576 -4.378 -14.422 53 HZ1 LYS 7 HZ1 LYS 7 104.855 -4.301 -16.714 54 HZ2 LYS 7 HZ2 LYS 7 104.429 -2.714 -16.574 55 HZ3 LYS 7 HZ3 LYS 7 103.616 -3.865 -15.717 56 H VAL 8 H VAL 8 105.293 -2.463 -8.507 57 HA VAL 8 HA VAL 8 107.260 -4.358 -7.911 58 HB VAL 8 HB VAL 8 105.450 -4.316 -6.424 59 HG11 VAL 8 HG11 VAL 8 103.751 -3.222 -7.653 60 HG12 VAL 8 HG12 VAL 8 103.063 -4.834 -7.343 61 HG13 VAL 8 HG13 VAL 8 103.759 -4.454 -8.937 62 HG21 VAL 8 HG21 VAL 8 106.138 -6.642 -6.810 63 HG22 VAL 8 HG22 VAL 8 104.380 -6.576 -6.538 64 HG23 VAL 8 HG23 VAL 8 105.019 -6.768 -8.188 65 H ASP 9 H ASP 9 108.334 -5.529 -9.394 66 HA ASP 9 HA ASP 9 106.743 -6.914 -11.542 67 HB2 ASP 9 HB2 ASP 9 109.021 -5.526 -11.830 68 HB3 ASP 9 HB3 ASP 9 109.746 -7.078 -11.346 69 H ARG 10 H ARG 10 108.710 -7.395 -8.667 70 HA ARG 10 HA ARG 10 107.875 -10.284 -8.699 71 HB2 ARG 10 HB2 ARG 10 110.694 -9.204 -8.610 72 HB3 ARG 10 HB3 ARG 10 110.300 -10.697 -7.726 73 HG2 ARG 10 HG2 ARG 10 109.363 -10.419 -10.573 74 HG3 ARG 10 HG3 ARG 10 111.080 -10.781 -10.274 75 HD2 ARG 10 HD2 ARG 10 110.494 -12.759 -8.978 76 HD3 ARG 10 HD3 ARG 10 108.762 -12.356 -9.070 77 HE ARG 10 HE ARG 10 110.415 -13.541 -11.245 78 HH11 ARG 10 HH11 ARG 10 109.209 -14.171 -13.049 79 HH12 ARG 10 HH12 ARG 10 107.543 -13.660 -13.210 80 HH21 ARG 10 HH21 ARG 10 107.532 -11.879 -10.217 81 HH22 ARG 10 HH22 ARG 10 106.598 -12.368 -11.614 82 H SER 11 H SER 11 108.428 -11.285 -6.454 83 HA SER 11 HA SER 11 108.807 -9.500 -4.188 84 HB2 SER 11 HB2 SER 11 106.595 -8.649 -4.716 85 HB3 SER 11 HB3 SER 11 105.948 -10.299 -4.881 86 HG SER 11 HG SER 11 105.503 -10.048 -2.816 87 H GLU 12 H GLU 12 107.919 -10.755 -2.086 88 HA GLU 12 HA GLU 12 107.841 -13.695 -2.494 89 HB2 GLU 12 HB3 GLU 12 109.919 -14.259 -1.653 90 HB3 GLU 12 HB2 GLU 12 110.341 -12.714 -2.428 91 HG2 GLU 12 HG3 GLU 12 109.687 -11.659 -0.115 92 HG3 GLU 12 HG2 GLU 12 109.895 -13.313 0.507 93 H ASN 13 H ASN 13 107.361 -14.843 -0.495 94 HA ASN 13 HA ASN 13 106.182 -15.044 1.536 95 HB2 ASN 13 HB3 ASN 13 107.899 -12.600 1.969 96 HB3 ASN 13 HB2 ASN 13 106.670 -13.026 3.184 97 HD21 ASN 13 HD21 ASN 13 108.486 -13.549 4.696 98 HD22 ASN 13 HD22 ASN 13 109.331 -15.070 4.519 99 H TYR 14 H TYR 14 105.840 -11.757 2.356 100 HA TYR 14 HA TYR 14 104.033 -10.250 2.117 101 HB2 TYR 14 HB2 TYR 14 104.224 -11.327 -0.386 102 HB3 TYR 14 HB3 TYR 14 102.591 -11.867 0.070 103 HD1 TYR 14 HD1 TYR 14 104.409 -8.746 1.078 104 HD2 TYR 14 HD2 TYR 14 101.156 -10.451 -1.150 105 HE1 TYR 14 HE1 TYR 14 103.529 -6.472 0.622 106 HE2 TYR 14 HE2 TYR 14 100.275 -8.179 -1.604 107 HH TYR 14 HH TYR 14 100.402 -5.955 -0.881 108 H ASP 15 H ASP 15 102.929 -13.658 1.649 109 HA ASP 15 HA ASP 15 100.415 -13.250 2.994 110 HB2 ASP 15 HB2 ASP 15 102.173 -15.673 2.525 111 HB3 ASP 15 HB3 ASP 15 100.696 -15.801 3.510 112 H LYS 16 H LYS 16 103.566 -14.440 4.248 113 HA LYS 16 HA LYS 16 102.689 -14.657 6.984 114 HB2 LYS 16 HB2 LYS 16 105.473 -13.838 6.048 115 HB3 LYS 16 HB3 LYS 16 105.041 -14.657 7.568 116 HG2 LYS 16 HG2 LYS 16 104.131 -16.572 6.170 117 HG3 LYS 16 HG3 LYS 16 104.826 -15.773 4.740 118 HD2 LYS 16 HD2 LYS 16 107.069 -15.798 5.910 119 HD3 LYS 16 HD3 LYS 16 106.326 -16.778 7.197 120 HE2 LYS 16 HE2 LYS 16 105.649 -18.457 5.445 121 HE3 LYS 16 HE3 LYS 16 106.556 -17.506 4.244 122 HZ1 LYS 16 HZ1 LYS 16 107.888 -19.288 5.159 123 HZ2 LYS 16 HZ2 LYS 16 107.690 -18.709 6.691 124 HZ3 LYS 16 HZ3 LYS 16 108.531 -17.828 5.579 125 H PHE 17 H PHE 17 103.808 -11.933 5.018 126 HA PHE 17 HA PHE 17 104.008 -10.060 7.257 127 HB2 PHE 17 HB2 PHE 17 105.147 -9.622 5.144 128 HB3 PHE 17 HB3 PHE 17 103.606 -9.679 4.258 129 HD1 PHE 17 HD1 PHE 17 105.661 -7.769 6.641 130 HD2 PHE 17 HD2 PHE 17 102.047 -7.815 4.335 131 HE1 PHE 17 HE1 PHE 17 105.368 -5.346 7.067 132 HE2 PHE 17 HE2 PHE 17 101.739 -5.389 4.765 133 HZ PHE 17 HZ PHE 17 103.403 -4.155 6.131 134 H MET 18 H MET 18 101.650 -10.253 4.568 135 HA MET 18 HA MET 18 99.690 -8.554 5.760 136 HB2 MET 18 HB2 MET 18 99.257 -10.967 3.942 137 HB3 MET 18 HB3 MET 18 98.075 -9.671 4.241 138 HG2 MET 18 HG3 MET 18 100.857 -9.275 3.052 139 HG3 MET 18 HG2 MET 18 99.339 -9.306 2.123 140 HE1 MET 18 HE1 MET 18 99.709 -5.675 1.694 141 HE2 MET 18 HE2 MET 18 99.834 -7.334 1.064 142 HE3 MET 18 HE3 MET 18 101.221 -6.592 1.897 143 H GLU 19 H GLU 19 100.598 -11.844 6.518 144 HA GLU 19 HA GLU 19 98.060 -12.452 7.905 145 HB2 GLU 19 HB2 GLU 19 99.389 -14.290 6.998 146 HB3 GLU 19 HB3 GLU 19 100.801 -13.789 7.959 147 HG2 GLU 19 HG2 GLU 19 99.828 -14.479 9.985 148 HG3 GLU 19 HG3 GLU 19 98.175 -14.403 9.331 149 H LYS 20 H LYS 20 101.256 -11.165 8.747 150 HA LYS 20 HA LYS 20 100.872 -11.367 11.627 151 HB2 LYS 20 HB2 LYS 20 102.640 -9.602 9.887 152 HB3 LYS 20 HB3 LYS 20 102.686 -9.570 11.667 153 HG2 LYS 20 HG2 LYS 20 102.879 -12.223 10.242 154 HG3 LYS 20 HG3 LYS 20 104.315 -11.174 10.312 155 HD2 LYS 20 HD2 LYS 20 104.108 -11.058 12.781 156 HD3 LYS 20 HD3 LYS 20 102.676 -12.113 12.708 157 HE2 LYS 20 HE2 LYS 20 104.292 -13.723 13.093 158 HE3 LYS 20 HE3 LYS 20 104.375 -13.666 11.315 159 HZ1 LYS 20 HZ1 LYS 20 106.379 -13.055 13.142 160 HZ2 LYS 20 HZ2 LYS 20 106.452 -12.992 11.496 161 HZ3 LYS 20 HZ3 LYS 20 105.999 -11.658 12.353 162 H MET 21 H MET 21 100.239 -8.780 9.224 163 HA MET 21 HA MET 21 99.351 -6.859 11.224 164 HB2 MET 21 HB3 MET 21 98.031 -6.696 8.576 165 HB3 MET 21 HB2 MET 21 99.008 -5.484 9.438 166 HG2 MET 21 HG3 MET 21 101.070 -6.776 8.814 167 HG3 MET 21 HG2 MET 21 100.049 -7.869 7.848 168 HE1 MET 21 HE1 MET 21 101.069 -3.479 7.241 169 HE2 MET 21 HE2 MET 21 99.561 -3.763 8.142 170 HE3 MET 21 HE3 MET 21 101.091 -4.464 8.723 171 H GLY 22 H GLY 22 98.051 -9.812 10.239 172 HA2 GLY 22 HA2 GLY 22 96.003 -10.807 10.932 173 HA3 GLY 22 HA3 GLY 22 95.564 -9.276 11.728 174 H VAL 23 H VAL 23 96.571 -9.330 8.362 175 HA VAL 23 HA VAL 23 94.126 -8.006 7.516 176 HB VAL 23 HB VAL 23 96.161 -9.515 5.815 177 HG11 VAL 23 HG11 VAL 23 95.401 -7.950 4.047 178 HG12 VAL 23 HG12 VAL 23 94.049 -8.936 4.654 179 HG13 VAL 23 HG13 VAL 23 94.223 -7.244 5.179 180 HG21 VAL 23 HG21 VAL 23 97.242 -7.829 7.283 181 HG22 VAL 23 HG22 VAL 23 97.268 -7.306 5.582 182 HG23 VAL 23 HG23 VAL 23 96.091 -6.596 6.713 183 H ASN 24 H ASN 24 92.165 -8.916 7.181 184 HA ASN 24 HA ASN 24 91.476 -11.598 7.549 185 HB2 ASN 24 HB2 ASN 24 90.247 -9.842 5.380 186 HB3 ASN 24 HB3 ASN 24 89.461 -11.171 6.266 187 HD21 ASN 24 HD21 ASN 24 87.826 -9.899 7.312 188 HD22 ASN 24 HD22 ASN 24 88.217 -8.668 8.492 189 H ILE 25 H ILE 25 90.748 -13.224 5.814 190 HA ILE 25 HA ILE 25 93.069 -13.699 4.045 191 HB ILE 25 HB ILE 25 90.562 -15.181 4.803 192 HG12 ILE 25 HG12 ILE 25 92.928 -15.273 5.917 193 HG13 ILE 25 HG13 ILE 25 92.084 -16.804 5.584 194 HG21 ILE 25 HG21 ILE 25 91.198 -16.932 3.079 195 HG22 ILE 25 HG22 ILE 25 92.270 -15.720 2.340 196 HG23 ILE 25 HG23 ILE 25 90.514 -15.436 2.399 197 HD11 ILE 25 HD11 ILE 25 94.602 -16.558 4.873 198 HD12 ILE 25 HD12 ILE 25 93.455 -17.304 3.735 199 HD13 ILE 25 HD13 ILE 25 93.948 -15.608 3.518 200 H VAL 26 H VAL 26 90.427 -11.784 3.841 201 HA VAL 26 HA VAL 26 89.772 -12.275 0.988 202 HB VAL 26 HB VAL 26 89.022 -9.856 2.676 203 HG11 VAL 26 HG11 VAL 26 88.572 -9.739 0.241 204 HG12 VAL 26 HG12 VAL 26 87.055 -9.845 1.167 205 HG13 VAL 26 HG13 VAL 26 87.690 -11.283 0.330 206 HG21 VAL 26 HG21 VAL 26 86.850 -11.346 2.956 207 HG22 VAL 26 HG22 VAL 26 88.232 -11.577 4.053 208 HG23 VAL 26 HG23 VAL 26 87.982 -12.693 2.689 209 H LYS 27 H LYS 27 91.070 -9.458 2.814 210 HA LYS 27 HA LYS 27 92.025 -8.104 0.447 211 HB2 LYS 27 HB2 LYS 27 92.468 -7.902 3.401 212 HB3 LYS 27 HB3 LYS 27 93.728 -7.192 2.363 213 HG2 LYS 27 HG2 LYS 27 91.992 -5.515 2.899 214 HG3 LYS 27 HG3 LYS 27 91.987 -5.889 1.158 215 HD2 LYS 27 HD2 LYS 27 90.066 -7.339 1.399 216 HD3 LYS 27 HD3 LYS 27 90.158 -7.258 3.175 217 HE2 LYS 27 HE2 LYS 27 88.382 -5.762 2.183 218 HE3 LYS 27 HE3 LYS 27 89.592 -4.888 3.152 219 HZ1 LYS 27 HZ1 LYS 27 88.954 -4.084 0.780 220 HZ2 LYS 27 HZ2 LYS 27 90.518 -3.988 1.297 221 HZ3 LYS 27 HZ3 LYS 27 90.055 -5.211 0.292 222 H ARG 28 H ARG 28 93.372 -10.636 2.504 223 HA ARG 28 HA ARG 28 96.090 -10.456 1.452 224 HB2 ARG 28 HB3 ARG 28 95.333 -11.646 3.591 225 HB3 ARG 28 HB2 ARG 28 94.717 -12.946 2.542 226 HG2 ARG 28 HG3 ARG 28 97.037 -13.081 1.511 227 HG3 ARG 28 HG2 ARG 28 97.592 -11.964 2.780 228 HD2 ARG 28 HD2 ARG 28 98.041 -14.010 3.797 229 HD3 ARG 28 HD3 ARG 28 96.386 -13.718 4.383 230 HE ARG 28 HE ARG 28 95.915 -15.110 2.045 231 HH11 ARG 28 HH11 ARG 28 95.931 -17.365 1.897 232 HH12 ARG 28 HH12 ARG 28 96.876 -18.309 3.027 233 HH21 ARG 28 HH21 ARG 28 98.069 -15.527 4.748 234 HH22 ARG 28 HH22 ARG 28 98.081 -17.272 4.634 235 H LYS 29 H LYS 29 93.244 -12.502 0.644 236 HA LYS 29 HA LYS 29 94.520 -14.042 -1.409 237 HB2 LYS 29 HB2 LYS 29 92.157 -14.318 -0.414 238 HB3 LYS 29 HB3 LYS 29 91.648 -13.051 -1.556 239 HG2 LYS 29 HG2 LYS 29 91.259 -14.965 -2.830 240 HG3 LYS 29 HG3 LYS 29 92.926 -14.577 -3.318 241 HD2 LYS 29 HD3 LYS 29 93.822 -16.189 -1.718 242 HD3 LYS 29 HD2 LYS 29 92.196 -16.498 -1.064 243 HE2 LYS 29 HE3 LYS 29 92.988 -16.991 -3.967 244 HE3 LYS 29 HE2 LYS 29 92.987 -18.249 -2.707 245 HZ1 LYS 29 HZ1 LYS 29 90.919 -18.216 -3.935 246 HZ2 LYS 29 HZ2 LYS 29 90.649 -17.807 -2.360 247 HZ3 LYS 29 HZ3 LYS 29 90.650 -16.641 -3.527 248 H LEU 30 H LEU 30 93.061 -10.794 -1.476 249 HA LEU 30 HA LEU 30 93.572 -10.578 -4.401 250 HB2 LEU 30 HB3 LEU 30 92.538 -8.564 -2.360 251 HB3 LEU 30 HB2 LEU 30 92.681 -8.255 -4.107 252 HG LEU 30 HG LEU 30 91.058 -10.527 -2.880 253 HD11 LEU 30 HD11 LEU 30 89.087 -9.166 -3.523 254 HD12 LEU 30 HD12 LEU 30 90.166 -7.856 -4.059 255 HD13 LEU 30 HD13 LEU 30 90.098 -8.306 -2.338 256 HD21 LEU 30 HD21 LEU 30 91.905 -10.955 -5.173 257 HD22 LEU 30 HD22 LEU 30 90.142 -10.714 -5.177 258 HD23 LEU 30 HD23 LEU 30 91.220 -9.404 -5.715 259 H ALA 31 H ALA 31 95.241 -10.133 -1.518 260 HA ALA 31 HA ALA 31 96.930 -7.877 -2.297 261 HB1 ALA 31 HB1 ALA 31 98.483 -9.161 -0.514 262 HB2 ALA 31 HB2 ALA 31 96.946 -9.985 -0.161 263 HB3 ALA 31 HB3 ALA 31 97.061 -8.215 -0.012 264 H ALA 32 H ALA 32 97.370 -11.445 -2.370 265 HA ALA 32 HA ALA 32 99.982 -11.660 -3.300 266 HB1 ALA 32 HB1 ALA 32 99.259 -13.641 -4.605 267 HB2 ALA 32 HB2 ALA 32 97.566 -13.109 -4.472 268 HB3 ALA 32 HB3 ALA 32 98.462 -13.597 -3.014 269 H HIS 33 H HIS 33 97.316 -10.112 -4.931 270 HA HIS 33 HA HIS 33 98.431 -10.236 -7.626 271 HB2 HIS 33 HB2 HIS 33 96.041 -9.666 -7.088 272 HB3 HIS 33 HB3 HIS 33 96.600 -8.116 -6.416 273 HD2 HIS 33 HD2 HIS 33 97.191 -6.159 -8.340 274 HE1 HIS 33 HE1 HIS 33 96.587 -8.571 -11.754 275 HE2 HIS 33 HE2 HIS 33 97.028 -6.184 -10.960 276 H ASP 34 H ASP 34 100.436 -9.562 -5.644 277 HA ASP 34 HA ASP 34 101.041 -6.801 -5.417 278 HB2 ASP 34 HB2 ASP 34 103.269 -8.708 -6.097 279 HB3 ASP 34 HB3 ASP 34 103.184 -7.474 -4.817 280 H ASN 35 H ASN 35 100.282 -5.801 -7.395 281 HA ASN 35 HA ASN 35 102.420 -5.798 -9.488 282 HB2 ASN 35 HB2 ASN 35 99.878 -7.145 -9.815 283 HB3 ASN 35 HB3 ASN 35 99.932 -5.735 -10.900 284 HD21 ASN 35 HD21 ASN 35 100.245 -8.784 -11.409 285 HD22 ASN 35 HD22 ASN 35 101.737 -8.890 -12.316 286 H LEU 36 H LEU 36 101.820 -3.858 -7.519 287 HA LEU 36 HA LEU 36 100.107 -1.824 -8.875 288 HB2 LEU 36 HB2 LEU 36 100.300 -0.541 -6.860 289 HB3 LEU 36 HB3 LEU 36 100.098 -2.233 -6.352 290 HG LEU 36 HG LEU 36 102.912 -1.301 -6.775 291 HD11 LEU 36 HD11 LEU 36 101.030 -0.175 -4.700 292 HD12 LEU 36 HD12 LEU 36 102.727 -0.480 -4.259 293 HD13 LEU 36 HD13 LEU 36 102.340 0.634 -5.593 294 HD21 LEU 36 HD21 LEU 36 101.903 -2.659 -4.298 295 HD22 LEU 36 HD22 LEU 36 103.380 -2.966 -5.242 296 HD23 LEU 36 HD23 LEU 36 101.811 -3.574 -5.822 297 H LYS 37 H LYS 37 100.933 0.397 -9.168 298 HA LYS 37 HA LYS 37 103.804 0.324 -10.114 299 HB2 LYS 37 HB3 LYS 37 101.800 0.832 -11.712 300 HB3 LYS 37 HB2 LYS 37 101.722 2.399 -10.874 301 HG2 LYS 37 HG2 LYS 37 103.604 3.172 -11.900 302 HG3 LYS 37 HG3 LYS 37 104.458 1.623 -11.700 303 HD2 LYS 37 HD2 LYS 37 103.488 0.704 -13.663 304 HD3 LYS 37 HD3 LYS 37 102.202 1.933 -13.709 305 HE2 LYS 37 HE3 LYS 37 104.024 3.674 -14.079 306 HE3 LYS 37 HE2 LYS 37 105.167 2.325 -14.288 307 HZ1 LYS 37 HZ1 LYS 37 104.264 3.061 -16.391 308 HZ2 LYS 37 HZ2 LYS 37 103.782 1.515 -16.077 309 HZ3 LYS 37 HZ3 LYS 37 102.723 2.764 -15.884 310 H LEU 38 H LEU 38 105.212 1.996 -9.439 311 HA LEU 38 HA LEU 38 104.043 3.986 -7.500 312 HB2 LEU 38 HB3 LEU 38 106.676 2.644 -6.865 313 HB3 LEU 38 HB2 LEU 38 105.532 3.455 -5.770 314 HG LEU 38 HG LEU 38 103.890 1.526 -6.497 315 HD11 LEU 38 HD11 LEU 38 105.959 -0.439 -6.618 316 HD12 LEU 38 HD12 LEU 38 106.348 0.793 -7.842 317 HD13 LEU 38 HD13 LEU 38 104.771 -0.031 -7.879 318 HD21 LEU 38 HD21 LEU 38 104.536 1.651 -4.221 319 HD22 LEU 38 HD22 LEU 38 106.249 1.346 -4.597 320 HD23 LEU 38 HD23 LEU 38 105.063 0.024 -4.714 321 H THR 39 H THR 39 104.692 5.986 -8.061 322 HA THR 39 HA THR 39 107.132 6.226 -9.806 323 HB THR 39 HB THR 39 105.429 8.600 -9.113 324 HG1 THR 39 HG1 THR 39 103.820 7.110 -9.496 325 HG21 THR 39 HG21 THR 39 105.822 9.082 -11.512 326 HG22 THR 39 HG22 THR 39 107.354 8.756 -10.666 327 HG23 THR 39 HG23 THR 39 106.623 7.504 -11.698 328 H ILE 40 H ILE 40 108.929 6.320 -8.510 329 HA ILE 40 HA ILE 40 108.744 7.937 -5.982 330 HB ILE 40 HB ILE 40 111.209 6.432 -6.873 331 HG12 ILE 40 HG12 ILE 40 109.871 4.602 -5.312 332 HG13 ILE 40 HG13 ILE 40 108.528 5.301 -6.247 333 HG21 ILE 40 HG21 ILE 40 111.417 6.107 -4.422 334 HG22 ILE 40 HG22 ILE 40 111.260 7.832 -4.829 335 HG23 ILE 40 HG23 ILE 40 109.863 6.940 -4.180 336 HD11 ILE 40 HD11 ILE 40 109.517 3.358 -7.428 337 HD12 ILE 40 HD12 ILE 40 109.763 4.859 -8.351 338 HD13 ILE 40 HD13 ILE 40 111.106 4.159 -7.416 339 H THR 41 H THR 41 109.563 9.951 -5.881 340 HA THR 41 HA THR 41 111.619 10.731 -7.954 341 HB THR 41 HB THR 41 109.636 12.733 -6.873 342 HG1 THR 41 HG1 THR 41 108.250 11.193 -7.648 343 HG21 THR 41 HG21 THR 41 110.038 13.750 -9.098 344 HG22 THR 41 HG22 THR 41 111.570 13.464 -8.239 345 HG23 THR 41 HG23 THR 41 111.063 12.366 -9.545 346 H GLN 42 H GLN 42 113.159 12.314 -7.193 347 HA GLN 42 HA GLN 42 113.069 12.740 -4.199 348 HB2 GLN 42 HB2 GLN 42 115.511 12.354 -4.123 349 HB3 GLN 42 HB3 GLN 42 114.667 10.916 -4.745 350 HG2 GLN 42 HG3 GLN 42 115.154 11.674 -7.076 351 HG3 GLN 42 HG2 GLN 42 116.062 13.055 -6.415 352 HE21 GLN 42 HE21 GLN 42 118.235 12.703 -5.831 353 HE22 GLN 42 HE22 GLN 42 118.985 11.123 -5.797 354 H GLU 43 H GLU 43 113.817 14.765 -3.504 355 HA GLU 43 HA GLU 43 114.916 16.581 -5.642 356 HB2 GLU 43 HB3 GLU 43 112.680 17.392 -3.735 357 HB3 GLU 43 HB2 GLU 43 113.367 18.355 -5.065 358 HG2 GLU 43 HG2 GLU 43 112.660 16.192 -6.492 359 HG3 GLU 43 HG3 GLU 43 111.484 16.014 -5.168 360 H GLY 44 H GLY 44 116.902 16.105 -4.395 361 HA2 GLY 44 HA2 GLY 44 118.502 16.708 -2.774 362 HA3 GLY 44 HA3 GLY 44 117.594 18.229 -2.622 363 H ASN 45 H ASN 45 115.777 18.275 -1.084 364 HA ASN 45 HA ASN 45 116.085 16.163 1.064 365 HB2 ASN 45 HB2 ASN 45 115.624 18.000 2.718 366 HB3 ASN 45 HB3 ASN 45 117.154 18.212 1.834 367 HD21 ASN 45 HD21 ASN 45 114.583 18.775 -0.315 368 HD22 ASN 45 HD22 ASN 45 114.518 20.517 -0.173 369 H LYS 46 H LYS 46 114.115 16.449 -1.179 370 HA LYS 46 HA LYS 46 111.701 16.189 0.549 371 HB2 LYS 46 HB2 LYS 46 111.526 18.516 -0.060 372 HB3 LYS 46 HB3 LYS 46 112.012 18.178 -1.739 373 HG2 LYS 46 HG2 LYS 46 109.706 16.562 -0.973 374 HG3 LYS 46 HG3 LYS 46 109.378 18.293 -0.728 375 HD2 LYS 46 HD2 LYS 46 110.249 18.706 -3.070 376 HD3 LYS 46 HD3 LYS 46 110.332 16.942 -3.289 377 HE2 LYS 46 HE2 LYS 46 108.016 16.694 -3.278 378 HE3 LYS 46 HE3 LYS 46 107.760 18.153 -2.291 379 HZ1 LYS 46 HZ1 LYS 46 107.236 19.039 -4.260 380 HZ2 LYS 46 HZ2 LYS 46 108.034 17.898 -5.144 381 HZ3 LYS 46 HZ3 LYS 46 108.865 19.163 -4.488 382 H PHE 47 H PHE 47 111.185 14.169 0.021 383 HA PHE 47 HA PHE 47 111.575 13.243 -2.809 384 HB2 PHE 47 HB2 PHE 47 111.249 11.909 -0.128 385 HB3 PHE 47 HB3 PHE 47 110.783 11.013 -1.593 386 HD1 PHE 47 HD1 PHE 47 113.565 13.368 -0.634 387 HD2 PHE 47 HD2 PHE 47 112.453 9.608 -2.389 388 HE1 PHE 47 HE1 PHE 47 115.952 12.874 -1.088 389 HE2 PHE 47 HE2 PHE 47 114.840 9.116 -2.845 390 HZ PHE 47 HZ PHE 47 116.589 10.747 -2.194 391 H THR 48 H THR 48 109.752 11.663 -3.554 392 HA THR 48 HA THR 48 107.056 12.424 -2.559 393 HB THR 48 HB THR 48 107.950 13.035 -5.414 394 HG1 THR 48 HG1 THR 48 108.622 14.604 -3.886 395 HG21 THR 48 HG21 THR 48 105.653 13.934 -5.661 396 HG22 THR 48 HG22 THR 48 105.622 12.201 -5.259 397 HG23 THR 48 HG23 THR 48 105.270 13.412 -4.003 398 H VAL 49 H VAL 49 106.446 10.335 -2.245 399 HA VAL 49 HA VAL 49 106.991 8.362 -4.449 400 HB VAL 49 HB VAL 49 105.806 7.840 -1.692 401 HG11 VAL 49 HG11 VAL 49 105.447 6.083 -3.405 402 HG12 VAL 49 HG12 VAL 49 106.591 5.533 -2.157 403 HG13 VAL 49 HG13 VAL 49 107.193 6.059 -3.747 404 HG21 VAL 49 HG21 VAL 49 108.106 7.174 -1.039 405 HG22 VAL 49 HG22 VAL 49 108.044 8.894 -1.492 406 HG23 VAL 49 HG23 VAL 49 108.708 7.697 -2.630 407 H LYS 50 H LYS 50 105.412 8.148 -5.943 408 HA LYS 50 HA LYS 50 102.575 8.684 -5.039 409 HB2 LYS 50 HB3 LYS 50 103.645 10.079 -6.931 410 HB3 LYS 50 HB2 LYS 50 103.559 8.596 -7.912 411 HG2 LYS 50 HG2 LYS 50 101.166 8.501 -7.723 412 HG3 LYS 50 HG3 LYS 50 101.149 9.742 -6.448 413 HD2 LYS 50 HD3 LYS 50 101.834 11.460 -8.004 414 HD3 LYS 50 HD2 LYS 50 102.169 10.257 -9.272 415 HE2 LYS 50 HE2 LYS 50 99.652 9.602 -8.988 416 HE3 LYS 50 HE3 LYS 50 99.496 11.183 -8.186 417 HZ1 LYS 50 HZ1 LYS 50 99.077 11.338 -10.550 418 HZ2 LYS 50 HZ2 LYS 50 100.572 10.735 -10.899 419 HZ3 LYS 50 HZ3 LYS 50 100.427 12.200 -10.157 420 H GLU 51 H GLU 51 101.864 6.664 -4.378 421 HA GLU 51 HA GLU 51 102.561 4.242 -5.915 422 HB2 GLU 51 HB2 GLU 51 100.438 4.682 -3.765 423 HB3 GLU 51 HB3 GLU 51 101.016 3.106 -4.357 424 HG2 GLU 51 HG2 GLU 51 103.134 3.366 -3.369 425 HG3 GLU 51 HG3 GLU 51 102.985 5.138 -3.284 426 H SER 52 H SER 52 100.940 2.899 -7.036 427 HA SER 52 HA SER 52 98.356 4.179 -7.697 428 HB2 SER 52 HB2 SER 52 99.985 3.515 -10.115 429 HB3 SER 52 HB3 SER 52 98.768 4.792 -9.876 430 HG SER 52 HG SER 52 100.953 5.605 -10.025 431 H SER 53 H SER 53 97.192 2.446 -7.235 432 HA SER 53 HA SER 53 97.818 -0.094 -8.737 433 HB2 SER 53 HB3 SER 53 96.467 -0.738 -6.292 434 HB3 SER 53 HB2 SER 53 98.116 -1.195 -6.782 435 HG SER 53 HG SER 53 98.824 0.839 -5.940 436 H ALA 54 H ALA 54 95.955 -1.161 -9.520 437 HA ALA 54 HA ALA 54 93.668 0.458 -10.091 438 HB1 ALA 54 HB1 ALA 54 92.561 -1.666 -10.739 439 HB2 ALA 54 HB2 ALA 54 93.837 -2.584 -9.904 440 HB3 ALA 54 HB3 ALA 54 94.236 -1.609 -11.338 441 H PHE 55 H PHE 55 94.597 -0.302 -7.080 442 HA PHE 55 HA PHE 55 91.793 -0.894 -6.130 443 HB2 PHE 55 HB2 PHE 55 93.497 -2.503 -5.381 444 HB3 PHE 55 HB3 PHE 55 94.472 -1.177 -4.703 445 HD1 PHE 55 HD1 PHE 55 93.983 -0.270 -2.560 446 HD2 PHE 55 HD2 PHE 55 91.173 -2.912 -4.452 447 HE1 PHE 55 HE1 PHE 55 92.675 -0.383 -0.457 448 HE2 PHE 55 HE2 PHE 55 89.865 -3.025 -2.348 449 HZ PHE 55 HZ PHE 55 90.615 -1.760 -0.351 450 H ARG 56 H ARG 56 94.354 1.533 -6.076 451 HA ARG 56 HA ARG 56 92.782 3.698 -5.323 452 HB2 ARG 56 HB3 ARG 56 93.196 1.889 -3.023 453 HB3 ARG 56 HB2 ARG 56 93.713 3.561 -2.701 454 HG2 ARG 56 HG2 ARG 56 91.068 3.104 -4.074 455 HG3 ARG 56 HG3 ARG 56 91.180 2.824 -2.319 456 HD2 ARG 56 HD2 ARG 56 91.651 5.060 -1.855 457 HD3 ARG 56 HD3 ARG 56 92.351 5.355 -3.464 458 HE ARG 56 HE ARG 56 89.483 4.736 -3.609 459 HH11 ARG 56 HH11 ARG 56 88.151 6.474 -4.170 460 HH12 ARG 56 HH12 ARG 56 88.761 8.111 -4.067 461 HH21 ARG 56 HH21 ARG 56 91.910 7.141 -2.942 462 HH22 ARG 56 HH22 ARG 56 90.879 8.487 -3.375 463 H ASN 57 H ASN 57 94.462 4.548 -6.645 464 HA ASN 57 HA ASN 57 97.267 4.388 -5.974 465 HB2 ASN 57 HB2 ASN 57 97.540 6.272 -7.526 466 HB3 ASN 57 HB3 ASN 57 96.368 5.112 -8.196 467 HD21 ASN 57 HD21 ASN 57 96.843 8.387 -7.808 468 HD22 ASN 57 HD22 ASN 57 95.175 8.906 -7.725 469 H ILE 58 H ILE 58 98.605 5.762 -4.782 470 HA ILE 58 HA ILE 58 97.215 7.955 -3.244 471 HB ILE 58 HB ILE 58 99.331 6.296 -1.903 472 HG12 ILE 58 HG12 ILE 58 96.446 5.495 -2.393 473 HG13 ILE 58 HG13 ILE 58 97.922 4.516 -2.588 474 HG21 ILE 58 HG21 ILE 58 98.017 8.508 -1.125 475 HG22 ILE 58 HG22 ILE 58 96.806 7.304 -0.624 476 HG23 ILE 58 HG23 ILE 58 98.459 7.228 0.031 477 HD11 ILE 58 HD11 ILE 58 97.095 3.743 -0.532 478 HD12 ILE 58 HD12 ILE 58 98.250 4.997 -0.020 479 HD13 ILE 58 HD13 ILE 58 96.506 5.353 -0.052 480 H GLU 59 H GLU 59 98.949 9.267 -2.028 481 HA GLU 59 HA GLU 59 101.609 9.337 -3.337 482 HB2 GLU 59 HB2 GLU 59 101.402 11.387 -4.470 483 HB3 GLU 59 HB3 GLU 59 99.846 10.599 -4.824 484 HG2 GLU 59 HG3 GLU 59 99.044 11.806 -2.621 485 HG3 GLU 59 HG2 GLU 59 100.450 12.859 -2.907 486 H CYS 60 H CYS 60 103.111 10.433 -2.053 487 HA CYS 60 HA CYS 60 102.204 12.266 0.066 488 HB2 CYS 60 HB3 CYS 60 102.667 10.925 1.985 489 HB3 CYS 60 HB2 CYS 60 101.675 9.893 0.928 490 HG CYS 60 HG CYS 60 105.124 9.756 0.724 491 H VAL 61 H VAL 61 103.823 13.679 0.403 492 HA VAL 61 HA VAL 61 106.487 13.100 -0.758 493 HB VAL 61 HB VAL 61 105.880 15.326 -1.110 494 HG11 VAL 61 HG11 VAL 61 104.972 16.676 0.982 495 HG12 VAL 61 HG12 VAL 61 103.880 15.618 0.057 496 HG13 VAL 61 HG13 VAL 61 104.575 15.054 1.596 497 HG21 VAL 61 HG21 VAL 61 107.277 16.730 0.324 498 HG22 VAL 61 HG22 VAL 61 107.288 15.481 1.591 499 HG23 VAL 61 HG23 VAL 61 108.110 15.183 0.041 500 H PHE 62 H PHE 62 108.480 13.389 0.544 501 HA PHE 62 HA PHE 62 108.150 13.173 3.482 502 HB2 PHE 62 HB3 PHE 62 108.695 10.965 3.804 503 HB3 PHE 62 HB2 PHE 62 107.903 10.809 2.220 504 HD1 PHE 62 HD1 PHE 62 111.273 11.418 3.769 505 HD2 PHE 62 HD2 PHE 62 109.067 9.859 0.430 506 HE1 PHE 62 HE1 PHE 62 113.371 10.513 2.806 507 HE2 PHE 62 HE2 PHE 62 111.165 8.956 -0.535 508 HZ PHE 62 HZ PHE 62 113.317 9.279 0.655 509 H GLU 63 H GLU 63 109.874 14.027 4.504 510 HA GLU 63 HA GLU 63 112.293 14.629 2.799 511 HB2 GLU 63 HB2 GLU 63 111.218 16.615 3.746 512 HB3 GLU 63 HB3 GLU 63 111.248 15.896 5.373 513 HG2 GLU 63 HG2 GLU 63 113.588 16.107 5.561 514 HG3 GLU 63 HG3 GLU 63 113.814 16.232 3.800 515 H LEU 64 H LEU 64 114.405 14.646 4.124 516 HA LEU 64 HA LEU 64 114.514 12.042 5.580 517 HB2 LEU 64 HB3 LEU 64 116.655 14.003 4.657 518 HB3 LEU 64 HB2 LEU 64 117.004 12.495 5.534 519 HG LEU 64 HG LEU 64 115.241 12.363 3.095 520 HD11 LEU 64 HD11 LEU 64 117.166 13.758 2.389 521 HD12 LEU 64 HD12 LEU 64 118.288 12.543 3.046 522 HD13 LEU 64 HD13 LEU 64 117.250 12.138 1.658 523 HD21 LEU 64 HD21 LEU 64 116.362 10.158 2.898 524 HD22 LEU 64 HD22 LEU 64 115.648 10.369 4.515 525 HD23 LEU 64 HD23 LEU 64 117.402 10.563 4.285 526 H GLY 65 H GLY 65 114.379 11.940 7.754 527 HA2 GLY 65 HA3 GLY 65 114.950 12.546 10.003 528 HA3 GLY 65 HA2 GLY 65 115.700 14.040 9.395 529 H VAL 66 H VAL 66 112.423 13.063 8.483 530 HA VAL 66 HA VAL 66 111.298 15.014 10.470 531 HB VAL 66 HB VAL 66 110.705 15.179 7.483 532 HG11 VAL 66 HG11 VAL 66 108.864 15.882 8.988 533 HG12 VAL 66 HG12 VAL 66 109.569 17.281 8.143 534 HG13 VAL 66 HG13 VAL 66 109.981 16.970 9.846 535 HG21 VAL 66 HG21 VAL 66 111.914 17.453 7.806 536 HG22 VAL 66 HG22 VAL 66 112.927 15.993 7.707 537 HG23 VAL 66 HG23 VAL 66 112.586 16.735 9.289 538 H THR 67 H THR 67 110.007 13.519 11.516 539 HA THR 67 HA THR 67 108.785 11.230 10.429 540 HB THR 67 HB THR 67 107.229 12.975 12.341 541 HG1 THR 67 HG1 THR 67 108.645 12.154 13.982 542 HG21 THR 67 HG21 THR 67 106.760 10.763 13.364 543 HG22 THR 67 HG22 THR 67 106.316 10.781 11.641 544 HG23 THR 67 HG23 THR 67 107.820 9.985 12.164 545 H PHE 68 H PHE 68 106.909 10.766 9.443 546 HA PHE 68 HA PHE 68 104.856 12.735 8.832 547 HB2 PHE 68 HB2 PHE 68 105.235 13.276 6.631 548 HB3 PHE 68 HB3 PHE 68 106.926 13.123 7.158 549 HD1 PHE 68 HD1 PHE 68 107.330 10.274 7.353 550 HD2 PHE 68 HD2 PHE 68 105.132 12.494 4.421 551 HE1 PHE 68 HE1 PHE 68 107.765 8.489 5.687 552 HE2 PHE 68 HE2 PHE 68 105.534 10.699 2.755 553 HZ PHE 68 HZ PHE 68 106.858 8.697 3.386 554 H ASN 69 H ASN 69 103.715 11.410 6.618 555 HA ASN 69 HA ASN 69 103.720 8.540 7.457 556 HB2 ASN 69 HB2 ASN 69 101.270 8.535 7.812 557 HB3 ASN 69 HB3 ASN 69 102.093 9.616 8.961 558 HD21 ASN 69 HD21 ASN 69 102.454 11.357 6.245 559 HD22 ASN 69 HD22 ASN 69 100.955 12.258 6.233 560 H CYS 70 H CYS 70 102.575 7.155 6.066 561 HA CYS 70 HA CYS 70 101.559 8.258 3.492 562 HB2 CYS 70 HB2 CYS 70 104.188 7.734 3.475 563 HB3 CYS 70 HB3 CYS 70 103.612 6.059 3.296 564 HG CYS 70 HG CYS 70 102.276 6.417 0.907 565 H ASN 71 H ASN 71 99.944 6.891 2.695 566 HA ASN 71 HA ASN 71 99.400 4.517 4.454 567 HB2 ASN 71 HB2 ASN 71 97.212 4.695 2.825 568 HB3 ASN 71 HB3 ASN 71 97.369 5.559 4.373 569 HD21 ASN 71 HD21 ASN 71 96.200 6.190 1.455 570 HD22 ASN 71 HD22 ASN 71 96.776 7.821 1.196 571 H LEU 72 H LEU 72 98.982 2.452 3.588 572 HA LEU 72 HA LEU 72 100.332 2.022 0.938 573 HB2 LEU 72 HB2 LEU 72 99.388 -0.062 2.952 574 HB3 LEU 72 HB3 LEU 72 100.531 -0.295 1.609 575 HG LEU 72 HG LEU 72 101.015 1.644 3.908 576 HD11 LEU 72 HD11 LEU 72 100.880 -0.683 4.755 577 HD12 LEU 72 HD12 LEU 72 102.043 -1.202 3.512 578 HD13 LEU 72 HD13 LEU 72 102.555 -0.084 4.798 579 HD21 LEU 72 HD21 LEU 72 103.349 1.539 3.071 580 HD22 LEU 72 HD22 LEU 72 102.237 2.096 1.798 581 HD23 LEU 72 HD23 LEU 72 102.836 0.420 1.785 582 H ALA 73 H ALA 73 99.305 0.922 -0.767 583 HA ALA 73 HA ALA 73 96.657 1.475 -1.396 584 HB1 ALA 73 HB1 ALA 73 96.694 -0.500 -2.895 585 HB2 ALA 73 HB2 ALA 73 98.241 0.378 -2.954 586 HB3 ALA 73 HB3 ALA 73 98.110 -1.134 -2.023 587 H ASP 74 H ASP 74 97.817 -1.157 0.696 588 HA ASP 74 HA ASP 74 95.357 -2.616 0.896 589 HB2 ASP 74 HB2 ASP 74 97.372 -2.100 3.127 590 HB3 ASP 74 HB3 ASP 74 96.228 -3.459 3.019 591 H GLY 75 H GLY 75 95.670 0.595 1.369 592 HA2 GLY 75 HA3 GLY 75 94.151 2.128 2.358 593 HA3 GLY 75 HA2 GLY 75 93.183 0.746 2.926 594 H THR 76 H THR 76 96.614 0.882 3.629 595 HA THR 76 HA THR 76 95.890 1.215 6.528 596 HB THR 76 HB THR 76 98.699 0.615 5.835 597 HG1 THR 76 HG1 THR 76 97.730 -0.533 4.154 598 HG21 THR 76 HG21 THR 76 98.332 -1.144 7.542 599 HG22 THR 76 HG22 THR 76 96.589 -0.781 7.540 600 HG23 THR 76 HG23 THR 76 97.752 0.438 8.116 601 H GLU 77 H GLU 77 97.348 2.547 7.856 602 HA GLU 77 HA GLU 77 98.683 4.751 6.287 603 HB2 GLU 77 HB2 GLU 77 96.372 5.417 7.107 604 HB3 GLU 77 HB3 GLU 77 96.967 5.182 8.768 605 HG2 GLU 77 HG2 GLU 77 98.788 6.829 8.320 606 HG3 GLU 77 HG3 GLU 77 98.118 7.098 6.693 607 H LEU 78 H LEU 78 100.771 5.052 7.006 608 HA LEU 78 HA LEU 78 101.312 4.293 9.885 609 HB2 LEU 78 HB3 LEU 78 103.307 3.723 7.678 610 HB3 LEU 78 HB2 LEU 78 103.242 3.052 9.325 611 HG LEU 78 HG LEU 78 100.841 2.197 8.460 612 HD11 LEU 78 HD11 LEU 78 101.084 3.269 6.236 613 HD12 LEU 78 HD12 LEU 78 102.575 2.339 5.951 614 HD13 LEU 78 HD13 LEU 78 101.012 1.497 6.087 615 HD21 LEU 78 HD21 LEU 78 101.948 0.049 7.895 616 HD22 LEU 78 HD22 LEU 78 102.688 0.791 9.334 617 HD23 LEU 78 HD23 LEU 78 103.511 0.891 7.759 618 H ARG 79 H ARG 79 103.289 5.298 10.768 619 HA ARG 79 HA ARG 79 104.148 7.741 9.212 620 HB2 ARG 79 HB2 ARG 79 103.967 9.115 11.246 621 HB3 ARG 79 HB3 ARG 79 102.387 8.400 10.846 622 HG2 ARG 79 HG3 ARG 79 102.797 6.586 12.493 623 HG3 ARG 79 HG2 ARG 79 104.369 7.316 12.899 624 HD2 ARG 79 HD2 ARG 79 103.344 9.261 13.830 625 HD3 ARG 79 HD3 ARG 79 101.770 8.882 13.091 626 HE ARG 79 HE ARG 79 102.433 6.694 14.811 627 HH11 ARG 79 HH11 ARG 79 101.552 6.640 16.892 628 HH12 ARG 79 HH12 ARG 79 100.974 8.114 17.636 629 HH21 ARG 79 HH21 ARG 79 101.790 10.115 14.906 630 HH22 ARG 79 HH22 ARG 79 101.108 10.073 16.516 631 H GLY 80 H GLY 80 106.261 8.478 9.687 632 HA2 GLY 80 HA3 GLY 80 108.013 7.805 11.721 633 HA3 GLY 80 HA2 GLY 80 108.091 6.383 10.645 634 H THR 81 H THR 81 109.482 6.551 8.921 635 HA THR 81 HA THR 81 109.677 8.735 7.153 636 HB THR 81 HB THR 81 112.162 9.318 8.393 637 HG1 THR 81 HG1 THR 81 111.765 9.293 10.457 638 HG21 THR 81 HG21 THR 81 111.174 11.581 8.603 639 HG22 THR 81 HG22 THR 81 110.781 10.848 7.029 640 HG23 THR 81 HG23 THR 81 109.555 10.898 8.318 641 H TRP 82 H TRP 82 111.390 8.548 5.638 642 HA TRP 82 HA TRP 82 112.777 5.875 5.801 643 HB2 TRP 82 HB2 TRP 82 112.220 7.754 3.462 644 HB3 TRP 82 HB3 TRP 82 113.158 6.247 3.334 645 HD1 TRP 82 HD1 TRP 82 109.621 7.488 4.246 646 HE1 TRP 82 HE1 TRP 82 107.927 5.588 3.832 647 HE3 TRP 82 HE3 TRP 82 112.877 3.748 3.029 648 HZ2 TRP 82 HZ2 TRP 82 107.997 2.808 3.070 649 HZ3 TRP 82 HZ3 TRP 82 112.039 1.486 2.462 650 HH2 TRP 82 HH2 TRP 82 109.604 1.012 2.480 651 H SER 83 H SER 83 115.012 5.801 5.967 652 HA SER 83 HA SER 83 116.492 8.383 5.464 653 HB2 SER 83 HB2 SER 83 116.429 6.745 8.012 654 HB3 SER 83 HB3 SER 83 117.866 7.707 7.589 655 HG SER 83 HG SER 83 116.332 8.905 8.851 656 H LEU 84 H LEU 84 118.828 8.019 5.079 657 HA LEU 84 HA LEU 84 119.211 5.274 3.941 658 HB2 LEU 84 HB2 LEU 84 120.073 6.579 2.289 659 HB3 LEU 84 HB3 LEU 84 120.220 7.990 3.363 660 HG LEU 84 HG LEU 84 122.259 6.899 4.383 661 HD11 LEU 84 HD11 LEU 84 122.774 5.186 2.069 662 HD12 LEU 84 HD12 LEU 84 121.317 4.664 2.948 663 HD13 LEU 84 HD13 LEU 84 122.872 4.799 3.804 664 HD21 LEU 84 HD21 LEU 84 123.734 7.444 2.465 665 HD22 LEU 84 HD22 LEU 84 122.438 8.650 2.640 666 HD23 LEU 84 HD23 LEU 84 122.329 7.404 1.374 667 H GLU 85 H GLU 85 120.450 3.794 4.979 668 HA GLU 85 HA GLU 85 122.321 4.811 7.126 669 HB2 GLU 85 HB2 GLU 85 120.167 2.710 7.255 670 HB3 GLU 85 HB3 GLU 85 121.664 2.441 8.178 671 HG2 GLU 85 HG2 GLU 85 120.182 5.084 8.324 672 HG3 GLU 85 HG3 GLU 85 119.720 3.710 9.357 673 H GLY 86 H GLY 86 124.361 4.239 6.580 674 HA2 GLY 86 HA3 GLY 86 126.123 2.950 5.672 675 HA3 GLY 86 HA2 GLY 86 125.076 1.525 5.887 676 H ASN 87 H ASN 87 124.222 0.592 4.071 677 HA ASN 87 HA ASN 87 124.344 2.238 1.533 678 HB2 ASN 87 HB2 ASN 87 124.902 -0.745 1.830 679 HB3 ASN 87 HB3 ASN 87 124.955 0.188 0.316 680 HD21 ASN 87 HD21 ASN 87 126.688 1.829 0.084 681 HD22 ASN 87 HD22 ASN 87 128.126 1.722 1.075 682 H LYS 88 H LYS 88 122.009 1.872 3.331 683 HA LYS 88 HA LYS 88 120.227 0.683 1.237 684 HB2 LYS 88 HB3 LYS 88 119.088 -0.795 2.796 685 HB3 LYS 88 HB2 LYS 88 120.828 -1.168 2.839 686 HG2 LYS 88 HG2 LYS 88 120.823 0.660 4.783 687 HG3 LYS 88 HG3 LYS 88 119.109 0.196 4.903 688 HD2 LYS 88 HD3 LYS 88 119.686 -2.123 5.283 689 HD3 LYS 88 HD2 LYS 88 121.398 -1.815 4.905 690 HE2 LYS 88 HE3 LYS 88 121.785 -0.708 6.926 691 HE3 LYS 88 HE2 LYS 88 120.077 -0.247 7.118 692 HZ1 LYS 88 HZ1 LYS 88 120.696 -2.016 8.625 693 HZ2 LYS 88 HZ2 LYS 88 121.152 -2.985 7.370 694 HZ3 LYS 88 HZ3 LYS 88 119.569 -2.557 7.549 695 H LEU 89 H LEU 89 118.068 1.434 1.353 696 HA LEU 89 HA LEU 89 117.788 3.948 2.957 697 HB2 LEU 89 HB2 LEU 89 116.600 2.813 0.480 698 HB3 LEU 89 HB3 LEU 89 115.449 3.684 1.521 699 HG LEU 89 HG LEU 89 118.149 4.899 0.901 700 HD11 LEU 89 HD11 LEU 89 117.158 4.268 -1.283 701 HD12 LEU 89 HD12 LEU 89 115.640 5.077 -0.827 702 HD13 LEU 89 HD13 LEU 89 117.124 6.033 -1.051 703 HD21 LEU 89 HD21 LEU 89 116.698 5.905 2.644 704 HD22 LEU 89 HD22 LEU 89 116.856 6.988 1.240 705 HD23 LEU 89 HD23 LEU 89 115.371 6.033 1.464 706 H ILE 90 H ILE 90 116.915 3.755 4.957 707 HA ILE 90 HA ILE 90 115.277 1.351 5.573 708 HB ILE 90 HB ILE 90 115.180 2.687 7.873 709 HG12 ILE 90 HG13 ILE 90 117.719 3.755 6.595 710 HG13 ILE 90 HG12 ILE 90 116.226 4.713 6.760 711 HG21 ILE 90 HG21 ILE 90 116.299 0.509 7.475 712 HG22 ILE 90 HG22 ILE 90 117.697 1.359 6.773 713 HG23 ILE 90 HG23 ILE 90 117.299 1.570 8.495 714 HD11 ILE 90 HD11 ILE 90 116.251 4.338 9.198 715 HD12 ILE 90 HD12 ILE 90 117.766 5.103 8.662 716 HD13 ILE 90 HD13 ILE 90 117.732 3.364 9.038 717 H GLY 91 H GLY 91 113.253 1.601 6.779 718 HA2 GLY 91 HA3 GLY 91 111.727 4.113 6.224 719 HA3 GLY 91 HA2 GLY 91 111.114 2.612 5.486 720 H LYS 92 H LYS 92 111.556 4.394 8.472 721 HA LYS 92 HA LYS 92 110.519 2.121 10.099 722 HB2 LYS 92 HB2 LYS 92 111.558 4.896 10.641 723 HB3 LYS 92 HB3 LYS 92 110.479 4.151 11.844 724 HG2 LYS 92 HG3 LYS 92 111.958 2.319 12.198 725 HG3 LYS 92 HG2 LYS 92 112.874 2.665 10.711 726 HD2 LYS 92 HD3 LYS 92 113.958 4.530 11.662 727 HD3 LYS 92 HD2 LYS 92 112.727 4.717 12.933 728 HE2 LYS 92 HE2 LYS 92 113.480 2.544 13.928 729 HE3 LYS 92 HE3 LYS 92 114.768 2.461 12.703 730 HZ1 LYS 92 HZ1 LYS 92 115.555 3.433 14.756 731 HZ2 LYS 92 HZ2 LYS 92 114.418 4.626 14.679 732 HZ3 LYS 92 HZ3 LYS 92 115.612 4.549 13.543 733 H PHE 93 H PHE 93 108.391 1.724 9.603 734 HA PHE 93 HA PHE 93 106.535 4.108 9.756 735 HB2 PHE 93 HB2 PHE 93 106.649 1.762 7.870 736 HB3 PHE 93 HB3 PHE 93 105.057 2.428 8.296 737 HD1 PHE 93 HD1 PHE 93 107.182 5.132 8.676 738 HD2 PHE 93 HD2 PHE 93 105.524 2.667 5.573 739 HE1 PHE 93 HE1 PHE 93 107.517 6.962 7.045 740 HE2 PHE 93 HE2 PHE 93 105.860 4.502 3.939 741 HZ PHE 93 HZ PHE 93 106.854 6.652 4.676 742 H LYS 94 H LYS 94 104.830 3.946 11.100 743 HA LYS 94 HA LYS 94 104.332 1.247 12.364 744 HB2 LYS 94 HB2 LYS 94 104.095 2.257 14.520 745 HB3 LYS 94 HB3 LYS 94 105.593 2.936 13.840 746 HG2 LYS 94 HG2 LYS 94 104.175 4.885 12.988 747 HG3 LYS 94 HG3 LYS 94 102.848 4.244 13.986 748 HD2 LYS 94 HD3 LYS 94 103.997 5.915 15.305 749 HD3 LYS 94 HD2 LYS 94 104.431 4.324 15.971 750 HE2 LYS 94 HE2 LYS 94 106.613 4.438 15.191 751 HE3 LYS 94 HE3 LYS 94 106.176 5.465 13.805 752 HZ1 LYS 94 HZ1 LYS 94 107.379 6.699 15.483 753 HZ2 LYS 94 HZ2 LYS 94 105.844 7.285 15.341 754 HZ3 LYS 94 HZ3 LYS 94 106.248 6.333 16.626 755 H ARG 95 H ARG 95 102.242 0.617 12.133 756 HA ARG 95 HA ARG 95 100.300 1.965 10.639 757 HB2 ARG 95 HB2 ARG 95 99.908 0.173 13.075 758 HB3 ARG 95 HB3 ARG 95 98.585 0.675 11.995 759 HG2 ARG 95 HG3 ARG 95 100.101 -0.237 10.076 760 HG3 ARG 95 HG2 ARG 95 100.983 -1.075 11.375 761 HD2 ARG 95 HD3 ARG 95 99.311 -2.619 10.610 762 HD3 ARG 95 HD2 ARG 95 98.711 -1.971 12.155 763 HE ARG 95 HE ARG 95 97.631 -0.250 10.206 764 HH11 ARG 95 HH11 ARG 95 95.596 -0.646 9.306 765 HH12 ARG 95 HH12 ARG 95 94.942 -2.269 9.301 766 HH21 ARG 95 HH21 ARG 95 97.707 -3.664 10.893 767 HH22 ARG 95 HH22 ARG 95 96.132 -3.969 10.196 768 H THR 96 H THR 96 99.528 4.002 10.885 769 HA THR 96 HA THR 96 99.735 5.426 13.419 770 HB THR 96 HB THR 96 97.738 6.625 11.744 771 HG1 THR 96 HG1 THR 96 98.359 5.464 9.993 772 HG21 THR 96 HG21 THR 96 99.514 8.318 11.439 773 HG22 THR 96 HG22 THR 96 100.715 7.174 12.084 774 HG23 THR 96 HG23 THR 96 99.418 7.789 13.136 775 H ASP 97 H ASP 97 97.742 3.038 12.397 776 HA ASP 97 HA ASP 97 95.279 3.974 13.773 777 HB2 ASP 97 HB2 ASP 97 95.781 1.132 12.865 778 HB3 ASP 97 HB3 ASP 97 94.254 2.046 12.901 779 H ASN 98 H ASN 98 97.746 1.402 14.202 780 HA ASN 98 HA ASN 98 97.058 1.455 17.143 781 HB2 ASN 98 HB2 ASN 98 96.163 -0.581 15.733 782 HB3 ASN 98 HB3 ASN 98 97.862 -1.111 15.757 783 HD21 ASN 98 HD21 ASN 98 95.649 0.425 18.209 784 HD22 ASN 98 HD22 ASN 98 96.006 -0.746 19.459 785 H GLY 99 H GLY 99 99.322 2.259 14.993 786 HA2 GLY 99 HA2 GLY 99 101.693 2.329 15.029 787 HA3 GLY 99 HA3 GLY 99 101.488 2.417 16.795 788 H ASN 100 H ASN 100 100.787 -0.236 14.463 789 HA ASN 100 HA ASN 100 101.941 -2.196 16.314 790 HB2 ASN 100 HB2 ASN 100 100.879 -2.286 13.485 791 HB3 ASN 100 HB3 ASN 100 101.751 -3.684 14.158 792 HD21 ASN 100 HD21 ASN 100 98.704 -2.956 13.568 793 HD22 ASN 100 HD22 ASN 100 97.916 -3.505 15.030 794 H GLU 101 H GLU 101 103.470 0.122 14.827 795 HA GLU 101 HA GLU 101 105.647 0.439 13.983 796 HB2 GLU 101 HB2 GLU 101 105.772 -1.643 16.097 797 HB3 GLU 101 HB3 GLU 101 107.191 -1.575 15.025 798 HG2 GLU 101 HG2 GLU 101 107.531 0.776 15.508 799 HG3 GLU 101 HG3 GLU 101 105.986 0.871 16.387 800 H LEU 102 H LEU 102 106.708 0.020 12.126 801 HA LEU 102 HA LEU 102 106.740 -2.800 11.073 802 HB2 LEU 102 HB2 LEU 102 104.825 -1.534 9.996 803 HB3 LEU 102 HB3 LEU 102 106.017 -0.371 9.368 804 HG LEU 102 HG LEU 102 106.391 -3.335 8.879 805 HD11 LEU 102 HD11 LEU 102 104.073 -2.804 8.172 806 HD12 LEU 102 HD12 LEU 102 105.122 -3.105 6.766 807 HD13 LEU 102 HD13 LEU 102 104.683 -1.438 7.208 808 HD21 LEU 102 HD21 LEU 102 107.132 -1.923 6.618 809 HD22 LEU 102 HD22 LEU 102 107.501 -0.758 7.912 810 HD23 LEU 102 HD23 LEU 102 108.239 -2.378 7.936 811 H ASN 103 H ASN 103 108.777 -3.295 10.301 812 HA ASN 103 HA ASN 103 110.647 -0.933 9.981 813 HB2 ASN 103 HB2 ASN 103 110.921 -3.591 11.294 814 HB3 ASN 103 HB3 ASN 103 112.312 -3.088 10.304 815 HD21 ASN 103 HD21 ASN 103 110.240 -0.635 11.808 816 HD22 ASN 103 HD22 ASN 103 111.401 -0.141 13.020 817 H THR 104 H THR 104 110.989 -0.544 7.842 818 HA THR 104 HA THR 104 111.270 -2.986 6.077 819 HB THR 104 HB THR 104 109.180 -1.933 5.508 820 HG1 THR 104 HG1 THR 104 109.918 -2.228 3.540 821 HG21 THR 104 HG21 THR 104 109.360 0.593 4.787 822 HG22 THR 104 HG22 THR 104 110.821 0.591 5.803 823 HG23 THR 104 HG23 THR 104 109.241 0.189 6.516 824 H VAL 105 H VAL 105 112.341 -2.317 3.923 825 HA VAL 105 HA VAL 105 114.413 -0.185 4.281 826 HB VAL 105 HB VAL 105 114.994 -3.145 3.856 827 HG11 VAL 105 HG11 VAL 105 117.420 -2.226 3.655 828 HG12 VAL 105 HG12 VAL 105 116.649 -0.671 3.260 829 HG13 VAL 105 HG13 VAL 105 116.365 -2.093 2.227 830 HG21 VAL 105 HG21 VAL 105 116.517 -2.773 5.779 831 HG22 VAL 105 HG22 VAL 105 116.023 -1.064 5.839 832 HG23 VAL 105 HG23 VAL 105 114.841 -2.345 6.199 833 H ARG 106 H ARG 106 115.589 0.173 2.152 834 HA ARG 106 HA ARG 106 113.989 -0.859 -0.186 835 HB2 ARG 106 HB2 ARG 106 113.658 1.715 0.870 836 HB3 ARG 106 HB3 ARG 106 114.781 1.958 -0.489 837 HG2 ARG 106 HG3 ARG 106 113.132 0.445 -1.833 838 HG3 ARG 106 HG2 ARG 106 111.980 0.799 -0.523 839 HD2 ARG 106 HD3 ARG 106 113.329 2.753 -2.422 840 HD3 ARG 106 HD2 ARG 106 111.588 2.488 -2.166 841 HE ARG 106 HE ARG 106 113.027 3.395 0.258 842 HH11 ARG 106 HH11 ARG 106 112.419 5.448 0.979 843 HH12 ARG 106 HH12 ARG 106 111.482 6.499 -0.061 844 HH21 ARG 106 HH21 ARG 106 111.352 4.213 -2.684 845 HH22 ARG 106 HH22 ARG 106 110.881 5.802 -2.125 846 H GLU 107 H GLU 107 115.249 -1.342 -1.941 847 HA GLU 107 HA GLU 107 118.037 -0.206 -2.012 848 HB2 GLU 107 HB2 GLU 107 117.357 -3.166 -2.312 849 HB3 GLU 107 HB3 GLU 107 118.969 -2.439 -2.513 850 HG2 GLU 107 HG3 GLU 107 118.972 -1.707 -0.174 851 HG3 GLU 107 HG2 GLU 107 117.308 -2.302 0.043 852 H ILE 108 H ILE 108 119.014 -0.407 -4.183 853 HA ILE 108 HA ILE 108 116.900 -0.767 -6.309 854 HB ILE 108 HB ILE 108 119.258 1.150 -6.439 855 HG12 ILE 108 HG13 ILE 108 116.610 1.398 -5.080 856 HG13 ILE 108 HG12 ILE 108 118.129 2.277 -4.783 857 HG21 ILE 108 HG21 ILE 108 118.034 0.281 -8.512 858 HG22 ILE 108 HG22 ILE 108 118.084 2.049 -8.318 859 HG23 ILE 108 HG23 ILE 108 116.603 1.151 -7.910 860 HD11 ILE 108 HD11 ILE 108 116.605 3.899 -5.671 861 HD12 ILE 108 HD12 ILE 108 117.697 3.481 -7.013 862 HD13 ILE 108 HD13 ILE 108 116.058 2.791 -6.952 863 H ILE 109 H ILE 109 117.668 -2.972 -6.445 864 HA ILE 109 HA ILE 109 120.461 -3.585 -6.936 865 HB ILE 109 HB ILE 109 117.845 -5.040 -7.408 866 HG12 ILE 109 HG12 ILE 109 120.325 -5.718 -5.765 867 HG13 ILE 109 HG13 ILE 109 118.909 -4.852 -5.122 868 HG21 ILE 109 HG21 ILE 109 119.861 -6.921 -7.829 869 HG22 ILE 109 HG22 ILE 109 118.832 -6.204 -9.092 870 HG23 ILE 109 HG23 ILE 109 120.432 -5.505 -8.745 871 HD11 ILE 109 HD11 ILE 109 118.767 -7.279 -4.631 872 HD12 ILE 109 HD12 ILE 109 118.877 -7.637 -6.370 873 HD13 ILE 109 HD13 ILE 109 117.460 -6.772 -5.728 874 H GLY 110 H GLY 110 121.232 -2.152 -8.498 875 HA2 GLY 110 HA2 GLY 110 121.571 -1.312 -10.683 876 HA3 GLY 110 HA3 GLY 110 121.293 -2.998 -11.173 877 H ASP 111 H ASP 111 119.034 -3.647 -11.638 878 HA ASP 111 HA ASP 111 117.399 -1.253 -12.506 879 HB2 ASP 111 HB3 ASP 111 117.534 -3.998 -13.825 880 HB3 ASP 111 HB2 ASP 111 116.624 -2.583 -14.407 881 H GLU 112 H GLU 112 117.260 -2.777 -9.932 882 HA GLU 112 HA GLU 112 114.342 -3.469 -10.185 883 HB2 GLU 112 HB2 GLU 112 116.571 -5.248 -9.200 884 HB3 GLU 112 HB3 GLU 112 114.965 -5.368 -8.441 885 HG2 GLU 112 HG2 GLU 112 113.969 -5.636 -10.742 886 HG3 GLU 112 HG3 GLU 112 115.622 -5.686 -11.402 887 H LEU 113 H LEU 113 113.151 -2.622 -8.498 888 HA LEU 113 HA LEU 113 114.741 -1.262 -6.328 889 HB2 LEU 113 HB2 LEU 113 112.751 -0.230 -7.810 890 HB3 LEU 113 HB3 LEU 113 111.753 -0.996 -6.552 891 HG LEU 113 HG LEU 113 114.130 0.624 -5.671 892 HD11 LEU 113 HD11 LEU 113 111.751 1.666 -7.146 893 HD12 LEU 113 HD12 LEU 113 113.374 2.372 -6.957 894 HD13 LEU 113 HD13 LEU 113 112.178 2.524 -5.646 895 HD21 LEU 113 HD21 LEU 113 112.706 -0.606 -4.052 896 HD22 LEU 113 HD22 LEU 113 112.575 1.153 -3.812 897 HD23 LEU 113 HD23 LEU 113 111.275 0.269 -4.647 898 H VAL 114 H VAL 114 115.085 -2.594 -4.596 899 HA VAL 114 HA VAL 114 112.949 -4.615 -3.987 900 HB VAL 114 HB VAL 114 115.559 -4.388 -2.485 901 HG11 VAL 114 HG11 VAL 114 113.837 -6.022 -1.767 902 HG12 VAL 114 HG12 VAL 114 113.815 -6.717 -3.406 903 HG13 VAL 114 HG13 VAL 114 115.279 -6.849 -2.402 904 HG21 VAL 114 HG21 VAL 114 116.391 -6.046 -4.326 905 HG22 VAL 114 HG22 VAL 114 115.113 -5.324 -5.332 906 HG23 VAL 114 HG23 VAL 114 116.418 -4.302 -4.683 907 H GLN 115 H GLN 115 111.437 -4.082 -2.543 908 HA GLN 115 HA GLN 115 112.255 -2.241 -0.281 909 HB2 GLN 115 HB3 GLN 115 110.571 -1.288 -1.947 910 HB3 GLN 115 HB2 GLN 115 109.451 -2.574 -1.435 911 HG2 GLN 115 HG2 GLN 115 109.297 -1.727 0.771 912 HG3 GLN 115 HG3 GLN 115 110.779 -0.756 0.598 913 HE21 GLN 115 HE21 GLN 115 107.387 -1.021 -0.633 914 HE22 GLN 115 HE22 GLN 115 107.233 0.684 -0.993 915 H THR 116 H THR 116 112.609 -3.662 1.391 916 HA THR 116 HA THR 116 110.638 -5.926 1.688 917 HB THR 116 HB THR 116 113.092 -5.719 3.402 918 HG1 THR 116 HG1 THR 116 113.990 -5.235 1.426 919 HG21 THR 116 HG21 THR 116 113.089 -8.171 2.998 920 HG22 THR 116 HG22 THR 116 111.713 -7.979 1.886 921 HG23 THR 116 HG23 THR 116 111.517 -7.610 3.616 922 H TYR 117 H TYR 117 109.530 -6.240 3.614 923 HA TYR 117 HA TYR 117 109.822 -4.012 5.637 924 HB2 TYR 117 HB2 TYR 117 107.163 -5.370 5.262 925 HB3 TYR 117 HB3 TYR 117 107.526 -3.731 5.849 926 HD1 TYR 117 HD1 TYR 117 108.054 -5.810 2.795 927 HD2 TYR 117 HD2 TYR 117 107.034 -1.974 4.407 928 HE1 TYR 117 HE1 TYR 117 107.680 -4.952 0.499 929 HE2 TYR 117 HE2 TYR 117 106.661 -1.101 2.115 930 HH TYR 117 HH TYR 117 106.492 -3.158 -0.646 931 H VAL 118 H VAL 118 109.460 -4.588 7.772 932 HA VAL 118 HA VAL 118 109.455 -7.572 8.286 933 HB VAL 118 HB VAL 118 110.655 -5.452 10.103 934 HG11 VAL 118 HG11 VAL 118 111.380 -7.219 11.404 935 HG12 VAL 118 HG12 VAL 118 111.521 -8.323 10.015 936 HG13 VAL 118 HG13 VAL 118 109.922 -7.972 10.714 937 HG21 VAL 118 HG21 VAL 118 112.441 -5.296 8.739 938 HG22 VAL 118 HG22 VAL 118 111.662 -6.392 7.573 939 HG23 VAL 118 HG23 VAL 118 112.683 -7.055 8.872 940 H TYR 119 H TYR 119 108.222 -8.272 10.031 941 HA TYR 119 HA TYR 119 106.606 -6.179 11.428 942 HB2 TYR 119 HB2 TYR 119 105.561 -7.297 9.184 943 HB3 TYR 119 HB3 TYR 119 105.027 -8.484 10.399 944 HD1 TYR 119 HD1 TYR 119 103.771 -7.688 12.416 945 HD2 TYR 119 HD2 TYR 119 104.566 -5.128 9.066 946 HE1 TYR 119 HE1 TYR 119 101.971 -6.154 13.165 947 HE2 TYR 119 HE2 TYR 119 102.775 -3.585 9.816 948 HH TYR 119 HH TYR 119 100.624 -3.793 11.239 949 H GLU 120 H GLU 120 107.002 -6.626 13.471 950 HA GLU 120 HA GLU 120 107.262 -7.827 15.473 951 HB2 GLU 120 HB2 GLU 120 105.085 -9.346 14.020 952 HB3 GLU 120 HB3 GLU 120 105.648 -9.865 15.627 953 HG2 GLU 120 HG2 GLU 120 104.928 -6.968 15.144 954 HG3 GLU 120 HG3 GLU 120 103.643 -8.163 15.445 955 H GLY 121 H GLY 121 108.772 -8.721 12.895 956 HA2 GLY 121 HA2 GLY 121 110.788 -10.165 13.252 957 HA3 GLY 121 HA3 GLY 121 109.747 -11.297 14.150 958 H VAL 122 H VAL 122 108.613 -9.690 11.256 959 HA VAL 122 HA VAL 122 108.928 -12.308 9.787 960 HB VAL 122 HB VAL 122 106.525 -11.322 10.521 961 HG11 VAL 122 HG11 VAL 122 106.803 -10.201 7.725 962 HG12 VAL 122 HG12 VAL 122 107.183 -9.195 9.143 963 HG13 VAL 122 HG13 VAL 122 105.550 -9.874 8.946 964 HG21 VAL 122 HG21 VAL 122 105.587 -12.562 8.593 965 HG22 VAL 122 HG22 VAL 122 107.184 -12.540 7.807 966 HG23 VAL 122 HG23 VAL 122 106.952 -13.439 9.326 967 H GLU 123 H GLU 123 108.616 -11.738 7.297 968 HA GLU 123 HA GLU 123 109.722 -9.052 6.698 969 HB2 GLU 123 HB3 GLU 123 111.446 -11.390 7.001 970 HB3 GLU 123 HB2 GLU 123 111.547 -10.723 5.354 971 HG2 GLU 123 HG2 GLU 123 112.052 -8.500 6.233 972 HG3 GLU 123 HG3 GLU 123 111.807 -9.067 7.902 973 H ALA 124 H ALA 124 108.610 -8.423 4.957 974 HA ALA 124 HA ALA 124 107.934 -10.520 2.880 975 HB1 ALA 124 HB1 ALA 124 106.465 -8.174 2.331 976 HB2 ALA 124 HB2 ALA 124 106.405 -8.344 4.101 977 HB3 ALA 124 HB3 ALA 124 105.839 -9.672 3.060 978 H LYS 125 H LYS 125 108.344 -9.921 0.621 979 HA LYS 125 HA LYS 125 110.120 -7.486 0.388 980 HB2 LYS 125 HB2 LYS 125 111.288 -9.839 0.493 981 HB3 LYS 125 HB3 LYS 125 110.710 -9.997 -1.183 982 HG2 LYS 125 HG2 LYS 125 111.982 -8.142 -1.924 983 HG3 LYS 125 HG3 LYS 125 112.185 -7.505 -0.275 984 HD2 LYS 125 HD2 LYS 125 114.292 -8.472 -0.758 985 HD3 LYS 125 HD3 LYS 125 113.467 -9.730 0.193 986 HE2 LYS 125 HE2 LYS 125 112.628 -10.543 -2.190 987 HE3 LYS 125 HE3 LYS 125 114.050 -9.640 -2.767 988 HZ1 LYS 125 HZ1 LYS 125 115.455 -10.981 -1.513 989 HZ2 LYS 125 HZ2 LYS 125 114.242 -11.588 -0.575 990 HZ3 LYS 125 HZ3 LYS 125 114.376 -12.053 -2.151 991 H ARG 126 H ARG 126 109.870 -6.276 -1.410 992 HA ARG 126 HA ARG 126 108.132 -7.376 -3.624 993 HB2 ARG 126 HB2 ARG 126 107.925 -4.598 -2.372 994 HB3 ARG 126 HB3 ARG 126 106.991 -5.183 -3.771 995 HG2 ARG 126 HG3 ARG 126 105.927 -6.904 -2.400 996 HG3 ARG 126 HG2 ARG 126 106.949 -6.474 -1.007 997 HD2 ARG 126 HD2 ARG 126 105.066 -5.236 -0.475 998 HD3 ARG 126 HD3 ARG 126 105.910 -4.042 -1.490 999 HE ARG 126 HE ARG 126 104.409 -5.398 -3.366 1000 HH11 ARG 126 HH11 ARG 126 102.249 -4.928 -3.836 1001 HH12 ARG 126 HH12 ARG 126 101.231 -4.186 -2.622 1002 HH21 ARG 126 HH21 ARG 126 103.747 -4.062 -0.219 1003 HH22 ARG 126 HH22 ARG 126 102.076 -3.698 -0.584 1004 H ILE 127 H ILE 127 109.418 -7.350 -5.422 1005 HA ILE 127 HA ILE 127 111.544 -5.209 -5.552 1006 HB ILE 127 HB ILE 127 111.285 -7.735 -7.234 1007 HG12 ILE 127 HG12 ILE 127 113.428 -7.778 -5.274 1008 HG13 ILE 127 HG13 ILE 127 111.870 -7.515 -4.455 1009 HG21 ILE 127 HG21 ILE 127 113.687 -7.305 -7.669 1010 HG22 ILE 127 HG22 ILE 127 112.684 -5.929 -8.187 1011 HG23 ILE 127 HG23 ILE 127 113.604 -5.836 -6.667 1012 HD11 ILE 127 HD11 ILE 127 112.353 -9.935 -4.693 1013 HD12 ILE 127 HD12 ILE 127 112.477 -9.737 -6.458 1014 HD13 ILE 127 HD13 ILE 127 110.918 -9.474 -5.640 1015 H PHE 128 H PHE 128 111.389 -3.602 -7.040 1016 HA PHE 128 HA PHE 128 109.138 -3.806 -9.032 1017 HB2 PHE 128 HB2 PHE 128 110.871 -1.375 -8.430 1018 HB3 PHE 128 HB3 PHE 128 109.328 -1.410 -9.308 1019 HD1 PHE 128 HD1 PHE 128 108.439 -3.650 -7.044 1020 HD2 PHE 128 HD2 PHE 128 109.709 0.447 -7.062 1021 HE1 PHE 128 HE1 PHE 128 107.197 -3.258 -4.937 1022 HE2 PHE 128 HE2 PHE 128 108.474 0.840 -4.947 1023 HZ PHE 128 HZ PHE 128 107.212 -1.013 -3.886 1024 H LYS 129 H LYS 129 109.721 -2.495 -11.136 1025 HA LYS 129 HA LYS 129 112.517 -2.935 -12.067 1026 HB2 LYS 129 HB2 LYS 129 111.466 -5.136 -12.476 1027 HB3 LYS 129 HB3 LYS 129 110.134 -4.345 -13.352 1028 HG2 LYS 129 HG3 LYS 129 111.857 -5.250 -14.908 1029 HG3 LYS 129 HG2 LYS 129 111.728 -3.479 -15.025 1030 HD2 LYS 129 HD2 LYS 129 113.774 -3.123 -13.972 1031 HD3 LYS 129 HD3 LYS 129 113.702 -4.661 -13.080 1032 HE2 LYS 129 HE3 LYS 129 114.171 -4.354 -16.080 1033 HE3 LYS 129 HE2 LYS 129 115.407 -4.767 -14.868 1034 HZ1 LYS 129 HZ1 LYS 129 114.773 -6.822 -15.536 1035 HZ2 LYS 129 HZ2 LYS 129 113.224 -6.389 -15.898 1036 HZ3 LYS 129 HZ3 LYS 129 113.670 -6.621 -14.327 1037 H LYS 130 H LYS 130 113.000 -1.584 -13.826 1038 HA LYS 130 HA LYS 130 111.583 0.828 -14.127 1039 HB2 LYS 130 HB2 LYS 130 112.801 1.145 -16.229 1040 HB3 LYS 130 HB3 LYS 130 113.870 0.358 -15.044 1041 HG2 LYS 130 HG2 LYS 130 114.248 -1.162 -16.702 1042 HG3 LYS 130 HG3 LYS 130 112.658 -1.817 -16.245 1043 HD2 LYS 130 HD2 LYS 130 111.561 -0.412 -17.939 1044 HD3 LYS 130 HD3 LYS 130 113.120 0.335 -18.360 1045 HE2 LYS 130 HE2 LYS 130 112.598 -2.660 -18.544 1046 HE3 LYS 130 HE3 LYS 130 112.371 -1.544 -19.911 1047 HZ1 LYS 130 HZ1 LYS 130 114.567 -2.526 -19.919 1048 HZ2 LYS 130 HZ2 LYS 130 114.676 -0.898 -19.681 1049 HZ3 LYS 130 HZ3 LYS 130 114.886 -1.932 -18.414 1050 H ASP 131 H ASP 131 109.761 1.483 -15.184 1051 HA ASP 131 HA ASP 131 108.693 0.024 -17.493 1052 HB2 ASP 131 HB2 ASP 131 108.065 -1.490 -15.552 1053 HB3 ASP 131 HB3 ASP 131 107.081 -0.152 -14.911 Start of MODEL 18 1 H1 ALA 1 H1 ALA 1 118.396 7.815 -9.014 2 H2 ALA 1 H2 ALA 1 117.362 8.634 -8.024 3 H3 ALA 1 H3 ALA 1 118.924 8.379 -7.557 4 HA ALA 1 HA ALA 1 118.399 5.905 -7.743 5 HB1 ALA 1 HB1 ALA 1 118.177 5.904 -5.459 6 HB2 ALA 1 HB2 ALA 1 116.844 7.083 -5.486 7 HB3 ALA 1 HB3 ALA 1 118.528 7.640 -5.640 8 H PHE 2 H PHE 2 116.898 4.771 -8.868 9 HA PHE 2 HA PHE 2 114.781 4.277 -9.844 10 HB2 PHE 2 HB2 PHE 2 114.755 3.993 -7.043 11 HB3 PHE 2 HB3 PHE 2 113.246 4.860 -7.415 12 HD1 PHE 2 HD1 PHE 2 115.244 2.169 -9.159 13 HD2 PHE 2 HD2 PHE 2 111.446 3.414 -7.581 14 HE1 PHE 2 HE1 PHE 2 114.214 0.059 -9.962 15 HE2 PHE 2 HE2 PHE 2 110.422 1.305 -8.385 16 HZ PHE 2 HZ PHE 2 111.807 -0.370 -9.578 17 H ASP 3 H ASP 3 115.618 7.101 -10.010 18 HA ASP 3 HA ASP 3 113.231 8.736 -9.457 19 HB2 ASP 3 HB2 ASP 3 115.664 9.554 -9.619 20 HB3 ASP 3 HB3 ASP 3 115.491 9.400 -11.383 21 H SER 4 H SER 4 111.548 7.541 -10.556 22 HA SER 4 HA SER 4 110.823 8.490 -13.106 23 HB2 SER 4 HB2 SER 4 111.392 5.985 -14.178 24 HB3 SER 4 HB3 SER 4 112.298 7.480 -14.510 25 HG SER 4 HG SER 4 113.354 5.401 -13.514 26 H THR 5 H THR 5 109.653 6.126 -14.258 27 HA THR 5 HA THR 5 107.584 5.636 -12.143 28 HB THR 5 HB THR 5 107.611 4.935 -15.114 29 HG1 THR 5 HG1 THR 5 106.158 6.739 -15.195 30 HG21 THR 5 HG21 THR 5 105.182 4.567 -14.776 31 HG22 THR 5 HG22 THR 5 106.143 3.469 -13.756 32 HG23 THR 5 HG23 THR 5 105.373 4.905 -13.039 33 H TRP 6 H TRP 6 107.031 3.549 -11.438 34 HA TRP 6 HA TRP 6 108.549 1.231 -12.552 35 HB2 TRP 6 HB3 TRP 6 108.724 1.903 -9.590 36 HB3 TRP 6 HB2 TRP 6 109.605 0.636 -10.475 37 HD1 TRP 6 HD1 TRP 6 109.378 4.484 -10.236 38 HE1 TRP 6 HE1 TRP 6 111.642 5.502 -10.940 39 HE3 TRP 6 HE3 TRP 6 111.754 0.225 -11.723 40 HZ2 TRP 6 HZ2 TRP 6 114.148 4.564 -12.026 41 HZ3 TRP 6 HZ3 TRP 6 114.071 0.307 -12.585 42 HH2 TRP 6 HH2 TRP 6 115.274 2.470 -12.739 43 H LYS 7 H LYS 7 107.800 -0.842 -11.412 44 HA LYS 7 HA LYS 7 105.226 -0.577 -9.945 45 HB2 LYS 7 HB2 LYS 7 103.810 -1.519 -11.546 46 HB3 LYS 7 HB3 LYS 7 104.860 -0.508 -12.566 47 HG2 LYS 7 HG2 LYS 7 106.355 -2.583 -12.829 48 HG3 LYS 7 HG3 LYS 7 105.019 -3.511 -12.107 49 HD2 LYS 7 HD2 LYS 7 104.663 -1.686 -14.516 50 HD3 LYS 7 HD3 LYS 7 105.031 -3.422 -14.658 51 HE2 LYS 7 HE2 LYS 7 102.997 -3.825 -13.136 52 HE3 LYS 7 HE3 LYS 7 102.577 -2.118 -13.419 53 HZ1 LYS 7 HZ1 LYS 7 101.502 -3.573 -15.002 54 HZ2 LYS 7 HZ2 LYS 7 102.955 -4.162 -15.515 55 HZ3 LYS 7 HZ3 LYS 7 102.567 -2.580 -15.778 56 H VAL 8 H VAL 8 105.009 -2.272 -8.538 57 HA VAL 8 HA VAL 8 107.067 -4.045 -7.935 58 HB VAL 8 HB VAL 8 105.333 -4.126 -6.390 59 HG11 VAL 8 HG11 VAL 8 103.466 -4.405 -8.782 60 HG12 VAL 8 HG12 VAL 8 102.928 -4.494 -7.088 61 HG13 VAL 8 HG13 VAL 8 103.647 -2.992 -7.715 62 HG21 VAL 8 HG21 VAL 8 104.582 -6.373 -6.267 63 HG22 VAL 8 HG22 VAL 8 106.073 -6.472 -7.234 64 HG23 VAL 8 HG23 VAL 8 104.485 -6.529 -8.037 65 H ASP 9 H ASP 9 108.182 -5.181 -9.427 66 HA ASP 9 HA ASP 9 106.636 -6.690 -11.519 67 HB2 ASP 9 HB2 ASP 9 108.718 -5.212 -12.025 68 HB3 ASP 9 HB3 ASP 9 109.660 -6.522 -11.273 69 H ARG 10 H ARG 10 108.605 -7.052 -8.630 70 HA ARG 10 HA ARG 10 107.936 -9.981 -8.688 71 HB2 ARG 10 HB3 ARG 10 110.715 -8.783 -8.480 72 HB3 ARG 10 HB2 ARG 10 110.340 -10.385 -7.801 73 HG2 ARG 10 HG3 ARG 10 109.747 -9.592 -10.682 74 HG3 ARG 10 HG2 ARG 10 111.232 -10.431 -10.176 75 HD2 ARG 10 HD2 ARG 10 109.419 -12.044 -8.987 76 HD3 ARG 10 HD3 ARG 10 108.416 -11.447 -10.330 77 HE ARG 10 HE ARG 10 111.089 -12.342 -11.202 78 HH11 ARG 10 HH11 ARG 10 111.085 -14.211 -12.475 79 HH12 ARG 10 HH12 ARG 10 109.657 -15.220 -12.542 80 HH21 ARG 10 HH21 ARG 10 107.820 -13.209 -10.374 81 HH22 ARG 10 HH22 ARG 10 107.817 -14.656 -11.358 82 H SER 11 H SER 11 108.499 -10.989 -6.477 83 HA SER 11 HA SER 11 108.812 -9.234 -4.171 84 HB2 SER 11 HB3 SER 11 106.570 -8.465 -4.671 85 HB3 SER 11 HB2 SER 11 105.994 -10.134 -4.904 86 HG SER 11 HG SER 11 105.523 -9.985 -2.836 87 H GLU 12 H GLU 12 107.973 -10.572 -2.099 88 HA GLU 12 HA GLU 12 108.061 -13.507 -2.584 89 HB2 GLU 12 HB2 GLU 12 110.155 -13.956 -1.754 90 HB3 GLU 12 HB3 GLU 12 110.493 -12.319 -2.363 91 HG2 GLU 12 HG2 GLU 12 109.729 -11.495 -0.025 92 HG3 GLU 12 HG3 GLU 12 109.896 -13.192 0.486 93 H ASN 13 H ASN 13 107.514 -14.729 -0.665 94 HA ASN 13 HA ASN 13 106.236 -15.032 1.297 95 HB2 ASN 13 HB2 ASN 13 107.948 -12.623 1.922 96 HB3 ASN 13 HB3 ASN 13 106.689 -13.126 3.075 97 HD21 ASN 13 HD21 ASN 13 108.428 -13.761 4.613 98 HD22 ASN 13 HD22 ASN 13 109.299 -15.257 4.359 99 H TYR 14 H TYR 14 105.906 -11.800 2.297 100 HA TYR 14 HA TYR 14 104.138 -10.240 2.068 101 HB2 TYR 14 HB2 TYR 14 104.333 -11.254 -0.470 102 HB3 TYR 14 HB3 TYR 14 102.678 -11.747 -0.042 103 HD1 TYR 14 HD1 TYR 14 104.543 -8.726 1.147 104 HD2 TYR 14 HD2 TYR 14 101.362 -10.241 -1.311 105 HE1 TYR 14 HE1 TYR 14 103.749 -6.411 0.747 106 HE2 TYR 14 HE2 TYR 14 100.569 -7.926 -1.712 107 HH TYR 14 HH TYR 14 101.629 -5.256 0.103 108 H ASP 15 H ASP 15 102.951 -13.592 1.429 109 HA ASP 15 HA ASP 15 100.453 -13.213 2.785 110 HB2 ASP 15 HB2 ASP 15 102.203 -15.651 2.320 111 HB3 ASP 15 HB3 ASP 15 100.669 -15.766 3.215 112 H LYS 16 H LYS 16 103.445 -14.758 4.059 113 HA LYS 16 HA LYS 16 102.603 -14.909 6.767 114 HB2 LYS 16 HB3 LYS 16 105.402 -14.252 5.740 115 HB3 LYS 16 HB2 LYS 16 105.003 -14.896 7.351 116 HG2 LYS 16 HG2 LYS 16 104.322 -16.296 4.728 117 HG3 LYS 16 HG3 LYS 16 105.759 -16.662 5.713 118 HD2 LYS 16 HD2 LYS 16 103.997 -16.912 7.668 119 HD3 LYS 16 HD3 LYS 16 102.841 -17.144 6.334 120 HE2 LYS 16 HE2 LYS 16 105.107 -18.887 7.232 121 HE3 LYS 16 HE3 LYS 16 103.517 -19.337 6.571 122 HZ1 LYS 16 HZ1 LYS 16 105.055 -19.819 4.909 123 HZ2 LYS 16 HZ2 LYS 16 105.892 -18.412 5.107 124 HZ3 LYS 16 HZ3 LYS 16 104.391 -18.389 4.425 125 H PHE 17 H PHE 17 103.896 -12.152 4.923 126 HA PHE 17 HA PHE 17 104.167 -10.404 7.239 127 HB2 PHE 17 HB3 PHE 17 105.303 -9.838 5.187 128 HB3 PHE 17 HB2 PHE 17 103.784 -9.900 4.263 129 HD1 PHE 17 HD1 PHE 17 105.845 -7.968 6.573 130 HD2 PHE 17 HD2 PHE 17 102.087 -8.113 4.516 131 HE1 PHE 17 HE1 PHE 17 105.497 -5.564 7.055 132 HE2 PHE 17 HE2 PHE 17 101.726 -5.706 5.000 133 HZ PHE 17 HZ PHE 17 103.435 -4.429 6.270 134 H MET 18 H MET 18 101.739 -10.417 4.608 135 HA MET 18 HA MET 18 99.874 -8.655 5.788 136 HB2 MET 18 HB2 MET 18 99.570 -11.065 3.982 137 HB3 MET 18 HB3 MET 18 98.130 -10.201 4.570 138 HG2 MET 18 HG2 MET 18 100.477 -8.874 3.143 139 HG3 MET 18 HG3 MET 18 98.958 -9.354 2.350 140 HE1 MET 18 HE1 MET 18 100.700 -6.839 2.778 141 HE2 MET 18 HE2 MET 18 99.290 -6.113 1.970 142 HE3 MET 18 HE3 MET 18 99.870 -5.447 3.516 143 H GLU 19 H GLU 19 100.451 -12.100 6.523 144 HA GLU 19 HA GLU 19 98.062 -12.391 8.178 145 HB2 GLU 19 HB2 GLU 19 100.712 -13.891 8.099 146 HB3 GLU 19 HB3 GLU 19 99.359 -14.356 9.157 147 HG2 GLU 19 HG2 GLU 19 98.027 -14.130 6.803 148 HG3 GLU 19 HG3 GLU 19 99.634 -14.582 6.186 149 H LYS 20 H LYS 20 101.418 -11.388 8.798 150 HA LYS 20 HA LYS 20 101.209 -11.363 11.680 151 HB2 LYS 20 HB2 LYS 20 103.178 -10.758 9.772 152 HB3 LYS 20 HB3 LYS 20 102.888 -9.211 10.603 153 HG2 LYS 20 HG3 LYS 20 104.535 -10.251 11.946 154 HG3 LYS 20 HG2 LYS 20 103.017 -10.623 12.798 155 HD2 LYS 20 HD2 LYS 20 102.934 -12.817 11.550 156 HD3 LYS 20 HD3 LYS 20 104.546 -12.448 10.891 157 HE2 LYS 20 HE3 LYS 20 105.448 -12.290 13.199 158 HE3 LYS 20 HE2 LYS 20 103.837 -12.673 13.852 159 HZ1 LYS 20 HZ1 LYS 20 105.224 -14.631 13.702 160 HZ2 LYS 20 HZ2 LYS 20 103.934 -14.772 12.684 161 HZ3 LYS 20 HZ3 LYS 20 105.427 -14.418 12.079 162 H MET 21 H MET 21 100.536 -8.841 9.218 163 HA MET 21 HA MET 21 99.835 -6.834 11.227 164 HB2 MET 21 HB3 MET 21 98.642 -6.802 8.458 165 HB3 MET 21 HB2 MET 21 99.296 -5.458 9.424 166 HG2 MET 21 HG2 MET 21 101.552 -6.927 9.157 167 HG3 MET 21 HG3 MET 21 100.718 -7.421 7.664 168 HE1 MET 21 HE1 MET 21 99.983 -4.273 5.773 169 HE2 MET 21 HE2 MET 21 99.398 -5.859 6.330 170 HE3 MET 21 HE3 MET 21 98.977 -4.387 7.237 171 H GLY 22 H GLY 22 98.370 -9.722 10.416 172 HA2 GLY 22 HA2 GLY 22 96.265 -10.571 11.099 173 HA3 GLY 22 HA3 GLY 22 95.938 -9.010 11.889 174 H VAL 23 H VAL 23 96.797 -9.339 8.458 175 HA VAL 23 HA VAL 23 94.379 -7.845 7.707 176 HB VAL 23 HB VAL 23 96.301 -9.384 5.907 177 HG11 VAL 23 HG11 VAL 23 95.553 -7.729 4.216 178 HG12 VAL 23 HG12 VAL 23 94.178 -8.668 4.846 179 HG13 VAL 23 HG13 VAL 23 94.454 -7.004 5.414 180 HG21 VAL 23 HG21 VAL 23 96.712 -7.031 7.575 181 HG22 VAL 23 HG22 VAL 23 96.851 -6.603 5.853 182 HG23 VAL 23 HG23 VAL 23 97.877 -7.887 6.536 183 H ASN 24 H ASN 24 92.459 -8.632 6.878 184 HA ASN 24 HA ASN 24 91.515 -11.196 7.515 185 HB2 ASN 24 HB2 ASN 24 90.788 -9.557 5.045 186 HB3 ASN 24 HB3 ASN 24 89.811 -10.873 5.738 187 HD21 ASN 24 HD21 ASN 24 88.388 -8.615 5.691 188 HD22 ASN 24 HD22 ASN 24 88.374 -7.798 7.237 189 H ILE 25 H ILE 25 90.857 -12.942 5.799 190 HA ILE 25 HA ILE 25 93.401 -13.807 4.533 191 HB ILE 25 HB ILE 25 90.711 -15.044 5.086 192 HG12 ILE 25 HG12 ILE 25 92.878 -15.077 6.561 193 HG13 ILE 25 HG13 ILE 25 91.983 -16.595 6.323 194 HG21 ILE 25 HG21 ILE 25 91.493 -17.055 3.741 195 HG22 ILE 25 HG22 ILE 25 92.733 -16.001 3.020 196 HG23 ILE 25 HG23 ILE 25 91.007 -15.647 2.766 197 HD11 ILE 25 HD11 ILE 25 94.585 -16.593 5.988 198 HD12 ILE 25 HD12 ILE 25 93.568 -17.437 4.796 199 HD13 ILE 25 HD13 ILE 25 94.214 -15.820 4.428 200 H VAL 26 H VAL 26 90.945 -11.818 3.680 201 HA VAL 26 HA VAL 26 90.641 -12.683 0.863 202 HB VAL 26 HB VAL 26 89.913 -9.967 2.017 203 HG11 VAL 26 HG11 VAL 26 89.723 -10.291 -0.435 204 HG12 VAL 26 HG12 VAL 26 88.117 -10.125 0.314 205 HG13 VAL 26 HG13 VAL 26 88.713 -11.732 -0.166 206 HG21 VAL 26 HG21 VAL 26 87.610 -11.222 2.326 207 HG22 VAL 26 HG22 VAL 26 88.632 -12.677 2.415 208 HG23 VAL 26 HG23 VAL 26 88.859 -11.357 3.587 209 H LYS 27 H LYS 27 91.950 -9.715 2.425 210 HA LYS 27 HA LYS 27 93.349 -8.878 0.019 211 HB2 LYS 27 HB2 LYS 27 93.449 -8.148 2.945 212 HB3 LYS 27 HB3 LYS 27 94.764 -7.597 1.880 213 HG2 LYS 27 HG3 LYS 27 92.974 -5.900 1.982 214 HG3 LYS 27 HG2 LYS 27 93.078 -6.592 0.346 215 HD2 LYS 27 HD2 LYS 27 91.192 -8.082 0.812 216 HD3 LYS 27 HD3 LYS 27 91.130 -7.523 2.500 217 HE2 LYS 27 HE2 LYS 27 90.616 -5.849 0.003 218 HE3 LYS 27 HE3 LYS 27 89.414 -6.349 1.216 219 HZ1 LYS 27 HZ1 LYS 27 89.962 -4.287 1.959 220 HZ2 LYS 27 HZ2 LYS 27 91.522 -4.349 1.428 221 HZ3 LYS 27 HZ3 LYS 27 91.084 -5.161 2.795 222 H ARG 28 H ARG 28 93.980 -11.241 2.472 223 HA ARG 28 HA ARG 28 96.897 -11.313 2.096 224 HB2 ARG 28 HB2 ARG 28 95.465 -12.195 4.102 225 HB3 ARG 28 HB3 ARG 28 95.207 -13.632 3.084 226 HG2 ARG 28 HG3 ARG 28 98.017 -12.599 3.424 227 HG3 ARG 28 HG2 ARG 28 97.273 -13.495 4.769 228 HD2 ARG 28 HD2 ARG 28 97.602 -14.466 1.896 229 HD3 ARG 28 HD3 ARG 28 98.470 -15.068 3.328 230 HE ARG 28 HE ARG 28 95.529 -15.269 3.562 231 HH11 ARG 28 HH11 ARG 28 94.743 -17.389 3.606 232 HH12 ARG 28 HH12 ARG 28 95.782 -18.716 3.136 233 HH21 ARG 28 HH21 ARG 28 98.515 -16.672 2.449 234 HH22 ARG 28 HH22 ARG 28 97.907 -18.312 2.484 235 H LYS 29 H LYS 29 94.110 -13.242 0.899 236 HA LYS 29 HA LYS 29 95.804 -15.004 -0.706 237 HB2 LYS 29 HB3 LYS 29 93.373 -15.401 0.081 238 HB3 LYS 29 HB2 LYS 29 92.890 -14.353 -1.274 239 HG2 LYS 29 HG2 LYS 29 94.099 -15.838 -2.852 240 HG3 LYS 29 HG3 LYS 29 94.573 -16.890 -1.496 241 HD2 LYS 29 HD2 LYS 29 92.327 -17.566 -1.090 242 HD3 LYS 29 HD3 LYS 29 91.662 -16.228 -2.058 243 HE2 LYS 29 HE3 LYS 29 91.487 -18.245 -3.389 244 HE3 LYS 29 HE2 LYS 29 92.794 -17.257 -4.086 245 HZ1 LYS 29 HZ1 LYS 29 93.453 -19.556 -3.836 246 HZ2 LYS 29 HZ2 LYS 29 93.161 -19.510 -2.214 247 HZ3 LYS 29 HZ3 LYS 29 94.371 -18.594 -2.859 248 H LEU 30 H LEU 30 94.092 -11.944 -1.308 249 HA LEU 30 HA LEU 30 94.871 -12.023 -4.181 250 HB2 LEU 30 HB2 LEU 30 93.465 -9.900 -2.507 251 HB3 LEU 30 HB3 LEU 30 93.765 -9.772 -4.257 252 HG LEU 30 HG LEU 30 92.389 -12.224 -3.145 253 HD11 LEU 30 HD11 LEU 30 91.165 -10.281 -2.212 254 HD12 LEU 30 HD12 LEU 30 91.054 -9.570 -3.839 255 HD13 LEU 30 HD13 LEU 30 90.209 -11.094 -3.474 256 HD21 LEU 30 HD21 LEU 30 93.131 -12.163 -5.512 257 HD22 LEU 30 HD22 LEU 30 91.355 -12.191 -5.399 258 HD23 LEU 30 HD23 LEU 30 92.199 -10.668 -5.765 259 H ALA 31 H ALA 31 96.202 -11.081 -1.242 260 HA ALA 31 HA ALA 31 97.707 -8.742 -1.992 261 HB1 ALA 31 HB1 ALA 31 99.371 -10.026 -0.222 262 HB2 ALA 31 HB2 ALA 31 97.969 -9.040 0.258 263 HB3 ALA 31 HB3 ALA 31 97.814 -10.810 0.140 264 H ALA 32 H ALA 32 98.691 -12.212 -1.999 265 HA ALA 32 HA ALA 32 101.283 -11.998 -2.999 266 HB1 ALA 32 HB1 ALA 32 100.901 -14.144 -4.181 267 HB2 ALA 32 HB2 ALA 32 100.151 -14.160 -2.567 268 HB3 ALA 32 HB3 ALA 32 99.143 -13.922 -4.015 269 H HIS 33 H HIS 33 98.263 -11.394 -4.753 270 HA HIS 33 HA HIS 33 99.587 -11.177 -7.369 271 HB2 HIS 33 HB2 HIS 33 96.897 -10.124 -6.384 272 HB3 HIS 33 HB3 HIS 33 97.424 -10.163 -8.084 273 HD2 HIS 33 HD2 HIS 33 98.611 -13.218 -8.242 274 HE1 HIS 33 HE1 HIS 33 94.862 -14.419 -6.713 275 HE2 HIS 33 HE2 HIS 33 96.963 -15.234 -7.915 276 H ASP 34 H ASP 34 101.023 -9.688 -5.443 277 HA ASP 34 HA ASP 34 100.293 -6.890 -5.392 278 HB2 ASP 34 HB2 ASP 34 102.798 -6.570 -4.965 279 HB3 ASP 34 HB3 ASP 34 101.959 -7.670 -3.845 280 H ASN 35 H ASN 35 99.981 -5.693 -7.197 281 HA ASN 35 HA ASN 35 102.168 -5.673 -9.243 282 HB2 ASN 35 HB3 ASN 35 99.299 -5.848 -10.192 283 HB3 ASN 35 HB2 ASN 35 100.800 -6.198 -11.083 284 HD21 ASN 35 HD21 ASN 35 102.150 -8.099 -9.945 285 HD22 ASN 35 HD22 ASN 35 101.188 -9.477 -9.459 286 H LEU 36 H LEU 36 101.542 -3.732 -7.278 287 HA LEU 36 HA LEU 36 99.774 -1.721 -8.545 288 HB2 LEU 36 HB2 LEU 36 100.126 -0.401 -6.601 289 HB3 LEU 36 HB3 LEU 36 100.094 -2.079 -6.015 290 HG LEU 36 HG LEU 36 102.777 -1.030 -6.816 291 HD11 LEU 36 HD11 LEU 36 101.792 0.940 -5.672 292 HD12 LEU 36 HD12 LEU 36 101.337 -0.090 -4.293 293 HD13 LEU 36 HD13 LEU 36 103.055 0.183 -4.670 294 HD21 LEU 36 HD21 LEU 36 102.151 -2.262 -4.156 295 HD22 LEU 36 HD22 LEU 36 101.900 -3.280 -5.594 296 HD23 LEU 36 HD23 LEU 36 103.504 -2.581 -5.268 297 H LYS 37 H LYS 37 100.495 0.444 -9.087 298 HA LYS 37 HA LYS 37 103.306 0.436 -10.212 299 HB2 LYS 37 HB2 LYS 37 100.805 0.875 -11.472 300 HB3 LYS 37 HB3 LYS 37 101.533 2.489 -11.299 301 HG2 LYS 37 HG2 LYS 37 103.697 1.414 -12.231 302 HG3 LYS 37 HG3 LYS 37 102.662 0.049 -12.715 303 HD2 LYS 37 HD2 LYS 37 101.142 1.899 -13.785 304 HD3 LYS 37 HD3 LYS 37 102.593 2.923 -13.669 305 HE2 LYS 37 HE3 LYS 37 103.828 0.929 -14.808 306 HE3 LYS 37 HE2 LYS 37 102.198 0.360 -15.243 307 HZ1 LYS 37 HZ1 LYS 37 103.136 1.767 -16.953 308 HZ2 LYS 37 HZ2 LYS 37 103.317 3.014 -15.890 309 HZ3 LYS 37 HZ3 LYS 37 101.807 2.487 -16.293 310 H LEU 38 H LEU 38 104.647 2.155 -9.631 311 HA LEU 38 HA LEU 38 103.383 4.486 -8.243 312 HB2 LEU 38 HB2 LEU 38 104.854 4.284 -6.284 313 HB3 LEU 38 HB3 LEU 38 103.850 2.825 -6.449 314 HG LEU 38 HG LEU 38 106.685 3.047 -7.545 315 HD11 LEU 38 HD11 LEU 38 106.083 3.100 -4.874 316 HD12 LEU 38 HD12 LEU 38 106.127 1.345 -5.167 317 HD13 LEU 38 HD13 LEU 38 107.549 2.346 -5.544 318 HD21 LEU 38 HD21 LEU 38 106.188 0.403 -7.108 319 HD22 LEU 38 HD22 LEU 38 105.839 1.217 -8.652 320 HD23 LEU 38 HD23 LEU 38 104.538 0.970 -7.463 321 H THR 39 H THR 39 104.622 6.362 -8.361 322 HA THR 39 HA THR 39 107.110 6.113 -10.065 323 HB THR 39 HB THR 39 105.560 8.680 -9.634 324 HG1 THR 39 HG1 THR 39 103.970 7.357 -10.391 325 HG21 THR 39 HG21 THR 39 106.462 9.166 -11.891 326 HG22 THR 39 HG22 THR 39 107.204 7.549 -11.943 327 HG23 THR 39 HG23 THR 39 107.769 8.749 -10.757 328 H ILE 40 H ILE 40 109.009 6.595 -9.059 329 HA ILE 40 HA ILE 40 108.793 8.080 -6.430 330 HB ILE 40 HB ILE 40 110.956 6.169 -7.417 331 HG12 ILE 40 HG12 ILE 40 109.973 4.839 -5.396 332 HG13 ILE 40 HG13 ILE 40 108.551 5.890 -5.587 333 HG21 ILE 40 HG21 ILE 40 111.780 6.333 -5.083 334 HG22 ILE 40 HG22 ILE 40 110.507 7.522 -4.717 335 HG23 ILE 40 HG23 ILE 40 111.795 7.926 -5.877 336 HD11 ILE 40 HD11 ILE 40 108.989 3.523 -6.968 337 HD12 ILE 40 HD12 ILE 40 109.529 4.754 -8.134 338 HD13 ILE 40 HD13 ILE 40 107.877 4.816 -7.476 339 H THR 41 H THR 41 109.842 9.981 -6.199 340 HA THR 41 HA THR 41 111.928 10.696 -8.261 341 HB THR 41 HB THR 41 110.068 12.789 -7.138 342 HG1 THR 41 HG1 THR 41 108.594 11.374 -7.979 343 HG21 THR 41 HG21 THR 41 110.566 13.850 -9.322 344 HG22 THR 41 HG22 THR 41 111.507 12.418 -9.802 345 HG23 THR 41 HG23 THR 41 112.064 13.438 -8.454 346 H GLN 42 H GLN 42 113.561 12.161 -7.427 347 HA GLN 42 HA GLN 42 113.416 12.595 -4.446 348 HB2 GLN 42 HB2 GLN 42 115.729 11.793 -4.185 349 HB3 GLN 42 HB3 GLN 42 114.712 10.506 -4.875 350 HG2 GLN 42 HG3 GLN 42 115.496 11.169 -7.163 351 HG3 GLN 42 HG2 GLN 42 116.586 12.359 -6.412 352 HE21 GLN 42 HE21 GLN 42 118.237 10.863 -7.626 353 HE22 GLN 42 HE22 GLN 42 118.836 9.493 -6.718 354 H GLU 43 H GLU 43 114.373 14.501 -3.762 355 HA GLU 43 HA GLU 43 115.973 16.032 -5.806 356 HB2 GLU 43 HB2 GLU 43 113.447 16.935 -4.388 357 HB3 GLU 43 HB3 GLU 43 114.660 18.112 -4.945 358 HG2 GLU 43 HG2 GLU 43 114.514 17.062 -7.241 359 HG3 GLU 43 HG3 GLU 43 113.163 16.070 -6.643 360 H GLY 44 H GLY 44 117.706 15.270 -4.340 361 HA2 GLY 44 HA2 GLY 44 119.182 15.602 -2.530 362 HA3 GLY 44 HA3 GLY 44 118.620 17.289 -2.573 363 H ASN 45 H ASN 45 116.688 17.834 -1.292 364 HA ASN 45 HA ASN 45 116.353 15.924 1.035 365 HB2 ASN 45 HB2 ASN 45 115.708 18.727 1.618 366 HB3 ASN 45 HB3 ASN 45 116.785 17.608 2.486 367 HD21 ASN 45 HD21 ASN 45 119.048 17.392 1.657 368 HD22 ASN 45 HD22 ASN 45 119.746 18.702 0.731 369 H LYS 46 H LYS 46 114.754 16.151 -1.476 370 HA LYS 46 HA LYS 46 112.116 16.442 -0.107 371 HB2 LYS 46 HB2 LYS 46 113.074 18.094 -2.461 372 HB3 LYS 46 HB3 LYS 46 111.353 17.669 -2.312 373 HG2 LYS 46 HG3 LYS 46 111.117 19.415 -0.891 374 HG3 LYS 46 HG2 LYS 46 112.147 18.540 0.268 375 HD2 LYS 46 HD2 LYS 46 114.156 19.566 -0.665 376 HD3 LYS 46 HD3 LYS 46 113.207 20.334 -1.960 377 HE2 LYS 46 HE2 LYS 46 112.921 20.870 1.030 378 HE3 LYS 46 HE3 LYS 46 113.678 21.956 -0.159 379 HZ1 LYS 46 HZ1 LYS 46 111.573 22.760 -0.134 380 HZ2 LYS 46 HZ2 LYS 46 111.378 21.627 -1.317 381 HZ3 LYS 46 HZ3 LYS 46 110.866 21.313 0.220 382 H PHE 47 H PHE 47 111.362 14.463 -0.430 383 HA PHE 47 HA PHE 47 111.900 13.131 -3.082 384 HB2 PHE 47 HB2 PHE 47 111.270 12.107 -0.301 385 HB3 PHE 47 HB3 PHE 47 110.985 11.085 -1.730 386 HD1 PHE 47 HD1 PHE 47 113.651 13.404 -0.415 387 HD2 PHE 47 HD2 PHE 47 112.731 9.689 -2.366 388 HE1 PHE 47 HE1 PHE 47 116.066 12.852 -0.502 389 HE2 PHE 47 HE2 PHE 47 115.147 9.135 -2.450 390 HZ PHE 47 HZ PHE 47 116.815 10.717 -1.519 391 H THR 48 H THR 48 110.033 11.737 -3.878 392 HA THR 48 HA THR 48 107.349 12.657 -2.985 393 HB THR 48 HB THR 48 108.263 13.066 -5.866 394 HG1 THR 48 HG1 THR 48 109.081 14.862 -5.129 395 HG21 THR 48 HG21 THR 48 106.128 14.314 -6.047 396 HG22 THR 48 HG22 THR 48 105.763 13.935 -4.347 397 HG23 THR 48 HG23 THR 48 105.845 12.627 -5.552 398 H VAL 49 H VAL 49 106.658 10.590 -2.635 399 HA VAL 49 HA VAL 49 107.131 8.563 -4.812 400 HB VAL 49 HB VAL 49 106.125 8.236 -1.949 401 HG11 VAL 49 HG11 VAL 49 105.223 6.523 -3.500 402 HG12 VAL 49 HG12 VAL 49 106.423 5.814 -2.393 403 HG13 VAL 49 HG13 VAL 49 106.872 6.178 -4.076 404 HG21 VAL 49 HG21 VAL 49 108.344 7.191 -1.583 405 HG22 VAL 49 HG22 VAL 49 108.792 7.553 -3.267 406 HG23 VAL 49 HG23 VAL 49 108.514 8.881 -2.115 407 H LYS 50 H LYS 50 105.518 8.454 -6.290 408 HA LYS 50 HA LYS 50 102.715 9.059 -5.334 409 HB2 LYS 50 HB2 LYS 50 103.562 10.452 -7.210 410 HB3 LYS 50 HB3 LYS 50 103.862 8.978 -8.162 411 HG2 LYS 50 HG2 LYS 50 101.578 8.529 -8.434 412 HG3 LYS 50 HG3 LYS 50 101.118 9.468 -6.993 413 HD2 LYS 50 HD2 LYS 50 101.330 11.526 -8.107 414 HD3 LYS 50 HD3 LYS 50 102.408 10.853 -9.353 415 HE2 LYS 50 HE2 LYS 50 100.631 9.802 -10.500 416 HE3 LYS 50 HE3 LYS 50 99.554 9.870 -9.084 417 HZ1 LYS 50 HZ1 LYS 50 98.978 11.534 -10.721 418 HZ2 LYS 50 HZ2 LYS 50 99.488 12.260 -9.331 419 HZ3 LYS 50 HZ3 LYS 50 100.486 12.197 -10.643 420 H GLU 51 H GLU 51 101.968 7.069 -4.592 421 HA GLU 51 HA GLU 51 102.545 4.609 -6.139 422 HB2 GLU 51 HB2 GLU 51 100.650 5.133 -3.804 423 HB3 GLU 51 HB3 GLU 51 101.045 3.528 -4.465 424 HG2 GLU 51 HG2 GLU 51 103.360 3.744 -3.831 425 HG3 GLU 51 HG3 GLU 51 103.156 5.468 -3.438 426 H SER 52 H SER 52 100.864 3.305 -7.164 427 HA SER 52 HA SER 52 98.221 4.541 -7.599 428 HB2 SER 52 HB2 SER 52 98.455 4.766 -10.030 429 HB3 SER 52 HB3 SER 52 99.663 5.784 -9.210 430 HG SER 52 HG SER 52 100.331 4.251 -11.035 431 H SER 53 H SER 53 97.136 2.780 -7.158 432 HA SER 53 HA SER 53 97.870 0.242 -8.627 433 HB2 SER 53 HB2 SER 53 96.185 0.257 -6.122 434 HB3 SER 53 HB3 SER 53 97.254 -1.018 -6.756 435 HG SER 53 HG SER 53 97.841 1.115 -5.109 436 H ALA 54 H ALA 54 95.451 -1.103 -8.071 437 HA ALA 54 HA ALA 54 93.601 0.532 -9.795 438 HB1 ALA 54 HB1 ALA 54 92.461 -1.630 -10.219 439 HB2 ALA 54 HB2 ALA 54 94.197 -1.739 -10.597 440 HB3 ALA 54 HB3 ALA 54 93.570 -2.437 -9.084 441 H PHE 55 H PHE 55 94.120 0.309 -6.609 442 HA PHE 55 HA PHE 55 91.156 0.215 -6.015 443 HB2 PHE 55 HB2 PHE 55 93.473 -0.785 -4.311 444 HB3 PHE 55 HB3 PHE 55 91.787 -0.669 -3.753 445 HD1 PHE 55 HD1 PHE 55 93.816 -2.069 -6.595 446 HD2 PHE 55 HD2 PHE 55 90.369 -2.497 -4.068 447 HE1 PHE 55 HE1 PHE 55 93.317 -4.257 -7.647 448 HE2 PHE 55 HE2 PHE 55 89.870 -4.688 -5.120 449 HZ PHE 55 HZ PHE 55 91.344 -5.567 -6.911 450 H ARG 56 H ARG 56 94.058 2.145 -5.814 451 HA ARG 56 HA ARG 56 92.741 4.447 -4.885 452 HB2 ARG 56 HB2 ARG 56 93.615 4.351 -2.390 453 HB3 ARG 56 HB3 ARG 56 92.058 3.602 -2.812 454 HG2 ARG 56 HG2 ARG 56 92.839 1.484 -2.446 455 HG3 ARG 56 HG3 ARG 56 94.423 1.839 -3.176 456 HD2 ARG 56 HD2 ARG 56 94.322 1.369 -0.608 457 HD3 ARG 56 HD3 ARG 56 95.275 2.763 -1.172 458 HE ARG 56 HE ARG 56 93.772 4.167 -0.001 459 HH11 ARG 56 HH11 ARG 56 91.835 4.590 1.087 460 HH12 ARG 56 HH12 ARG 56 90.563 3.389 1.106 461 HH21 ARG 56 HH21 ARG 56 92.354 1.089 -0.799 462 HH22 ARG 56 HH22 ARG 56 90.856 1.416 0.043 463 H ASN 57 H ASN 57 94.403 5.158 -6.344 464 HA ASN 57 HA ASN 57 97.224 4.793 -5.819 465 HB2 ASN 57 HB2 ASN 57 97.550 6.683 -7.358 466 HB3 ASN 57 HB3 ASN 57 96.272 5.615 -7.986 467 HD21 ASN 57 HD21 ASN 57 94.127 6.454 -8.155 468 HD22 ASN 57 HD22 ASN 57 93.727 8.105 -7.736 469 H ILE 58 H ILE 58 98.715 6.108 -4.701 470 HA ILE 58 HA ILE 58 97.481 8.272 -2.990 471 HB ILE 58 HB ILE 58 99.712 6.576 -1.909 472 HG12 ILE 58 HG12 ILE 58 96.809 5.766 -2.217 473 HG13 ILE 58 HG13 ILE 58 98.278 4.803 -2.516 474 HG21 ILE 58 HG21 ILE 58 98.590 8.729 -0.886 475 HG22 ILE 58 HG22 ILE 58 98.911 7.332 0.168 476 HG23 ILE 58 HG23 ILE 58 97.269 7.616 -0.457 477 HD11 ILE 58 HD11 ILE 58 97.554 3.979 -0.437 478 HD12 ILE 58 HD12 ILE 58 98.749 5.210 0.035 479 HD13 ILE 58 HD13 ILE 58 97.010 5.581 0.117 480 H GLU 59 H GLU 59 99.320 9.541 -1.880 481 HA GLU 59 HA GLU 59 101.801 9.707 -3.525 482 HB2 GLU 59 HB2 GLU 59 101.040 11.387 -4.832 483 HB3 GLU 59 HB3 GLU 59 99.511 11.465 -3.928 484 HG2 GLU 59 HG2 GLU 59 100.519 12.930 -2.254 485 HG3 GLU 59 HG3 GLU 59 102.119 12.757 -3.014 486 H CYS 60 H CYS 60 103.483 10.209 -2.205 487 HA CYS 60 HA CYS 60 102.846 11.676 0.360 488 HB2 CYS 60 HB2 CYS 60 104.254 9.031 -0.036 489 HB3 CYS 60 HB3 CYS 60 104.759 10.096 1.298 490 HG CYS 60 HG CYS 60 101.686 10.313 1.802 491 H VAL 61 H VAL 61 103.934 13.574 0.114 492 HA VAL 61 HA VAL 61 106.693 13.437 -1.115 493 HB VAL 61 HB VAL 61 105.360 16.070 -0.658 494 HG11 VAL 61 HG11 VAL 61 106.264 16.420 -2.984 495 HG12 VAL 61 HG12 VAL 61 106.874 14.748 -2.949 496 HG13 VAL 61 HG13 VAL 61 107.507 15.951 -1.799 497 HG21 VAL 61 HG21 VAL 61 104.057 15.703 -2.846 498 HG22 VAL 61 HG22 VAL 61 103.399 14.911 -1.394 499 HG23 VAL 61 HG23 VAL 61 104.318 13.961 -2.586 500 H PHE 62 H PHE 62 108.446 14.300 0.069 501 HA PHE 62 HA PHE 62 108.170 16.000 2.357 502 HB2 PHE 62 HB2 PHE 62 107.492 13.188 2.852 503 HB3 PHE 62 HB3 PHE 62 108.824 13.748 3.890 504 HD1 PHE 62 HD1 PHE 62 105.353 13.484 3.709 505 HD2 PHE 62 HD2 PHE 62 108.417 16.306 4.760 506 HE1 PHE 62 HE1 PHE 62 103.733 14.717 5.123 507 HE2 PHE 62 HE2 PHE 62 106.796 17.539 6.174 508 HZ PHE 62 HZ PHE 62 104.454 16.744 6.358 509 H GLU 63 H GLU 63 110.146 15.811 3.867 510 HA GLU 63 HA GLU 63 112.533 15.181 2.130 511 HB2 GLU 63 HB2 GLU 63 112.418 17.502 2.913 512 HB3 GLU 63 HB3 GLU 63 112.197 16.956 4.592 513 HG2 GLU 63 HG2 GLU 63 114.417 16.108 4.725 514 HG3 GLU 63 HG3 GLU 63 114.624 16.140 2.957 515 H LEU 64 H LEU 64 114.450 14.239 3.316 516 HA LEU 64 HA LEU 64 113.477 12.055 5.072 517 HB2 LEU 64 HB3 LEU 64 115.620 11.077 4.792 518 HB3 LEU 64 HB2 LEU 64 115.295 11.872 3.234 519 HG LEU 64 HG LEU 64 116.492 13.934 4.494 520 HD11 LEU 64 HD11 LEU 64 116.824 12.661 6.602 521 HD12 LEU 64 HD12 LEU 64 118.385 13.081 5.856 522 HD13 LEU 64 HD13 LEU 64 117.745 11.426 5.710 523 HD21 LEU 64 HD21 LEU 64 118.588 13.220 3.370 524 HD22 LEU 64 HD22 LEU 64 117.944 11.567 3.222 525 HD23 LEU 64 HD23 LEU 64 117.171 12.906 2.340 526 H GLY 65 H GLY 65 113.721 11.932 7.271 527 HA2 GLY 65 HA2 GLY 65 114.894 12.508 9.352 528 HA3 GLY 65 HA3 GLY 65 115.458 14.014 8.589 529 H VAL 66 H VAL 66 112.146 13.097 8.042 530 HA VAL 66 HA VAL 66 111.215 14.828 10.312 531 HB VAL 66 HB VAL 66 110.635 15.332 7.362 532 HG11 VAL 66 HG11 VAL 66 108.555 15.470 8.704 533 HG12 VAL 66 HG12 VAL 66 109.366 16.567 9.847 534 HG13 VAL 66 HG13 VAL 66 109.078 17.085 8.168 535 HG21 VAL 66 HG21 VAL 66 111.510 17.588 7.908 536 HG22 VAL 66 HG22 VAL 66 111.797 17.070 9.586 537 HG23 VAL 66 HG23 VAL 66 112.721 16.331 8.256 538 H THR 67 H THR 67 109.939 13.329 11.320 539 HA THR 67 HA THR 67 108.648 11.105 10.157 540 HB THR 67 HB THR 67 107.211 12.663 12.295 541 HG1 THR 67 HG1 THR 67 109.207 12.913 13.099 542 HG21 THR 67 HG21 THR 67 106.986 10.391 13.262 543 HG22 THR 67 HG22 THR 67 106.393 10.435 11.584 544 HG23 THR 67 HG23 THR 67 107.988 9.732 11.946 545 H PHE 68 H PHE 68 106.710 10.716 9.228 546 HA PHE 68 HA PHE 68 104.692 12.856 8.923 547 HB2 PHE 68 HB2 PHE 68 104.781 12.277 6.305 548 HB3 PHE 68 HB3 PHE 68 105.730 13.612 6.997 549 HD1 PHE 68 HD1 PHE 68 106.073 9.865 6.664 550 HD2 PHE 68 HD2 PHE 68 107.918 13.726 6.282 551 HE1 PHE 68 HE1 PHE 68 108.169 8.792 5.870 552 HE2 PHE 68 HE2 PHE 68 110.009 12.650 5.503 553 HZ PHE 68 HZ PHE 68 110.131 10.186 5.292 554 H ASN 69 H ASN 69 103.076 11.706 7.017 555 HA ASN 69 HA ASN 69 102.846 8.860 8.008 556 HB2 ASN 69 HB3 ASN 69 100.461 9.105 8.224 557 HB3 ASN 69 HB2 ASN 69 101.198 10.485 9.073 558 HD21 ASN 69 HD21 ASN 69 98.476 10.248 7.709 559 HD22 ASN 69 HD22 ASN 69 98.456 11.561 6.554 560 H CYS 70 H CYS 70 101.883 7.376 6.552 561 HA CYS 70 HA CYS 70 101.194 8.310 3.815 562 HB2 CYS 70 HB2 CYS 70 103.803 7.894 4.084 563 HB3 CYS 70 HB3 CYS 70 103.327 6.181 4.007 564 HG CYS 70 HG CYS 70 103.039 6.117 1.391 565 H ASN 71 H ASN 71 99.552 7.017 3.094 566 HA ASN 71 HA ASN 71 98.890 4.653 4.786 567 HB2 ASN 71 HB3 ASN 71 97.310 5.482 2.352 568 HB3 ASN 71 HB2 ASN 71 96.737 4.788 3.889 569 HD21 ASN 71 HD21 ASN 71 98.555 6.728 5.430 570 HD22 ASN 71 HD22 ASN 71 97.700 8.252 5.361 571 H LEU 72 H LEU 72 98.638 2.531 3.973 572 HA LEU 72 HA LEU 72 100.293 2.027 1.506 573 HB2 LEU 72 HB2 LEU 72 99.430 0.273 3.839 574 HB3 LEU 72 HB3 LEU 72 100.199 -0.385 2.375 575 HG LEU 72 HG LEU 72 101.412 1.855 4.047 576 HD11 LEU 72 HD11 LEU 72 102.130 -1.109 4.061 577 HD12 LEU 72 HD12 LEU 72 102.844 0.175 5.066 578 HD13 LEU 72 HD13 LEU 72 101.152 -0.316 5.319 579 HD21 LEU 72 HD21 LEU 72 102.165 1.704 1.687 580 HD22 LEU 72 HD22 LEU 72 103.467 1.233 2.805 581 HD23 LEU 72 HD23 LEU 72 102.557 -0.016 1.923 582 H ALA 73 H ALA 73 99.472 0.764 -0.207 583 HA ALA 73 HA ALA 73 96.833 1.121 -1.037 584 HB1 ALA 73 HB1 ALA 73 97.129 -0.879 -2.474 585 HB2 ALA 73 HB2 ALA 73 98.600 0.122 -2.455 586 HB3 ALA 73 HB3 ALA 73 98.529 -1.374 -1.493 587 H ASP 74 H ASP 74 98.042 -1.336 1.225 588 HA ASP 74 HA ASP 74 95.615 -2.925 1.276 589 HB2 ASP 74 HB2 ASP 74 97.269 -2.588 3.765 590 HB3 ASP 74 HB3 ASP 74 96.617 -4.071 3.027 591 H GLY 75 H GLY 75 95.615 0.214 1.671 592 HA2 GLY 75 HA2 GLY 75 94.113 1.675 2.769 593 HA3 GLY 75 HA3 GLY 75 93.225 0.238 3.332 594 H THR 76 H THR 76 96.664 0.665 3.977 595 HA THR 76 HA THR 76 95.976 0.811 6.899 596 HB THR 76 HB THR 76 98.817 0.571 6.108 597 HG1 THR 76 HG1 THR 76 97.938 -0.653 4.437 598 HG21 THR 76 HG21 THR 76 98.721 -1.252 7.783 599 HG22 THR 76 HG22 THR 76 96.949 -1.094 7.852 600 HG23 THR 76 HG23 THR 76 97.984 0.240 8.415 601 H GLU 77 H GLU 77 97.323 2.247 8.249 602 HA GLU 77 HA GLU 77 98.313 4.668 6.741 603 HB2 GLU 77 HB2 GLU 77 95.980 4.994 7.719 604 HB3 GLU 77 HB3 GLU 77 96.707 4.773 9.329 605 HG2 GLU 77 HG3 GLU 77 98.104 6.707 9.064 606 HG3 GLU 77 HG2 GLU 77 97.736 6.818 7.326 607 H LEU 78 H LEU 78 100.447 4.952 7.279 608 HA LEU 78 HA LEU 78 101.200 4.311 10.139 609 HB2 LEU 78 HB2 LEU 78 103.142 3.777 7.892 610 HB3 LEU 78 HB3 LEU 78 103.068 3.054 9.515 611 HG LEU 78 HG LEU 78 100.682 2.206 8.584 612 HD11 LEU 78 HD11 LEU 78 101.226 3.429 6.373 613 HD12 LEU 78 HD12 LEU 78 102.428 2.146 6.096 614 HD13 LEU 78 HD13 LEU 78 100.703 1.732 6.243 615 HD21 LEU 78 HD21 LEU 78 103.268 0.838 7.740 616 HD22 LEU 78 HD22 LEU 78 101.727 0.076 8.204 617 HD23 LEU 78 HD23 LEU 78 102.720 0.897 9.433 618 H ARG 79 H ARG 79 103.260 5.366 10.813 619 HA ARG 79 HA ARG 79 104.004 7.745 9.136 620 HB2 ARG 79 HB2 ARG 79 103.690 9.311 10.956 621 HB3 ARG 79 HB3 ARG 79 102.166 8.413 10.755 622 HG2 ARG 79 HG3 ARG 79 102.908 6.850 12.581 623 HG3 ARG 79 HG2 ARG 79 104.339 7.879 12.830 624 HD2 ARG 79 HD2 ARG 79 101.652 9.219 12.817 625 HD3 ARG 79 HD3 ARG 79 102.073 8.234 14.239 626 HE ARG 79 HE ARG 79 104.347 9.812 13.849 627 HH11 ARG 79 HH11 ARG 79 104.568 11.852 14.797 628 HH12 ARG 79 HH12 ARG 79 103.146 12.769 15.241 629 HH21 ARG 79 HH21 ARG 79 100.917 10.335 14.133 630 HH22 ARG 79 HH22 ARG 79 101.088 11.914 14.867 631 H GLY 80 H GLY 80 106.151 8.354 9.388 632 HA2 GLY 80 HA2 GLY 80 107.808 7.846 11.636 633 HA3 GLY 80 HA3 GLY 80 107.943 6.418 10.578 634 H THR 81 H THR 81 109.562 6.569 9.088 635 HA THR 81 HA THR 81 109.851 8.746 7.271 636 HB THR 81 HB THR 81 112.233 9.244 8.802 637 HG1 THR 81 HG1 THR 81 111.413 9.841 10.749 638 HG21 THR 81 HG21 THR 81 111.265 11.569 8.836 639 HG22 THR 81 HG22 THR 81 111.267 10.821 7.221 640 HG23 THR 81 HG23 THR 81 109.758 10.902 8.161 641 H TRP 82 H TRP 82 111.789 8.622 5.963 642 HA TRP 82 HA TRP 82 113.047 5.887 6.156 643 HB2 TRP 82 HB2 TRP 82 113.267 7.826 3.824 644 HB3 TRP 82 HB3 TRP 82 113.529 6.066 3.823 645 HD1 TRP 82 HD1 TRP 82 110.738 8.682 4.071 646 HE1 TRP 82 HE1 TRP 82 108.488 7.598 3.439 647 HE3 TRP 82 HE3 TRP 82 112.288 3.847 3.599 648 HZ2 TRP 82 HZ2 TRP 82 107.511 4.951 2.793 649 HZ3 TRP 82 HZ3 TRP 82 110.689 2.065 2.969 650 HH2 TRP 82 HH2 TRP 82 108.303 2.610 2.565 651 H SER 83 H SER 83 115.288 5.668 6.285 652 HA SER 83 HA SER 83 116.905 8.206 6.309 653 HB2 SER 83 HB2 SER 83 116.492 6.272 8.590 654 HB3 SER 83 HB3 SER 83 118.086 7.039 8.389 655 HG SER 83 HG SER 83 116.652 8.298 9.708 656 H LEU 84 H LEU 84 119.254 7.723 6.015 657 HA LEU 84 HA LEU 84 119.500 5.183 4.455 658 HB2 LEU 84 HB3 LEU 84 120.616 6.660 3.131 659 HB3 LEU 84 HB2 LEU 84 120.796 7.837 4.452 660 HG LEU 84 HG LEU 84 122.628 6.371 5.398 661 HD11 LEU 84 HD11 LEU 84 123.195 5.063 2.846 662 HD12 LEU 84 HD12 LEU 84 123.100 4.360 4.479 663 HD13 LEU 84 HD13 LEU 84 121.624 4.544 3.502 664 HD21 LEU 84 HD21 LEU 84 124.313 7.098 3.729 665 HD22 LEU 84 HD22 LEU 84 123.118 8.381 4.034 666 HD23 LEU 84 HD23 LEU 84 123.014 7.403 2.551 667 H GLU 85 H GLU 85 120.458 3.426 5.311 668 HA GLU 85 HA GLU 85 122.175 3.828 7.768 669 HB2 GLU 85 HB2 GLU 85 120.534 2.632 8.813 670 HB3 GLU 85 HB3 GLU 85 119.816 2.102 7.274 671 HG2 GLU 85 HG3 GLU 85 121.409 0.311 7.050 672 HG3 GLU 85 HG2 GLU 85 122.409 0.948 8.378 673 H GLY 86 H GLY 86 124.246 3.197 7.373 674 HA2 GLY 86 HA3 GLY 86 126.049 2.152 6.248 675 HA3 GLY 86 HA2 GLY 86 124.984 0.726 6.151 676 H ASN 87 H ASN 87 124.167 0.168 4.160 677 HA ASN 87 HA ASN 87 124.447 2.242 1.972 678 HB2 ASN 87 HB3 ASN 87 124.763 0.102 0.487 679 HB3 ASN 87 HB2 ASN 87 126.143 0.702 1.437 680 HD21 ASN 87 HD21 ASN 87 124.798 -2.151 0.589 681 HD22 ASN 87 HD22 ASN 87 125.054 -3.069 2.055 682 H LYS 88 H LYS 88 122.061 1.632 3.619 683 HA LYS 88 HA LYS 88 120.296 0.798 1.326 684 HB2 LYS 88 HB2 LYS 88 119.891 -0.218 4.168 685 HB3 LYS 88 HB3 LYS 88 119.006 -0.707 2.704 686 HG2 LYS 88 HG3 LYS 88 120.518 -2.455 2.810 687 HG3 LYS 88 HG2 LYS 88 121.497 -1.301 1.874 688 HD2 LYS 88 HD2 LYS 88 122.983 -1.937 3.580 689 HD3 LYS 88 HD3 LYS 88 122.272 -0.445 4.241 690 HE2 LYS 88 HE2 LYS 88 120.755 -1.689 5.641 691 HE3 LYS 88 HE3 LYS 88 121.155 -3.218 4.822 692 HZ1 LYS 88 HZ1 LYS 88 122.322 -2.996 6.913 693 HZ2 LYS 88 HZ2 LYS 88 123.026 -1.589 6.422 694 HZ3 LYS 88 HZ3 LYS 88 123.398 -3.005 5.663 695 H LEU 89 H LEU 89 118.050 1.515 1.603 696 HA LEU 89 HA LEU 89 117.944 4.022 3.273 697 HB2 LEU 89 HB2 LEU 89 116.572 3.050 0.773 698 HB3 LEU 89 HB3 LEU 89 115.694 4.186 1.825 699 HG LEU 89 HG LEU 89 118.565 4.767 1.092 700 HD11 LEU 89 HD11 LEU 89 117.434 4.242 -1.052 701 HD12 LEU 89 HD12 LEU 89 116.124 5.373 -0.636 702 HD13 LEU 89 HD13 LEU 89 117.772 5.985 -0.917 703 HD21 LEU 89 HD21 LEU 89 117.380 6.144 2.780 704 HD22 LEU 89 HD22 LEU 89 116.093 6.483 1.599 705 HD23 LEU 89 HD23 LEU 89 117.740 7.094 1.318 706 H ILE 90 H ILE 90 117.147 3.588 5.288 707 HA ILE 90 HA ILE 90 115.319 1.311 5.684 708 HB ILE 90 HB ILE 90 115.181 2.519 8.055 709 HG12 ILE 90 HG12 ILE 90 117.814 3.537 6.932 710 HG13 ILE 90 HG13 ILE 90 116.362 4.553 7.118 711 HG21 ILE 90 HG21 ILE 90 116.210 0.315 7.566 712 HG22 ILE 90 HG22 ILE 90 117.218 1.262 8.686 713 HG23 ILE 90 HG23 ILE 90 117.674 1.133 6.971 714 HD11 ILE 90 HD11 ILE 90 117.846 4.749 9.088 715 HD12 ILE 90 HD12 ILE 90 116.288 4.008 9.525 716 HD13 ILE 90 HD13 ILE 90 117.737 2.991 9.341 717 H GLY 91 H GLY 91 113.269 1.571 6.846 718 HA2 GLY 91 HA2 GLY 91 111.830 4.149 6.353 719 HA3 GLY 91 HA3 GLY 91 111.203 2.696 5.533 720 H LYS 92 H LYS 92 111.564 4.350 8.590 721 HA LYS 92 HA LYS 92 110.426 2.031 10.084 722 HB2 LYS 92 HB3 LYS 92 110.751 3.380 12.064 723 HB3 LYS 92 HB2 LYS 92 112.202 3.572 11.052 724 HG2 LYS 92 HG2 LYS 92 110.780 5.611 10.050 725 HG3 LYS 92 HG3 LYS 92 110.009 5.539 11.652 726 HD2 LYS 92 HD3 LYS 92 112.560 5.380 12.464 727 HD3 LYS 92 HD2 LYS 92 112.847 6.214 10.918 728 HE2 LYS 92 HE2 LYS 92 112.478 8.049 12.293 729 HE3 LYS 92 HE3 LYS 92 110.808 7.726 11.766 730 HZ1 LYS 92 HZ1 LYS 92 110.957 7.968 14.155 731 HZ2 LYS 92 HZ2 LYS 92 110.497 6.432 13.769 732 HZ3 LYS 92 HZ3 LYS 92 112.044 6.731 14.257 733 H PHE 93 H PHE 93 108.296 1.720 9.600 734 HA PHE 93 HA PHE 93 106.520 4.170 9.713 735 HB2 PHE 93 HB3 PHE 93 106.487 1.699 7.987 736 HB3 PHE 93 HB2 PHE 93 104.940 2.468 8.408 737 HD1 PHE 93 HD1 PHE 93 107.236 5.077 8.525 738 HD2 PHE 93 HD2 PHE 93 105.291 2.513 5.677 739 HE1 PHE 93 HE1 PHE 93 107.596 6.770 6.752 740 HE2 PHE 93 HE2 PHE 93 105.651 4.212 3.906 741 HZ PHE 93 HZ PHE 93 106.803 6.340 4.444 742 H LYS 94 H LYS 94 104.976 4.197 11.222 743 HA LYS 94 HA LYS 94 104.494 1.626 12.742 744 HB2 LYS 94 HB2 LYS 94 104.671 4.518 13.606 745 HB3 LYS 94 HB3 LYS 94 103.689 3.371 14.546 746 HG2 LYS 94 HG3 LYS 94 105.770 3.155 15.592 747 HG3 LYS 94 HG2 LYS 94 105.852 1.850 14.385 748 HD2 LYS 94 HD2 LYS 94 107.884 2.921 13.991 749 HD3 LYS 94 HD3 LYS 94 106.834 3.784 12.842 750 HE2 LYS 94 HE2 LYS 94 108.100 5.448 14.068 751 HE3 LYS 94 HE3 LYS 94 106.421 5.511 14.655 752 HZ1 LYS 94 HZ1 LYS 94 107.999 5.493 16.471 753 HZ2 LYS 94 HZ2 LYS 94 107.084 4.121 16.502 754 HZ3 LYS 94 HZ3 LYS 94 108.640 4.062 15.959 755 H ARG 95 H ARG 95 102.515 0.796 12.369 756 HA ARG 95 HA ARG 95 100.482 2.054 10.833 757 HB2 ARG 95 HB2 ARG 95 100.298 -0.075 13.003 758 HB3 ARG 95 HB3 ARG 95 98.917 0.401 11.986 759 HG2 ARG 95 HG3 ARG 95 100.437 -0.069 9.965 760 HG3 ARG 95 HG2 ARG 95 101.548 -0.853 11.114 761 HD2 ARG 95 HD2 ARG 95 100.113 -2.577 10.202 762 HD3 ARG 95 HD3 ARG 95 99.594 -2.285 11.879 763 HE ARG 95 HE ARG 95 98.124 -0.649 9.910 764 HH11 ARG 95 HH11 ARG 95 95.937 -1.184 9.690 765 HH12 ARG 95 HH12 ARG 95 95.338 -2.695 10.336 766 HH21 ARG 95 HH21 ARG 95 98.439 -3.700 11.558 767 HH22 ARG 95 HH22 ARG 95 96.747 -4.113 11.389 768 H THR 96 H THR 96 99.448 3.920 11.269 769 HA THR 96 HA THR 96 99.214 4.866 14.075 770 HB THR 96 HB THR 96 97.707 6.587 12.517 771 HG1 THR 96 HG1 THR 96 98.831 6.746 10.553 772 HG21 THR 96 HG21 THR 96 99.744 7.993 12.505 773 HG22 THR 96 HG22 THR 96 100.731 6.568 12.906 774 HG23 THR 96 HG23 THR 96 99.537 7.182 14.075 775 H ASP 97 H ASP 97 97.505 2.955 11.949 776 HA ASP 97 HA ASP 97 94.806 3.614 13.010 777 HB2 ASP 97 HB3 ASP 97 95.219 2.919 10.614 778 HB3 ASP 97 HB2 ASP 97 95.667 1.305 11.216 779 H ASN 98 H ASN 98 97.399 1.294 13.571 780 HA ASN 98 HA ASN 98 95.666 0.087 15.731 781 HB2 ASN 98 HB2 ASN 98 97.541 -1.382 13.824 782 HB3 ASN 98 HB3 ASN 98 96.763 -2.116 15.246 783 HD21 ASN 98 HD21 ASN 98 94.245 -0.481 14.853 784 HD22 ASN 98 HD22 ASN 98 93.438 -1.223 13.490 785 H GLY 99 H GLY 99 98.375 1.849 15.001 786 HA2 GLY 99 HA3 GLY 99 100.332 2.341 16.233 787 HA3 GLY 99 HA2 GLY 99 99.453 1.721 17.651 788 H ASN 100 H ASN 100 100.479 0.040 14.652 789 HA ASN 100 HA ASN 100 101.688 -2.078 16.378 790 HB2 ASN 100 HB2 ASN 100 100.194 -2.601 14.386 791 HB3 ASN 100 HB3 ASN 100 101.483 -1.962 13.338 792 HD21 ASN 100 HD21 ASN 100 100.607 -4.611 15.565 793 HD22 ASN 100 HD22 ASN 100 101.951 -5.643 15.129 794 H GLU 101 H GLU 101 103.205 -2.252 13.539 795 HA GLU 101 HA GLU 101 105.236 -0.198 13.699 796 HB2 GLU 101 HB2 GLU 101 106.938 -1.152 14.945 797 HB3 GLU 101 HB3 GLU 101 105.533 -1.794 15.829 798 HG2 GLU 101 HG3 GLU 101 105.653 -3.826 14.265 799 HG3 GLU 101 HG2 GLU 101 107.236 -3.206 13.738 800 H LEU 102 H LEU 102 106.431 -0.234 11.834 801 HA LEU 102 HA LEU 102 106.501 -2.825 10.288 802 HB2 LEU 102 HB3 LEU 102 104.709 -1.454 9.300 803 HB3 LEU 102 HB2 LEU 102 105.807 -0.058 9.193 804 HG LEU 102 HG LEU 102 107.309 -1.437 7.701 805 HD11 LEU 102 HD11 LEU 102 105.293 -3.469 8.434 806 HD12 LEU 102 HD12 LEU 102 105.596 -3.372 6.683 807 HD13 LEU 102 HD13 LEU 102 106.944 -3.680 7.804 808 HD21 LEU 102 HD21 LEU 102 105.654 0.158 6.763 809 HD22 LEU 102 HD22 LEU 102 105.842 -1.264 5.709 810 HD23 LEU 102 HD23 LEU 102 104.418 -1.123 6.768 811 H ASN 103 H ASN 103 108.665 -3.279 10.314 812 HA ASN 103 HA ASN 103 110.570 -0.959 10.001 813 HB2 ASN 103 HB2 ASN 103 110.647 -3.561 11.384 814 HB3 ASN 103 HB3 ASN 103 112.089 -3.276 10.382 815 HD21 ASN 103 HD21 ASN 103 113.439 -1.382 10.885 816 HD22 ASN 103 HD22 ASN 103 113.295 -0.578 12.432 817 H THR 104 H THR 104 110.848 -0.545 7.838 818 HA THR 104 HA THR 104 111.267 -2.973 6.082 819 HB THR 104 HB THR 104 109.186 -1.912 5.480 820 HG1 THR 104 HG1 THR 104 109.954 -2.225 3.527 821 HG21 THR 104 HG21 THR 104 109.395 0.608 4.745 822 HG22 THR 104 HG22 THR 104 110.839 0.605 5.786 823 HG23 THR 104 HG23 THR 104 109.244 0.218 6.475 824 H VAL 105 H VAL 105 112.351 -2.265 3.944 825 HA VAL 105 HA VAL 105 114.427 -0.148 4.330 826 HB VAL 105 HB VAL 105 115.141 -3.045 3.688 827 HG11 VAL 105 HG11 VAL 105 117.474 -1.910 4.309 828 HG12 VAL 105 HG12 VAL 105 116.628 -0.428 3.805 829 HG13 VAL 105 HG13 VAL 105 116.807 -1.782 2.663 830 HG21 VAL 105 HG21 VAL 105 116.212 -3.053 5.920 831 HG22 VAL 105 HG22 VAL 105 114.463 -2.752 6.060 832 HG23 VAL 105 HG23 VAL 105 115.614 -1.403 6.218 833 H ARG 106 H ARG 106 115.426 0.441 2.265 834 HA ARG 106 HA ARG 106 113.938 -0.714 -0.108 835 HB2 ARG 106 HB2 ARG 106 114.477 2.167 0.656 836 HB3 ARG 106 HB3 ARG 106 114.253 1.709 -1.049 837 HG2 ARG 106 HG3 ARG 106 112.058 0.760 -0.558 838 HG3 ARG 106 HG2 ARG 106 112.292 1.028 1.186 839 HD2 ARG 106 HD2 ARG 106 111.013 2.898 0.590 840 HD3 ARG 106 HD3 ARG 106 112.668 3.540 0.458 841 HE ARG 106 HE ARG 106 111.875 2.409 -2.089 842 HH11 ARG 106 HH11 ARG 106 111.270 3.860 -3.713 843 HH12 ARG 106 HH12 ARG 106 110.810 5.496 -3.298 844 HH21 ARG 106 HH21 ARG 106 111.287 5.035 0.120 845 HH22 ARG 106 HH22 ARG 106 110.820 6.159 -1.137 846 H GLU 107 H GLU 107 115.234 -1.373 -1.754 847 HA GLU 107 HA GLU 107 118.072 -0.316 -1.791 848 HB2 GLU 107 HB3 GLU 107 117.231 -3.189 -2.377 849 HB3 GLU 107 HB2 GLU 107 118.889 -2.544 -2.371 850 HG2 GLU 107 HG2 GLU 107 118.926 -2.300 -0.035 851 HG3 GLU 107 HG3 GLU 107 117.151 -2.265 0.088 852 H ILE 108 H ILE 108 119.075 -0.453 -3.964 853 HA ILE 108 HA ILE 108 116.962 -0.425 -6.127 854 HB ILE 108 HB ILE 108 119.571 1.145 -6.040 855 HG12 ILE 108 HG12 ILE 108 117.441 1.619 -4.378 856 HG13 ILE 108 HG13 ILE 108 118.522 2.890 -4.995 857 HG21 ILE 108 HG21 ILE 108 118.825 0.782 -8.288 858 HG22 ILE 108 HG22 ILE 108 117.131 1.108 -7.850 859 HG23 ILE 108 HG23 ILE 108 118.320 2.433 -7.857 860 HD11 ILE 108 HD11 ILE 108 116.020 3.328 -5.291 861 HD12 ILE 108 HD12 ILE 108 116.999 3.444 -6.773 862 HD13 ILE 108 HD13 ILE 108 116.014 1.993 -6.469 863 H ILE 109 H ILE 109 117.441 -2.726 -6.397 864 HA ILE 109 HA ILE 109 120.125 -3.661 -6.950 865 HB ILE 109 HB ILE 109 117.347 -4.697 -7.575 866 HG12 ILE 109 HG13 ILE 109 119.700 -5.833 -5.997 867 HG13 ILE 109 HG12 ILE 109 118.359 -4.905 -5.284 868 HG21 ILE 109 HG21 ILE 109 119.096 -6.780 -8.194 869 HG22 ILE 109 HG22 ILE 109 118.194 -5.801 -9.376 870 HG23 ILE 109 HG23 ILE 109 119.868 -5.367 -8.954 871 HD11 ILE 109 HD11 ILE 109 118.333 -7.666 -6.514 872 HD12 ILE 109 HD12 ILE 109 117.619 -7.108 -4.983 873 HD13 ILE 109 HD13 ILE 109 116.849 -6.682 -6.530 874 H GLY 110 H GLY 110 121.115 -2.201 -8.365 875 HA2 GLY 110 HA2 GLY 110 121.650 -1.271 -10.470 876 HA3 GLY 110 HA3 GLY 110 121.005 -2.788 -11.137 877 H ASP 111 H ASP 111 118.649 -2.875 -11.588 878 HA ASP 111 HA ASP 111 117.513 -0.102 -12.011 879 HB2 ASP 111 HB3 ASP 111 116.914 -2.398 -13.884 880 HB3 ASP 111 HB2 ASP 111 116.815 -0.646 -14.183 881 H GLU 112 H GLU 112 117.072 -2.093 -9.825 882 HA GLU 112 HA GLU 112 114.082 -2.259 -10.177 883 HB2 GLU 112 HB2 GLU 112 115.453 -4.471 -8.680 884 HB3 GLU 112 HB3 GLU 112 113.958 -4.509 -9.645 885 HG2 GLU 112 HG3 GLU 112 115.350 -4.253 -11.722 886 HG3 GLU 112 HG2 GLU 112 116.812 -4.360 -10.713 887 H LEU 113 H LEU 113 112.921 -1.947 -8.180 888 HA LEU 113 HA LEU 113 114.734 -0.938 -5.976 889 HB2 LEU 113 HB2 LEU 113 113.144 0.717 -6.960 890 HB3 LEU 113 HB3 LEU 113 111.789 -0.327 -6.474 891 HG LEU 113 HG LEU 113 112.909 -0.178 -4.083 892 HD11 LEU 113 HD11 LEU 113 113.986 2.069 -3.757 893 HD12 LEU 113 HD12 LEU 113 114.947 0.986 -4.793 894 HD13 LEU 113 HD13 LEU 113 113.980 2.291 -5.523 895 HD21 LEU 113 HD21 LEU 113 111.748 2.293 -4.037 896 HD22 LEU 113 HD22 LEU 113 110.819 0.776 -4.072 897 HD23 LEU 113 HD23 LEU 113 111.111 1.676 -5.580 898 H VAL 114 H VAL 114 115.029 -2.489 -4.462 899 HA VAL 114 HA VAL 114 112.825 -4.447 -3.962 900 HB VAL 114 HB VAL 114 115.436 -4.325 -2.433 901 HG11 VAL 114 HG11 VAL 114 113.689 -5.951 -1.751 902 HG12 VAL 114 HG12 VAL 114 113.653 -6.604 -3.406 903 HG13 VAL 114 HG13 VAL 114 115.118 -6.783 -2.411 904 HG21 VAL 114 HG21 VAL 114 116.218 -5.954 -4.333 905 HG22 VAL 114 HG22 VAL 114 114.969 -5.145 -5.309 906 HG23 VAL 114 HG23 VAL 114 116.308 -4.199 -4.616 907 H GLN 115 H GLN 115 111.275 -3.879 -2.537 908 HA GLN 115 HA GLN 115 112.123 -2.134 -0.212 909 HB2 GLN 115 HB2 GLN 115 110.405 -1.162 -1.798 910 HB3 GLN 115 HB3 GLN 115 109.322 -2.507 -1.365 911 HG2 GLN 115 HG2 GLN 115 109.266 -1.813 0.952 912 HG3 GLN 115 HG3 GLN 115 110.557 -0.617 0.683 913 HE21 GLN 115 HE21 GLN 115 109.909 1.477 0.109 914 HE22 GLN 115 HE22 GLN 115 108.287 1.895 -0.395 915 H THR 116 H THR 116 112.574 -3.612 1.395 916 HA THR 116 HA THR 116 110.633 -5.892 1.724 917 HB THR 116 HB THR 116 113.105 -5.638 3.407 918 HG1 THR 116 HG1 THR 116 113.971 -5.152 1.420 919 HG21 THR 116 HG21 THR 116 113.132 -8.089 3.023 920 HG22 THR 116 HG22 THR 116 111.556 -7.547 3.650 921 HG23 THR 116 HG23 THR 116 111.744 -7.927 1.921 922 H TYR 117 H TYR 117 109.532 -6.207 3.656 923 HA TYR 117 HA TYR 117 109.849 -3.990 5.685 924 HB2 TYR 117 HB2 TYR 117 107.154 -5.194 5.538 925 HB3 TYR 117 HB3 TYR 117 107.634 -3.488 5.687 926 HD1 TYR 117 HD1 TYR 117 107.857 -6.267 3.187 927 HD2 TYR 117 HD2 TYR 117 107.117 -2.106 3.901 928 HE1 TYR 117 HE1 TYR 117 107.361 -5.948 0.778 929 HE2 TYR 117 HE2 TYR 117 106.620 -1.774 1.494 930 HH TYR 117 HH TYR 117 107.313 -3.042 -0.738 931 H VAL 118 H VAL 118 109.496 -4.570 7.823 932 HA VAL 118 HA VAL 118 109.462 -7.557 8.317 933 HB VAL 118 HB VAL 118 110.621 -5.462 10.186 934 HG11 VAL 118 HG11 VAL 118 111.455 -7.268 11.389 935 HG12 VAL 118 HG12 VAL 118 109.959 -7.986 10.746 936 HG13 VAL 118 HG13 VAL 118 111.518 -8.327 9.960 937 HG21 VAL 118 HG21 VAL 118 112.568 -7.086 8.696 938 HG22 VAL 118 HG22 VAL 118 112.554 -5.335 9.012 939 HG23 VAL 118 HG23 VAL 118 111.633 -5.999 7.641 940 H TYR 119 H TYR 119 108.241 -8.262 10.104 941 HA TYR 119 HA TYR 119 106.561 -6.154 11.418 942 HB2 TYR 119 HB2 TYR 119 105.556 -7.471 9.257 943 HB3 TYR 119 HB3 TYR 119 105.078 -8.586 10.559 944 HD1 TYR 119 HD1 TYR 119 103.856 -7.640 12.571 945 HD2 TYR 119 HD2 TYR 119 104.406 -5.421 8.940 946 HE1 TYR 119 HE1 TYR 119 102.003 -6.125 13.218 947 HE2 TYR 119 HE2 TYR 119 102.563 -3.895 9.589 948 HH TYR 119 HH TYR 119 101.461 -3.166 11.860 949 H GLU 120 H GLU 120 107.033 -6.460 13.477 950 HA GLU 120 HA GLU 120 107.477 -7.559 15.514 951 HB2 GLU 120 HB3 GLU 120 105.163 -9.163 14.368 952 HB3 GLU 120 HB2 GLU 120 105.765 -9.373 16.030 953 HG2 GLU 120 HG2 GLU 120 105.097 -6.605 15.014 954 HG3 GLU 120 HG3 GLU 120 103.792 -7.683 15.565 955 H GLY 121 H GLY 121 108.833 -8.657 12.969 956 HA2 GLY 121 HA2 GLY 121 110.751 -10.232 13.351 957 HA3 GLY 121 HA3 GLY 121 109.637 -11.267 14.276 958 H VAL 122 H VAL 122 108.619 -9.649 11.338 959 HA VAL 122 HA VAL 122 108.785 -12.311 9.924 960 HB VAL 122 HB VAL 122 106.426 -11.197 10.660 961 HG11 VAL 122 HG11 VAL 122 106.772 -10.193 7.820 962 HG12 VAL 122 HG12 VAL 122 107.125 -9.149 9.218 963 HG13 VAL 122 HG13 VAL 122 105.487 -9.808 8.991 964 HG21 VAL 122 HG21 VAL 122 105.427 -12.480 8.792 965 HG22 VAL 122 HG22 VAL 122 106.762 -13.378 9.553 966 HG23 VAL 122 HG23 VAL 122 107.017 -12.554 7.996 967 H GLU 123 H GLU 123 108.470 -11.765 7.426 968 HA GLU 123 HA GLU 123 109.689 -9.138 6.782 969 HB2 GLU 123 HB3 GLU 123 111.747 -10.158 7.266 970 HB3 GLU 123 HB2 GLU 123 111.219 -11.742 6.649 971 HG2 GLU 123 HG2 GLU 123 111.571 -11.151 4.429 972 HG3 GLU 123 HG3 GLU 123 111.309 -9.418 4.738 973 H ALA 124 H ALA 124 108.830 -8.456 4.931 974 HA ALA 124 HA ALA 124 108.031 -10.543 2.888 975 HB1 ALA 124 HB1 ALA 124 106.504 -8.210 2.415 976 HB2 ALA 124 HB2 ALA 124 105.918 -9.753 3.082 977 HB3 ALA 124 HB3 ALA 124 106.450 -8.454 4.178 978 H LYS 125 H LYS 125 108.380 -9.880 0.640 979 HA LYS 125 HA LYS 125 110.139 -7.427 0.433 980 HB2 LYS 125 HB2 LYS 125 111.297 -9.791 0.412 981 HB3 LYS 125 HB3 LYS 125 110.667 -9.878 -1.250 982 HG2 LYS 125 HG3 LYS 125 111.882 -7.926 -1.919 983 HG3 LYS 125 HG2 LYS 125 112.241 -7.480 -0.234 984 HD2 LYS 125 HD2 LYS 125 114.265 -8.452 -0.930 985 HD3 LYS 125 HD3 LYS 125 113.442 -9.822 -0.147 986 HE2 LYS 125 HE3 LYS 125 112.496 -10.369 -2.488 987 HE3 LYS 125 HE2 LYS 125 113.713 -9.232 -3.116 988 HZ1 LYS 125 HZ1 LYS 125 115.379 -10.623 -2.576 989 HZ2 LYS 125 HZ2 LYS 125 114.638 -11.225 -1.231 990 HZ3 LYS 125 HZ3 LYS 125 114.214 -11.781 -2.725 991 H ARG 126 H ARG 126 109.851 -6.164 -1.339 992 HA ARG 126 HA ARG 126 108.069 -7.198 -3.543 993 HB2 ARG 126 HB2 ARG 126 107.078 -5.526 -1.598 994 HB3 ARG 126 HB3 ARG 126 107.690 -4.344 -2.779 995 HG2 ARG 126 HG3 ARG 126 106.400 -5.451 -4.573 996 HG3 ARG 126 HG2 ARG 126 105.811 -6.664 -3.411 997 HD2 ARG 126 HD2 ARG 126 105.263 -3.665 -3.384 998 HD3 ARG 126 HD3 ARG 126 104.086 -4.973 -3.654 999 HE ARG 126 HE ARG 126 105.108 -5.594 -1.147 1000 HH11 ARG 126 HH11 ARG 126 104.276 -4.730 0.768 1001 HH12 ARG 126 HH12 ARG 126 103.450 -3.188 0.746 1002 HH21 ARG 126 HH21 ARG 126 103.857 -2.730 -2.682 1003 HH22 ARG 126 HH22 ARG 126 103.213 -2.060 -1.200 1004 H ILE 127 H ILE 127 109.343 -7.037 -5.346 1005 HA ILE 127 HA ILE 127 111.354 -4.785 -5.386 1006 HB ILE 127 HB ILE 127 111.276 -7.245 -7.172 1007 HG12 ILE 127 HG13 ILE 127 113.384 -7.471 -5.309 1008 HG13 ILE 127 HG12 ILE 127 111.972 -6.975 -4.345 1009 HG21 ILE 127 HG21 ILE 127 113.662 -6.659 -7.515 1010 HG22 ILE 127 HG22 ILE 127 112.595 -5.317 -7.993 1011 HG23 ILE 127 HG23 ILE 127 113.467 -5.250 -6.443 1012 HD11 ILE 127 HD11 ILE 127 112.096 -9.445 -4.537 1013 HD12 ILE 127 HD12 ILE 127 112.054 -9.309 -6.311 1014 HD13 ILE 127 HD13 ILE 127 110.642 -8.813 -5.347 1015 H PHE 128 H PHE 128 111.181 -3.182 -6.826 1016 HA PHE 128 HA PHE 128 108.991 -3.401 -8.884 1017 HB2 PHE 128 HB2 PHE 128 110.564 -0.900 -8.151 1018 HB3 PHE 128 HB3 PHE 128 108.975 -1.005 -8.943 1019 HD1 PHE 128 HD1 PHE 128 108.175 -3.374 -6.978 1020 HD2 PHE 128 HD2 PHE 128 109.590 0.632 -6.427 1021 HE1 PHE 128 HE1 PHE 128 107.039 -3.284 -4.779 1022 HE2 PHE 128 HE2 PHE 128 108.464 0.727 -4.216 1023 HZ PHE 128 HZ PHE 128 107.186 -1.233 -3.392 1024 H LYS 129 H LYS 129 109.615 -2.010 -10.951 1025 HA LYS 129 HA LYS 129 112.450 -2.087 -11.724 1026 HB2 LYS 129 HB2 LYS 129 111.693 -4.533 -11.851 1027 HB3 LYS 129 HB3 LYS 129 110.600 -4.030 -13.162 1028 HG2 LYS 129 HG3 LYS 129 112.569 -3.098 -14.397 1029 HG3 LYS 129 HG2 LYS 129 113.634 -3.712 -13.111 1030 HD2 LYS 129 HD2 LYS 129 112.453 -6.011 -13.581 1031 HD3 LYS 129 HD3 LYS 129 111.992 -5.261 -15.128 1032 HE2 LYS 129 HE2 LYS 129 114.064 -6.345 -15.579 1033 HE3 LYS 129 HE3 LYS 129 114.492 -4.631 -15.361 1034 HZ1 LYS 129 HZ1 LYS 129 115.899 -6.232 -14.120 1035 HZ2 LYS 129 HZ2 LYS 129 115.196 -5.083 -13.168 1036 HZ3 LYS 129 HZ3 LYS 129 114.595 -6.619 -13.187 1037 H LYS 130 H LYS 130 112.745 -1.213 -13.912 1038 HA LYS 130 HA LYS 130 111.115 0.998 -14.519 1039 HB2 LYS 130 HB3 LYS 130 111.984 0.615 -16.953 1040 HB3 LYS 130 HB2 LYS 130 113.179 0.888 -15.663 1041 HG2 LYS 130 HG2 LYS 130 113.777 -1.395 -15.563 1042 HG3 LYS 130 HG3 LYS 130 112.278 -1.919 -16.368 1043 HD2 LYS 130 HD2 LYS 130 113.021 -1.141 -18.495 1044 HD3 LYS 130 HD3 LYS 130 114.324 -0.166 -17.774 1045 HE2 LYS 130 HE3 LYS 130 114.187 -3.205 -17.582 1046 HE3 LYS 130 HE2 LYS 130 115.097 -2.338 -18.842 1047 HZ1 LYS 130 HZ1 LYS 130 116.489 -2.890 -16.960 1048 HZ2 LYS 130 HZ2 LYS 130 116.349 -1.252 -17.100 1049 HZ3 LYS 130 HZ3 LYS 130 115.505 -2.055 -15.932 1050 H ASP 131 H ASP 131 109.116 1.276 -15.382 1051 HA ASP 131 HA ASP 131 107.241 -0.786 -15.720 1052 HB2 ASP 131 HB3 ASP 131 106.578 1.566 -15.742 1053 HB3 ASP 131 HB2 ASP 131 107.454 1.834 -17.268 Start of MODEL 19 1 H1 ALA 1 H1 ALA 1 118.142 7.839 -8.801 2 H2 ALA 1 H2 ALA 1 119.031 8.322 -7.499 3 H3 ALA 1 H3 ALA 1 117.470 8.828 -7.665 4 HA ALA 1 HA ALA 1 118.332 6.040 -7.218 5 HB1 ALA 1 HB1 ALA 1 117.249 6.329 -5.006 6 HB2 ALA 1 HB2 ALA 1 116.900 8.029 -5.400 7 HB3 ALA 1 HB3 ALA 1 118.585 7.485 -5.219 8 H PHE 2 H PHE 2 116.983 4.920 -8.582 9 HA PHE 2 HA PHE 2 114.952 4.334 -9.680 10 HB2 PHE 2 HB3 PHE 2 114.777 3.981 -6.916 11 HB3 PHE 2 HB2 PHE 2 113.289 4.874 -7.306 12 HD1 PHE 2 HD1 PHE 2 115.328 2.185 -9.002 13 HD2 PHE 2 HD2 PHE 2 111.468 3.495 -7.649 14 HE1 PHE 2 HE1 PHE 2 114.305 0.114 -9.910 15 HE2 PHE 2 HE2 PHE 2 110.448 1.425 -8.556 16 HZ PHE 2 HZ PHE 2 111.868 -0.266 -9.683 17 H ASP 3 H ASP 3 115.667 7.181 -9.833 18 HA ASP 3 HA ASP 3 113.181 8.709 -9.412 19 HB2 ASP 3 HB2 ASP 3 114.488 10.388 -10.938 20 HB3 ASP 3 HB3 ASP 3 115.134 10.034 -9.318 21 H SER 4 H SER 4 111.533 7.666 -10.601 22 HA SER 4 HA SER 4 110.976 8.490 -13.204 23 HB2 SER 4 HB3 SER 4 112.736 7.530 -14.353 24 HB3 SER 4 HB2 SER 4 112.938 6.223 -13.162 25 HG SER 4 HG SER 4 112.009 5.578 -15.247 26 H THR 5 H THR 5 109.827 6.258 -14.436 27 HA THR 5 HA THR 5 107.695 5.636 -12.437 28 HB THR 5 HB THR 5 107.898 4.956 -15.406 29 HG1 THR 5 HG1 THR 5 106.450 6.759 -15.571 30 HG21 THR 5 HG21 THR 5 105.456 4.587 -15.205 31 HG22 THR 5 HG22 THR 5 105.548 4.929 -13.460 32 HG23 THR 5 HG23 THR 5 106.358 3.492 -14.130 33 H TRP 6 H TRP 6 107.156 3.519 -11.797 34 HA TRP 6 HA TRP 6 108.803 1.265 -12.858 35 HB2 TRP 6 HB3 TRP 6 108.776 1.833 -9.874 36 HB3 TRP 6 HB2 TRP 6 109.781 0.665 -10.764 37 HD1 TRP 6 HD1 TRP 6 109.294 4.485 -10.417 38 HE1 TRP 6 HE1 TRP 6 111.537 5.660 -10.911 39 HE3 TRP 6 HE3 TRP 6 112.043 0.423 -11.812 40 HZ2 TRP 6 HZ2 TRP 6 114.177 4.909 -11.813 41 HZ3 TRP 6 HZ3 TRP 6 114.411 0.670 -12.479 42 HH2 TRP 6 HH2 TRP 6 115.486 2.906 -12.482 43 H LYS 7 H LYS 7 108.063 -0.851 -11.771 44 HA LYS 7 HA LYS 7 105.362 -0.682 -10.523 45 HB2 LYS 7 HB2 LYS 7 104.174 -1.819 -12.232 46 HB3 LYS 7 HB3 LYS 7 105.134 -0.606 -13.111 47 HG2 LYS 7 HG2 LYS 7 106.939 -2.462 -13.312 48 HG3 LYS 7 HG3 LYS 7 105.643 -3.588 -12.840 49 HD2 LYS 7 HD3 LYS 7 104.285 -2.916 -14.742 50 HD3 LYS 7 HD2 LYS 7 105.428 -1.617 -15.156 51 HE2 LYS 7 HE2 LYS 7 105.985 -3.388 -16.642 52 HE3 LYS 7 HE3 LYS 7 107.203 -3.498 -15.349 53 HZ1 LYS 7 HZ1 LYS 7 106.238 -5.643 -15.847 54 HZ2 LYS 7 HZ2 LYS 7 104.722 -5.090 -15.508 55 HZ3 LYS 7 HZ3 LYS 7 105.850 -5.192 -14.309 56 H VAL 8 H VAL 8 105.090 -2.378 -9.122 57 HA VAL 8 HA VAL 8 107.122 -4.036 -8.263 58 HB VAL 8 HB VAL 8 105.222 -4.290 -6.971 59 HG11 VAL 8 HG11 VAL 8 102.957 -4.861 -8.093 60 HG12 VAL 8 HG12 VAL 8 103.595 -3.215 -8.320 61 HG13 VAL 8 HG13 VAL 8 103.755 -4.419 -9.622 62 HG21 VAL 8 HG21 VAL 8 106.158 -6.564 -7.655 63 HG22 VAL 8 HG22 VAL 8 104.471 -6.576 -7.089 64 HG23 VAL 8 HG23 VAL 8 104.826 -6.668 -8.831 65 H ASP 9 H ASP 9 108.522 -5.069 -9.564 66 HA ASP 9 HA ASP 9 107.465 -6.618 -11.902 67 HB2 ASP 9 HB3 ASP 9 109.617 -5.091 -11.858 68 HB3 ASP 9 HB2 ASP 9 110.372 -6.494 -11.064 69 H ARG 10 H ARG 10 108.807 -6.978 -8.674 70 HA ARG 10 HA ARG 10 108.050 -9.860 -8.764 71 HB2 ARG 10 HB3 ARG 10 110.908 -8.939 -8.243 72 HB3 ARG 10 HB2 ARG 10 110.296 -10.563 -7.849 73 HG2 ARG 10 HG2 ARG 10 109.516 -10.639 -10.332 74 HG3 ARG 10 HG3 ARG 10 110.627 -9.269 -10.571 75 HD2 ARG 10 HD3 ARG 10 111.259 -12.110 -9.733 76 HD3 ARG 10 HD2 ARG 10 111.993 -11.135 -11.029 77 HE ARG 10 HE ARG 10 112.485 -9.873 -8.462 78 HH11 ARG 10 HH11 ARG 10 114.564 -10.096 -7.600 79 HH12 ARG 10 HH12 ARG 10 115.622 -11.361 -8.185 80 HH21 ARG 10 HH21 ARG 10 113.302 -12.599 -10.467 81 HH22 ARG 10 HH22 ARG 10 114.910 -12.772 -9.801 82 H SER 11 H SER 11 108.530 -10.855 -6.486 83 HA SER 11 HA SER 11 108.778 -9.048 -4.217 84 HB2 SER 11 HB3 SER 11 105.972 -9.874 -5.072 85 HB3 SER 11 HB2 SER 11 106.368 -9.303 -3.433 86 HG SER 11 HG SER 11 105.852 -7.461 -4.486 87 H GLU 12 H GLU 12 107.798 -10.317 -2.153 88 HA GLU 12 HA GLU 12 107.773 -13.255 -2.562 89 HB2 GLU 12 HB2 GLU 12 109.855 -13.790 -1.785 90 HB3 GLU 12 HB3 GLU 12 110.267 -12.149 -2.333 91 HG2 GLU 12 HG2 GLU 12 109.578 -11.346 0.008 92 HG3 GLU 12 HG3 GLU 12 109.560 -13.062 0.483 93 H ASN 13 H ASN 13 107.163 -14.402 -0.624 94 HA ASN 13 HA ASN 13 105.883 -14.605 1.346 95 HB2 ASN 13 HB2 ASN 13 107.700 -12.259 1.932 96 HB3 ASN 13 HB3 ASN 13 106.444 -12.726 3.104 97 HD21 ASN 13 HD21 ASN 13 108.259 -13.376 4.584 98 HD22 ASN 13 HD22 ASN 13 109.049 -14.916 4.326 99 H TYR 14 H TYR 14 105.730 -11.346 2.296 100 HA TYR 14 HA TYR 14 104.037 -9.706 2.063 101 HB2 TYR 14 HB2 TYR 14 104.160 -10.768 -0.466 102 HB3 TYR 14 HB3 TYR 14 102.481 -11.152 -0.017 103 HD1 TYR 14 HD1 TYR 14 104.618 -8.237 1.001 104 HD2 TYR 14 HD2 TYR 14 101.171 -9.583 -1.183 105 HE1 TYR 14 HE1 TYR 14 103.966 -5.883 0.578 106 HE2 TYR 14 HE2 TYR 14 100.518 -7.227 -1.603 107 HH TYR 14 HH TYR 14 102.080 -4.553 -0.020 108 H ASP 15 H ASP 15 102.701 -13.012 1.483 109 HA ASP 15 HA ASP 15 100.228 -12.488 2.854 110 HB2 ASP 15 HB2 ASP 15 100.490 -15.108 3.347 111 HB3 ASP 15 HB3 ASP 15 100.147 -14.505 1.708 112 H LYS 16 H LYS 16 103.306 -13.896 4.054 113 HA LYS 16 HA LYS 16 102.438 -14.147 6.789 114 HB2 LYS 16 HB2 LYS 16 105.250 -13.471 5.816 115 HB3 LYS 16 HB3 LYS 16 104.806 -14.252 7.353 116 HG2 LYS 16 HG2 LYS 16 103.740 -16.110 5.971 117 HG3 LYS 16 HG3 LYS 16 104.496 -15.373 4.538 118 HD2 LYS 16 HD3 LYS 16 106.154 -16.891 5.138 119 HD3 LYS 16 HD2 LYS 16 106.681 -15.471 6.072 120 HE2 LYS 16 HE2 LYS 16 105.221 -16.395 7.989 121 HE3 LYS 16 HE3 LYS 16 105.151 -17.908 7.054 122 HZ1 LYS 16 HZ1 LYS 16 106.976 -17.913 8.620 123 HZ2 LYS 16 HZ2 LYS 16 107.555 -17.956 7.077 124 HZ3 LYS 16 HZ3 LYS 16 107.620 -16.554 7.943 125 H PHE 17 H PHE 17 103.672 -11.421 4.896 126 HA PHE 17 HA PHE 17 103.993 -9.642 7.200 127 HB2 PHE 17 HB3 PHE 17 105.145 -9.189 5.097 128 HB3 PHE 17 HB2 PHE 17 103.598 -9.134 4.220 129 HD1 PHE 17 HD1 PHE 17 105.834 -7.388 6.528 130 HD2 PHE 17 HD2 PHE 17 102.061 -7.227 4.498 131 HE1 PHE 17 HE1 PHE 17 105.668 -4.971 7.045 132 HE2 PHE 17 HE2 PHE 17 101.883 -4.807 5.018 133 HZ PHE 17 HZ PHE 17 103.690 -3.677 6.290 134 H MET 18 H MET 18 101.614 -9.616 4.524 135 HA MET 18 HA MET 18 99.760 -7.853 5.801 136 HB2 MET 18 HB2 MET 18 99.187 -10.150 3.873 137 HB3 MET 18 HB3 MET 18 98.076 -8.809 4.243 138 HG2 MET 18 HG2 MET 18 100.867 -8.515 3.042 139 HG3 MET 18 HG3 MET 18 99.337 -8.394 2.140 140 HE1 MET 18 HE1 MET 18 100.560 -4.721 2.206 141 HE2 MET 18 HE2 MET 18 101.544 -6.199 2.084 142 HE3 MET 18 HE3 MET 18 99.991 -6.091 1.222 143 H GLU 19 H GLU 19 100.453 -11.244 6.373 144 HA GLU 19 HA GLU 19 97.896 -11.767 7.748 145 HB2 GLU 19 HB2 GLU 19 99.247 -13.591 6.726 146 HB3 GLU 19 HB3 GLU 19 100.554 -13.261 7.888 147 HG2 GLU 19 HG2 GLU 19 98.941 -13.717 9.759 148 HG3 GLU 19 HG3 GLU 19 97.715 -14.163 8.549 149 H LYS 20 H LYS 20 101.196 -10.804 8.684 150 HA LYS 20 HA LYS 20 100.769 -11.045 11.540 151 HB2 LYS 20 HB2 LYS 20 102.638 -9.311 9.875 152 HB3 LYS 20 HB3 LYS 20 102.673 -9.343 11.655 153 HG2 LYS 20 HG3 LYS 20 102.745 -11.952 10.141 154 HG3 LYS 20 HG2 LYS 20 104.230 -10.977 10.252 155 HD2 LYS 20 HD2 LYS 20 103.952 -10.909 12.741 156 HD3 LYS 20 HD3 LYS 20 102.541 -11.983 12.585 157 HE2 LYS 20 HE3 LYS 20 103.842 -13.811 11.902 158 HE3 LYS 20 HE2 LYS 20 105.175 -12.777 11.331 159 HZ1 LYS 20 HZ1 LYS 20 105.715 -13.858 13.411 160 HZ2 LYS 20 HZ2 LYS 20 104.406 -13.182 14.153 161 HZ3 LYS 20 HZ3 LYS 20 105.641 -12.224 13.625 162 H MET 21 H MET 21 100.238 -8.393 9.210 163 HA MET 21 HA MET 21 99.500 -6.423 11.208 164 HB2 MET 21 HB2 MET 21 99.011 -6.764 8.245 165 HB3 MET 21 HB3 MET 21 98.153 -5.486 9.139 166 HG2 MET 21 HG3 MET 21 100.103 -4.311 9.604 167 HG3 MET 21 HG2 MET 21 101.118 -5.773 9.568 168 HE1 MET 21 HE1 MET 21 99.161 -3.791 5.918 169 HE2 MET 21 HE2 MET 21 98.566 -3.885 7.593 170 HE3 MET 21 HE3 MET 21 98.507 -5.324 6.546 171 H GLY 22 H GLY 22 97.999 -9.315 10.252 172 HA2 GLY 22 HA2 GLY 22 95.966 -10.186 11.180 173 HA3 GLY 22 HA3 GLY 22 95.571 -8.566 11.801 174 H VAL 23 H VAL 23 96.525 -9.131 8.449 175 HA VAL 23 HA VAL 23 93.979 -7.922 7.550 176 HB VAL 23 HB VAL 23 96.170 -9.211 5.867 177 HG11 VAL 23 HG11 VAL 23 94.032 -8.727 4.707 178 HG12 VAL 23 HG12 VAL 23 94.096 -7.047 5.291 179 HG13 VAL 23 HG13 VAL 23 95.324 -7.639 4.146 180 HG21 VAL 23 HG21 VAL 23 95.996 -6.249 6.391 181 HG22 VAL 23 HG22 VAL 23 96.754 -7.288 7.620 182 HG23 VAL 23 HG23 VAL 23 97.410 -7.242 5.966 183 H ASN 24 H ASN 24 92.160 -9.043 7.041 184 HA ASN 24 HA ASN 24 91.719 -11.757 7.505 185 HB2 ASN 24 HB2 ASN 24 90.547 -9.937 5.369 186 HB3 ASN 24 HB3 ASN 24 89.960 -11.598 5.626 187 HD21 ASN 24 HD21 ASN 24 90.486 -8.460 7.345 188 HD22 ASN 24 HD22 ASN 24 89.223 -8.730 8.525 189 H ILE 25 H ILE 25 91.400 -13.578 5.881 190 HA ILE 25 HA ILE 25 93.898 -13.843 4.322 191 HB ILE 25 HB ILE 25 91.568 -15.615 5.027 192 HG12 ILE 25 HG12 ILE 25 93.822 -15.271 6.313 193 HG13 ILE 25 HG13 ILE 25 93.231 -16.930 6.058 194 HG21 ILE 25 HG21 ILE 25 92.597 -17.378 3.513 195 HG22 ILE 25 HG22 ILE 25 91.759 -16.060 2.660 196 HG23 ILE 25 HG23 ILE 25 93.537 -16.074 2.749 197 HD11 ILE 25 HD11 ILE 25 95.740 -16.377 5.512 198 HD12 ILE 25 HD12 ILE 25 94.808 -17.366 4.363 199 HD13 ILE 25 HD13 ILE 25 95.077 -15.638 4.034 200 H VAL 26 H VAL 26 91.039 -12.353 3.777 201 HA VAL 26 HA VAL 26 90.636 -13.162 0.960 202 HB VAL 26 HB VAL 26 89.551 -10.677 2.340 203 HG11 VAL 26 HG11 VAL 26 89.228 -10.864 -0.112 204 HG12 VAL 26 HG12 VAL 26 87.681 -11.033 0.751 205 HG13 VAL 26 HG13 VAL 26 88.503 -12.475 0.107 206 HG21 VAL 26 HG21 VAL 26 87.528 -12.350 2.685 207 HG22 VAL 26 HG22 VAL 26 88.802 -13.591 2.616 208 HG23 VAL 26 HG23 VAL 26 88.864 -12.320 3.861 209 H LYS 27 H LYS 27 91.541 -10.054 2.536 210 HA LYS 27 HA LYS 27 92.515 -8.892 0.060 211 HB2 LYS 27 HB2 LYS 27 92.300 -8.135 2.845 212 HB3 LYS 27 HB3 LYS 27 93.944 -7.766 2.272 213 HG2 LYS 27 HG3 LYS 27 92.575 -5.831 1.798 214 HG3 LYS 27 HG2 LYS 27 92.874 -6.651 0.246 215 HD2 LYS 27 HD3 LYS 27 90.570 -6.333 0.110 216 HD3 LYS 27 HD2 LYS 27 90.622 -7.936 0.882 217 HE2 LYS 27 HE2 LYS 27 89.155 -6.811 2.308 218 HE3 LYS 27 HE3 LYS 27 90.709 -6.503 3.119 219 HZ1 LYS 27 HZ1 LYS 27 89.433 -4.483 2.844 220 HZ2 LYS 27 HZ2 LYS 27 90.822 -4.399 1.959 221 HZ3 LYS 27 HZ3 LYS 27 89.382 -4.685 1.208 222 H ARG 28 H ARG 28 93.837 -11.148 2.355 223 HA ARG 28 HA ARG 28 96.653 -10.705 1.662 224 HB2 ARG 28 HB2 ARG 28 95.765 -11.848 3.768 225 HB3 ARG 28 HB3 ARG 28 95.390 -13.256 2.746 226 HG2 ARG 28 HG2 ARG 28 97.891 -13.009 1.957 227 HG3 ARG 28 HG3 ARG 28 98.083 -12.080 3.462 228 HD2 ARG 28 HD3 ARG 28 98.560 -14.261 4.184 229 HD3 ARG 28 HD2 ARG 28 96.824 -14.128 4.554 230 HE ARG 28 HE ARG 28 96.805 -15.147 1.972 231 HH11 ARG 28 HH11 ARG 28 96.927 -17.359 1.522 232 HH12 ARG 28 HH12 ARG 28 97.692 -18.443 2.662 233 HH21 ARG 28 HH21 ARG 28 98.463 -15.920 4.935 234 HH22 ARG 28 HH22 ARG 28 98.558 -17.632 4.586 235 H LYS 29 H LYS 29 94.126 -13.042 0.631 236 HA LYS 29 HA LYS 29 95.917 -14.418 -1.227 237 HB2 LYS 29 HB2 LYS 29 92.929 -14.322 -0.778 238 HB3 LYS 29 HB3 LYS 29 93.578 -15.103 -2.240 239 HG2 LYS 29 HG3 LYS 29 94.926 -16.622 -0.902 240 HG3 LYS 29 HG2 LYS 29 94.492 -15.760 0.593 241 HD2 LYS 29 HD3 LYS 29 93.167 -17.875 0.232 242 HD3 LYS 29 HD2 LYS 29 92.154 -16.416 0.354 243 HE2 LYS 29 HE2 LYS 29 91.687 -16.389 -1.948 244 HE3 LYS 29 HE3 LYS 29 93.125 -17.358 -2.352 245 HZ1 LYS 29 HZ1 LYS 29 91.106 -18.658 -2.494 246 HZ2 LYS 29 HZ2 LYS 29 92.072 -19.242 -1.291 247 HZ3 LYS 29 HZ3 LYS 29 90.740 -18.344 -0.917 248 H LEU 30 H LEU 30 93.742 -11.628 -1.445 249 HA LEU 30 HA LEU 30 94.119 -11.486 -4.395 250 HB2 LEU 30 HB3 LEU 30 92.592 -9.841 -2.360 251 HB3 LEU 30 HB2 LEU 30 92.840 -9.249 -4.020 252 HG LEU 30 HG LEU 30 91.840 -12.064 -3.609 253 HD11 LEU 30 HD11 LEU 30 90.407 -10.659 -2.150 254 HD12 LEU 30 HD12 LEU 30 89.510 -11.215 -3.583 255 HD13 LEU 30 HD13 LEU 30 90.120 -9.544 -3.507 256 HD21 LEU 30 HD21 LEU 30 92.449 -11.234 -5.866 257 HD22 LEU 30 HD22 LEU 30 91.312 -9.879 -5.674 258 HD23 LEU 30 HD23 LEU 30 90.701 -11.550 -5.751 259 H ALA 31 H ALA 31 95.715 -10.499 -1.607 260 HA ALA 31 HA ALA 31 96.886 -8.024 -2.710 261 HB1 ALA 31 HB1 ALA 31 98.532 -8.508 -0.699 262 HB2 ALA 31 HB2 ALA 31 97.313 -9.724 -0.250 263 HB3 ALA 31 HB3 ALA 31 96.857 -8.007 -0.368 264 H ALA 32 H ALA 32 98.001 -11.397 -2.176 265 HA ALA 32 HA ALA 32 100.668 -11.230 -2.963 266 HB1 ALA 32 HB1 ALA 32 100.420 -13.493 -3.945 267 HB2 ALA 32 HB2 ALA 32 99.528 -13.360 -2.410 268 HB3 ALA 32 HB3 ALA 32 98.652 -13.293 -3.958 269 H HIS 33 H HIS 33 97.859 -10.546 -4.925 270 HA HIS 33 HA HIS 33 99.168 -10.850 -7.517 271 HB2 HIS 33 HB2 HIS 33 96.791 -9.155 -6.629 272 HB3 HIS 33 HB3 HIS 33 97.285 -9.384 -8.324 273 HD2 HIS 33 HD2 HIS 33 97.772 -12.672 -6.460 274 HE1 HIS 33 HE1 HIS 33 93.909 -12.895 -8.154 275 HE2 HIS 33 HE2 HIS 33 95.747 -14.252 -7.013 276 H ASP 34 H ASP 34 100.864 -9.471 -5.636 277 HA ASP 34 HA ASP 34 100.875 -6.644 -5.821 278 HB2 ASP 34 HB2 ASP 34 103.414 -8.281 -6.118 279 HB3 ASP 34 HB3 ASP 34 103.179 -6.741 -5.256 280 H ASN 35 H ASN 35 100.194 -5.852 -7.828 281 HA ASN 35 HA ASN 35 102.289 -5.971 -9.965 282 HB2 ASN 35 HB2 ASN 35 99.438 -6.963 -10.231 283 HB3 ASN 35 HB3 ASN 35 100.286 -6.275 -11.637 284 HD21 ASN 35 HD21 ASN 35 102.494 -7.298 -12.145 285 HD22 ASN 35 HD22 ASN 35 102.685 -9.004 -11.809 286 H LEU 36 H LEU 36 101.647 -3.846 -8.209 287 HA LEU 36 HA LEU 36 99.866 -2.061 -9.838 288 HB2 LEU 36 HB3 LEU 36 99.895 -0.566 -7.912 289 HB3 LEU 36 HB2 LEU 36 99.534 -2.217 -7.360 290 HG LEU 36 HG LEU 36 102.424 -1.450 -7.435 291 HD11 LEU 36 HD11 LEU 36 101.364 0.606 -6.538 292 HD12 LEU 36 HD12 LEU 36 102.251 -0.265 -5.264 293 HD13 LEU 36 HD13 LEU 36 100.476 -0.373 -5.346 294 HD21 LEU 36 HD21 LEU 36 101.629 -3.664 -6.644 295 HD22 LEU 36 HD22 LEU 36 100.630 -2.863 -5.408 296 HD23 LEU 36 HD23 LEU 36 102.405 -2.755 -5.325 297 H LYS 37 H LYS 37 100.629 0.289 -9.951 298 HA LYS 37 HA LYS 37 103.507 0.277 -10.874 299 HB2 LYS 37 HB2 LYS 37 101.333 0.874 -12.358 300 HB3 LYS 37 HB3 LYS 37 101.598 2.472 -11.622 301 HG2 LYS 37 HG2 LYS 37 104.084 2.154 -12.327 302 HG3 LYS 37 HG3 LYS 37 103.468 0.865 -13.389 303 HD2 LYS 37 HD2 LYS 37 101.708 2.737 -14.089 304 HD3 LYS 37 HD3 LYS 37 102.977 3.838 -13.501 305 HE2 LYS 37 HE3 LYS 37 103.510 3.556 -15.790 306 HE3 LYS 37 HE2 LYS 37 104.592 2.405 -14.968 307 HZ1 LYS 37 HZ1 LYS 37 103.460 1.389 -16.830 308 HZ2 LYS 37 HZ2 LYS 37 101.985 1.740 -16.183 309 HZ3 LYS 37 HZ3 LYS 37 102.987 0.674 -15.422 310 H LEU 38 H LEU 38 104.913 1.867 -10.099 311 HA LEU 38 HA LEU 38 103.736 3.908 -8.219 312 HB2 LEU 38 HB3 LEU 38 106.249 2.345 -7.522 313 HB3 LEU 38 HB2 LEU 38 105.284 3.407 -6.471 314 HG LEU 38 HG LEU 38 103.360 1.635 -7.149 315 HD11 LEU 38 HD11 LEU 38 104.886 0.304 -8.584 316 HD12 LEU 38 HD12 LEU 38 105.965 0.045 -7.192 317 HD13 LEU 38 HD13 LEU 38 104.325 -0.647 -7.188 318 HD21 LEU 38 HD21 LEU 38 104.078 2.242 -4.851 319 HD22 LEU 38 HD22 LEU 38 103.854 0.484 -5.010 320 HD23 LEU 38 HD23 LEU 38 105.494 1.175 -5.014 321 H THR 39 H THR 39 104.558 5.893 -8.635 322 HA THR 39 HA THR 39 107.035 6.018 -10.355 323 HB THR 39 HB THR 39 104.725 7.923 -9.847 324 HG1 THR 39 HG1 THR 39 104.709 7.809 -12.162 325 HG21 THR 39 HG21 THR 39 106.147 9.428 -11.475 326 HG22 THR 39 HG22 THR 39 106.494 9.462 -9.730 327 HG23 THR 39 HG23 THR 39 107.526 8.509 -10.824 328 H ILE 40 H ILE 40 108.897 6.404 -9.250 329 HA ILE 40 HA ILE 40 108.644 7.813 -6.594 330 HB ILE 40 HB ILE 40 110.860 6.080 -7.768 331 HG12 ILE 40 HG12 ILE 40 110.152 4.753 -5.614 332 HG13 ILE 40 HG13 ILE 40 108.653 5.705 -5.726 333 HG21 ILE 40 HG21 ILE 40 111.915 6.313 -5.535 334 HG22 ILE 40 HG22 ILE 40 111.766 7.895 -6.337 335 HG23 ILE 40 HG23 ILE 40 110.629 7.442 -5.045 336 HD11 ILE 40 HD11 ILE 40 109.116 3.322 -7.052 337 HD12 ILE 40 HD12 ILE 40 107.915 4.541 -7.541 338 HD13 ILE 40 HD13 ILE 40 109.525 4.524 -8.299 339 H THR 41 H THR 41 109.241 9.891 -6.487 340 HA THR 41 HA THR 41 111.267 10.876 -8.508 341 HB THR 41 HB THR 41 109.342 12.743 -7.135 342 HG1 THR 41 HG1 THR 41 107.914 11.231 -7.903 343 HG21 THR 41 HG21 THR 41 109.548 13.922 -9.306 344 HG22 THR 41 HG22 THR 41 110.542 12.587 -9.936 345 HG23 THR 41 HG23 THR 41 111.149 13.595 -8.601 346 H GLN 42 H GLN 42 112.824 12.416 -7.677 347 HA GLN 42 HA GLN 42 112.937 12.455 -4.649 348 HB2 GLN 42 HB2 GLN 42 115.360 12.203 -4.777 349 HB3 GLN 42 HB3 GLN 42 114.602 10.875 -5.688 350 HG2 GLN 42 HG3 GLN 42 114.847 12.382 -7.769 351 HG3 GLN 42 HG2 GLN 42 115.929 13.385 -6.774 352 HE21 GLN 42 HE21 GLN 42 117.507 12.573 -8.594 353 HE22 GLN 42 HE22 GLN 42 118.336 11.068 -8.265 354 H GLU 43 H GLU 43 113.651 14.402 -3.706 355 HA GLU 43 HA GLU 43 114.391 16.608 -5.619 356 HB2 GLU 43 HB3 GLU 43 112.410 17.097 -3.376 357 HB3 GLU 43 HB2 GLU 43 112.748 18.104 -4.804 358 HG2 GLU 43 HG2 GLU 43 111.751 16.404 -6.274 359 HG3 GLU 43 HG3 GLU 43 111.482 15.327 -4.883 360 H GLY 44 H GLY 44 116.517 16.095 -4.646 361 HA2 GLY 44 HA2 GLY 44 118.223 16.499 -3.065 362 HA3 GLY 44 HA3 GLY 44 117.310 17.975 -2.682 363 H ASN 45 H ASN 45 115.596 17.803 -1.030 364 HA ASN 45 HA ASN 45 116.146 15.521 0.885 365 HB2 ASN 45 HB3 ASN 45 115.748 18.486 1.410 366 HB3 ASN 45 HB2 ASN 45 115.531 17.262 2.684 367 HD21 ASN 45 HD21 ASN 45 117.456 15.822 3.146 368 HD22 ASN 45 HD22 ASN 45 119.058 16.459 2.850 369 H LYS 46 H LYS 46 114.023 15.836 -1.208 370 HA LYS 46 HA LYS 46 111.759 15.203 0.609 371 HB2 LYS 46 HB3 LYS 46 111.904 17.673 -1.104 372 HB3 LYS 46 HB2 LYS 46 110.357 16.798 -1.042 373 HG2 LYS 46 HG2 LYS 46 109.913 17.754 0.956 374 HG3 LYS 46 HG3 LYS 46 111.351 16.962 1.642 375 HD2 LYS 46 HD2 LYS 46 112.762 18.829 1.042 376 HD3 LYS 46 HD3 LYS 46 111.468 19.568 0.068 377 HE2 LYS 46 HE2 LYS 46 110.086 19.750 2.177 378 HE3 LYS 46 HE3 LYS 46 111.505 19.192 3.095 379 HZ1 LYS 46 HZ1 LYS 46 111.379 21.592 3.024 380 HZ2 LYS 46 HZ2 LYS 46 112.725 21.073 2.224 381 HZ3 LYS 46 HZ3 LYS 46 111.409 21.590 1.375 382 H PHE 47 H PHE 47 111.307 13.265 -0.188 383 HA PHE 47 HA PHE 47 111.526 12.789 -3.138 384 HB2 PHE 47 HB2 PHE 47 111.335 11.052 -0.679 385 HB3 PHE 47 HB3 PHE 47 110.832 10.384 -2.250 386 HD1 PHE 47 HD1 PHE 47 113.625 12.513 -0.879 387 HD2 PHE 47 HD2 PHE 47 112.476 9.277 -3.459 388 HE1 PHE 47 HE1 PHE 47 116.002 12.156 -1.489 389 HE2 PHE 47 HE2 PHE 47 114.854 8.918 -4.067 390 HZ PHE 47 HZ PHE 47 116.617 10.359 -3.084 391 H THR 48 H THR 48 109.674 11.270 -3.997 392 HA THR 48 HA THR 48 107.033 11.841 -2.769 393 HB THR 48 HB THR 48 107.793 12.926 -5.519 394 HG1 THR 48 HG1 THR 48 108.458 14.266 -3.804 395 HG21 THR 48 HG21 THR 48 105.461 13.763 -5.562 396 HG22 THR 48 HG22 THR 48 105.144 12.961 -4.006 397 HG23 THR 48 HG23 THR 48 105.501 11.987 -5.452 398 H VAL 49 H VAL 49 106.484 9.718 -2.743 399 HA VAL 49 HA VAL 49 106.898 8.100 -5.241 400 HB VAL 49 HB VAL 49 105.937 7.258 -2.470 401 HG11 VAL 49 HG11 VAL 49 106.422 4.974 -3.304 402 HG12 VAL 49 HG12 VAL 49 106.862 5.647 -4.892 403 HG13 VAL 49 HG13 VAL 49 105.186 5.771 -4.307 404 HG21 VAL 49 HG21 VAL 49 108.226 6.331 -2.230 405 HG22 VAL 49 HG22 VAL 49 108.271 8.095 -2.466 406 HG23 VAL 49 HG23 VAL 49 108.665 7.006 -3.818 407 H LYS 50 H LYS 50 105.245 8.220 -6.674 408 HA LYS 50 HA LYS 50 102.474 8.668 -5.584 409 HB2 LYS 50 HB3 LYS 50 103.854 9.168 -8.205 410 HB3 LYS 50 HB2 LYS 50 102.109 8.819 -8.243 411 HG2 LYS 50 HG3 LYS 50 101.639 10.659 -6.735 412 HG3 LYS 50 HG2 LYS 50 103.374 10.923 -6.435 413 HD2 LYS 50 HD2 LYS 50 103.743 11.707 -8.666 414 HD3 LYS 50 HD3 LYS 50 102.158 11.112 -9.217 415 HE2 LYS 50 HE2 LYS 50 102.421 13.209 -7.033 416 HE3 LYS 50 HE3 LYS 50 102.356 13.646 -8.757 417 HZ1 LYS 50 HZ1 LYS 50 100.171 13.650 -7.755 418 HZ2 LYS 50 HZ2 LYS 50 100.263 12.474 -8.908 419 HZ3 LYS 50 HZ3 LYS 50 100.323 12.069 -7.310 420 H GLU 51 H GLU 51 101.726 6.646 -4.960 421 HA GLU 51 HA GLU 51 102.281 4.240 -6.546 422 HB2 GLU 51 HB2 GLU 51 101.820 3.791 -4.278 423 HB3 GLU 51 HB3 GLU 51 100.455 4.931 -4.230 424 HG2 GLU 51 HG3 GLU 51 99.017 3.449 -5.379 425 HG3 GLU 51 HG2 GLU 51 100.370 2.487 -6.021 426 H SER 52 H SER 52 100.657 3.020 -7.771 427 HA SER 52 HA SER 52 98.118 4.366 -8.435 428 HB2 SER 52 HB3 SER 52 100.066 3.951 -10.724 429 HB3 SER 52 HB2 SER 52 98.557 4.894 -10.705 430 HG SER 52 HG SER 52 100.608 6.124 -10.522 431 H SER 53 H SER 53 96.939 2.613 -8.152 432 HA SER 53 HA SER 53 97.557 0.225 -9.876 433 HB2 SER 53 HB2 SER 53 97.672 -1.212 -8.113 434 HB3 SER 53 HB3 SER 53 97.942 0.236 -7.112 435 HG SER 53 HG SER 53 96.174 -0.744 -6.227 436 H ALA 54 H ALA 54 95.669 -0.758 -10.705 437 HA ALA 54 HA ALA 54 93.339 0.896 -10.956 438 HB1 ALA 54 HB1 ALA 54 92.226 -1.139 -11.831 439 HB2 ALA 54 HB2 ALA 54 93.868 -0.975 -12.497 440 HB3 ALA 54 HB3 ALA 54 93.551 -2.140 -11.189 441 H PHE 55 H PHE 55 94.452 -0.229 -8.136 442 HA PHE 55 HA PHE 55 91.704 -0.949 -7.111 443 HB2 PHE 55 HB2 PHE 55 94.250 -1.455 -5.570 444 HB3 PHE 55 HB3 PHE 55 92.697 -2.322 -5.499 445 HD1 PHE 55 HD1 PHE 55 95.905 -2.911 -6.339 446 HD2 PHE 55 HD2 PHE 55 92.047 -2.951 -8.228 447 HE1 PHE 55 HE1 PHE 55 96.740 -4.541 -8.010 448 HE2 PHE 55 HE2 PHE 55 92.882 -4.581 -9.899 449 HZ PHE 55 HZ PHE 55 95.228 -5.378 -9.789 450 H ARG 56 H ARG 56 94.496 1.234 -6.629 451 HA ARG 56 HA ARG 56 92.881 3.209 -5.321 452 HB2 ARG 56 HB2 ARG 56 92.680 1.607 -3.479 453 HB3 ARG 56 HB3 ARG 56 94.444 1.374 -3.448 454 HG2 ARG 56 HG3 ARG 56 94.313 2.968 -1.797 455 HG3 ARG 56 HG2 ARG 56 94.345 4.072 -3.193 456 HD2 ARG 56 HD2 ARG 56 92.473 4.825 -1.973 457 HD3 ARG 56 HD3 ARG 56 91.743 3.756 -3.194 458 HE ARG 56 HE ARG 56 91.051 2.328 -1.434 459 HH11 ARG 56 HH11 ARG 56 91.052 1.641 0.720 460 HH12 ARG 56 HH12 ARG 56 92.214 2.302 1.849 461 HH21 ARG 56 HH21 ARG 56 93.713 4.376 -0.514 462 HH22 ARG 56 HH22 ARG 56 93.715 3.844 1.152 463 H ASN 57 H ASN 57 94.304 4.274 -6.911 464 HA ASN 57 HA ASN 57 97.184 4.290 -6.620 465 HB2 ASN 57 HB2 ASN 57 97.104 6.347 -7.981 466 HB3 ASN 57 HB3 ASN 57 95.982 5.131 -8.638 467 HD21 ASN 57 HD21 ASN 57 93.809 5.402 -6.810 468 HD22 ASN 57 HD22 ASN 57 93.130 7.004 -6.994 469 H ILE 58 H ILE 58 98.546 5.579 -5.373 470 HA ILE 58 HA ILE 58 97.221 7.594 -3.571 471 HB ILE 58 HB ILE 58 99.331 5.773 -2.444 472 HG12 ILE 58 HG13 ILE 58 96.390 5.117 -2.836 473 HG13 ILE 58 HG12 ILE 58 97.806 4.135 -3.288 474 HG21 ILE 58 HG21 ILE 58 98.197 7.933 -1.397 475 HG22 ILE 58 HG22 ILE 58 96.864 6.808 -1.044 476 HG23 ILE 58 HG23 ILE 58 98.489 6.497 -0.386 477 HD11 ILE 58 HD11 ILE 58 97.168 3.121 -1.279 478 HD12 ILE 58 HD12 ILE 58 98.368 4.305 -0.709 479 HD13 ILE 58 HD13 ILE 58 96.630 4.657 -0.559 480 H GLU 59 H GLU 59 99.000 8.748 -2.267 481 HA GLU 59 HA GLU 59 101.610 8.935 -3.694 482 HB2 GLU 59 HB3 GLU 59 101.401 11.153 -4.438 483 HB3 GLU 59 HB2 GLU 59 99.792 10.486 -4.802 484 HG2 GLU 59 HG2 GLU 59 99.179 11.308 -2.387 485 HG3 GLU 59 HG3 GLU 59 100.625 12.332 -2.550 486 H CYS 60 H CYS 60 103.227 9.716 -2.331 487 HA CYS 60 HA CYS 60 102.413 11.012 0.236 488 HB2 CYS 60 HB2 CYS 60 103.748 8.281 0.059 489 HB3 CYS 60 HB3 CYS 60 103.804 9.291 1.523 490 HG CYS 60 HG CYS 60 100.669 9.359 0.712 491 H VAL 61 H VAL 61 103.935 12.486 0.827 492 HA VAL 61 HA VAL 61 106.485 12.510 -0.749 493 HB VAL 61 HB VAL 61 105.864 14.605 1.309 494 HG11 VAL 61 HG11 VAL 61 106.721 16.064 -0.518 495 HG12 VAL 61 HG12 VAL 61 107.861 14.751 -0.137 496 HG13 VAL 61 HG13 VAL 61 106.832 14.644 -1.586 497 HG21 VAL 61 HG21 VAL 61 104.383 15.713 -0.502 498 HG22 VAL 61 HG22 VAL 61 104.246 14.087 -1.211 499 HG23 VAL 61 HG23 VAL 61 103.653 14.390 0.439 500 H PHE 62 H PHE 62 108.558 12.555 0.304 501 HA PHE 62 HA PHE 62 108.479 11.828 3.231 502 HB2 PHE 62 HB2 PHE 62 110.182 10.418 1.132 503 HB3 PHE 62 HB3 PHE 62 110.119 10.049 2.871 504 HD1 PHE 62 HD1 PHE 62 107.436 9.918 3.669 505 HD2 PHE 62 HD2 PHE 62 109.059 8.858 -0.164 506 HE1 PHE 62 HE1 PHE 62 105.515 8.401 3.275 507 HE2 PHE 62 HE2 PHE 62 107.138 7.340 -0.557 508 HZ PHE 62 HZ PHE 62 105.365 7.113 1.162 509 H GLU 63 H GLU 63 110.722 11.975 4.207 510 HA GLU 63 HA GLU 63 112.682 13.661 2.769 511 HB2 GLU 63 HB2 GLU 63 111.184 15.444 3.404 512 HB3 GLU 63 HB3 GLU 63 110.989 14.778 5.043 513 HG2 GLU 63 HG3 GLU 63 113.224 15.347 5.655 514 HG3 GLU 63 HG2 GLU 63 113.700 15.624 3.962 515 H LEU 64 H LEU 64 114.560 14.184 4.327 516 HA LEU 64 HA LEU 64 114.905 11.769 6.086 517 HB2 LEU 64 HB2 LEU 64 117.005 13.805 5.237 518 HB3 LEU 64 HB3 LEU 64 117.277 12.179 5.910 519 HG LEU 64 HG LEU 64 115.983 12.835 3.225 520 HD11 LEU 64 HD11 LEU 64 118.447 13.097 3.278 521 HD12 LEU 64 HD12 LEU 64 118.606 11.462 3.962 522 HD13 LEU 64 HD13 LEU 64 117.976 11.679 2.311 523 HD21 LEU 64 HD21 LEU 64 116.368 10.189 3.113 524 HD22 LEU 64 HD22 LEU 64 114.882 10.874 3.813 525 HD23 LEU 64 HD23 LEU 64 116.200 10.330 4.879 526 H GLY 65 H GLY 65 114.664 11.995 8.242 527 HA2 GLY 65 HA2 GLY 65 115.059 12.992 10.384 528 HA3 GLY 65 HA3 GLY 65 115.716 14.434 9.578 529 H VAL 66 H VAL 66 112.601 13.165 8.560 530 HA VAL 66 HA VAL 66 111.195 15.167 10.303 531 HB VAL 66 HB VAL 66 111.018 15.114 7.257 532 HG11 VAL 66 HG11 VAL 66 108.824 15.510 8.342 533 HG12 VAL 66 HG12 VAL 66 109.546 16.801 9.331 534 HG13 VAL 66 HG13 VAL 66 109.429 16.992 7.565 535 HG21 VAL 66 HG21 VAL 66 111.846 17.467 7.495 536 HG22 VAL 66 HG22 VAL 66 112.048 17.191 9.241 537 HG23 VAL 66 HG23 VAL 66 113.025 16.267 8.075 538 H THR 67 H THR 67 109.917 13.664 11.343 539 HA THR 67 HA THR 67 108.875 11.271 10.148 540 HB THR 67 HB THR 67 107.247 12.693 12.227 541 HG1 THR 67 HG1 THR 67 109.283 13.232 12.935 542 HG21 THR 67 HG21 THR 67 107.019 10.500 13.126 543 HG22 THR 67 HG22 THR 67 106.965 10.270 11.362 544 HG23 THR 67 HG23 THR 67 108.458 9.907 12.262 545 H PHE 68 H PHE 68 107.050 10.805 9.080 546 HA PHE 68 HA PHE 68 104.962 12.903 8.705 547 HB2 PHE 68 HB2 PHE 68 105.108 12.074 6.132 548 HB3 PHE 68 HB3 PHE 68 105.967 13.514 6.724 549 HD1 PHE 68 HD1 PHE 68 106.411 9.789 6.454 550 HD2 PHE 68 HD2 PHE 68 108.256 13.665 6.370 551 HE1 PHE 68 HE1 PHE 68 108.578 8.746 5.837 552 HE2 PHE 68 HE2 PHE 68 110.422 12.622 5.767 553 HZ PHE 68 HZ PHE 68 110.581 10.164 5.496 554 H ASN 69 H ASN 69 103.366 11.594 6.868 555 HA ASN 69 HA ASN 69 103.250 8.765 7.870 556 HB2 ASN 69 HB3 ASN 69 100.856 8.993 8.432 557 HB3 ASN 69 HB2 ASN 69 101.845 10.103 9.409 558 HD21 ASN 69 HD21 ASN 69 100.379 10.210 6.076 559 HD22 ASN 69 HD22 ASN 69 99.681 11.800 6.292 560 H CYS 70 H CYS 70 102.071 7.354 6.557 561 HA CYS 70 HA CYS 70 100.905 8.452 4.026 562 HB2 CYS 70 HB3 CYS 70 103.307 7.945 3.528 563 HB3 CYS 70 HB2 CYS 70 103.047 6.276 4.089 564 HG CYS 70 HG CYS 70 101.900 5.363 1.883 565 H ASN 71 H ASN 71 99.820 6.478 2.825 566 HA ASN 71 HA ASN 71 98.879 4.559 4.968 567 HB2 ASN 71 HB3 ASN 71 96.664 4.643 3.535 568 HB3 ASN 71 HB2 ASN 71 96.998 5.925 4.725 569 HD21 ASN 71 HD21 ASN 71 96.139 5.383 1.479 570 HD22 ASN 71 HD22 ASN 71 96.596 6.945 0.838 571 H LEU 72 H LEU 72 98.635 2.436 4.366 572 HA LEU 72 HA LEU 72 99.786 1.739 1.687 573 HB2 LEU 72 HB2 LEU 72 99.012 -0.030 4.051 574 HB3 LEU 72 HB3 LEU 72 99.885 -0.559 2.593 575 HG LEU 72 HG LEU 72 100.943 1.743 4.248 576 HD11 LEU 72 HD11 LEU 72 100.552 -0.126 5.829 577 HD12 LEU 72 HD12 LEU 72 102.292 0.115 5.540 578 HD13 LEU 72 HD13 LEU 72 101.435 -1.227 4.744 579 HD21 LEU 72 HD21 LEU 72 101.921 1.260 2.019 580 HD22 LEU 72 HD22 LEU 72 103.091 0.923 3.317 581 HD23 LEU 72 HD23 LEU 72 102.234 -0.419 2.521 582 H ALA 73 H ALA 73 98.662 0.479 0.160 583 HA ALA 73 HA ALA 73 95.982 0.984 -0.364 584 HB1 ALA 73 HB1 ALA 73 95.934 -1.124 -1.670 585 HB2 ALA 73 HB2 ALA 73 97.473 -0.260 -1.902 586 HB3 ALA 73 HB3 ALA 73 97.401 -1.678 -0.828 587 H ASP 74 H ASP 74 97.263 -1.282 2.018 588 HA ASP 74 HA ASP 74 94.769 -2.725 2.445 589 HB2 ASP 74 HB2 ASP 74 97.226 -2.237 4.169 590 HB3 ASP 74 HB3 ASP 74 95.848 -3.215 4.728 591 H GLY 75 H GLY 75 94.897 0.395 2.455 592 HA2 GLY 75 HA3 GLY 75 93.696 2.088 3.586 593 HA3 GLY 75 HA2 GLY 75 92.729 0.784 4.317 594 H THR 76 H THR 76 96.225 0.892 4.680 595 HA THR 76 HA THR 76 95.793 1.331 7.622 596 HB THR 76 HB THR 76 98.518 0.699 6.696 597 HG1 THR 76 HG1 THR 76 97.400 -0.469 5.117 598 HG21 THR 76 HG21 THR 76 98.291 -1.037 8.450 599 HG22 THR 76 HG22 THR 76 96.555 -0.671 8.586 600 HG23 THR 76 HG23 THR 76 97.761 0.553 9.049 601 H GLU 77 H GLU 77 97.402 2.706 8.747 602 HA GLU 77 HA GLU 77 98.533 4.856 6.952 603 HB2 GLU 77 HB2 GLU 77 96.373 5.618 7.966 604 HB3 GLU 77 HB3 GLU 77 97.058 5.323 9.582 605 HG2 GLU 77 HG2 GLU 77 98.793 6.981 9.220 606 HG3 GLU 77 HG3 GLU 77 98.323 7.170 7.514 607 H LEU 78 H LEU 78 100.716 4.864 7.290 608 HA LEU 78 HA LEU 78 101.643 4.268 10.116 609 HB2 LEU 78 HB2 LEU 78 103.741 3.880 8.156 610 HB3 LEU 78 HB3 LEU 78 103.048 2.705 9.297 611 HG LEU 78 HG LEU 78 102.778 1.924 6.978 612 HD11 LEU 78 HD11 LEU 78 100.830 1.006 7.637 613 HD12 LEU 78 HD12 LEU 78 100.695 2.251 8.902 614 HD13 LEU 78 HD13 LEU 78 99.973 2.529 7.300 615 HD21 LEU 78 HD21 LEU 78 102.365 3.386 5.315 616 HD22 LEU 78 HD22 LEU 78 100.774 3.750 6.024 617 HD23 LEU 78 HD23 LEU 78 102.202 4.696 6.509 618 H ARG 79 H ARG 79 103.438 5.484 10.910 619 HA ARG 79 HA ARG 79 104.273 7.821 9.193 620 HB2 ARG 79 HB2 ARG 79 103.882 9.401 10.949 621 HB3 ARG 79 HB3 ARG 79 102.399 8.423 10.845 622 HG2 ARG 79 HG2 ARG 79 103.339 6.954 12.685 623 HG3 ARG 79 HG3 ARG 79 104.670 8.122 12.858 624 HD2 ARG 79 HD3 ARG 79 101.951 8.268 13.893 625 HD3 ARG 79 HD2 ARG 79 103.344 9.320 14.244 626 HE ARG 79 HE ARG 79 102.574 10.259 11.775 627 HH11 ARG 79 HH11 ARG 79 100.927 11.774 11.445 628 HH12 ARG 79 HH12 ARG 79 99.622 11.911 12.602 629 HH21 ARG 79 HH21 ARG 79 100.855 9.405 14.680 630 HH22 ARG 79 HH22 ARG 79 99.581 10.576 14.424 631 H GLY 80 H GLY 80 106.430 8.417 9.456 632 HA2 GLY 80 HA3 GLY 80 108.054 7.930 11.730 633 HA3 GLY 80 HA2 GLY 80 108.201 6.487 10.693 634 H THR 81 H THR 81 109.833 6.611 9.222 635 HA THR 81 HA THR 81 110.184 8.752 7.379 636 HB THR 81 HB THR 81 112.539 9.287 8.911 637 HG1 THR 81 HG1 THR 81 111.752 9.816 10.879 638 HG21 THR 81 HG21 THR 81 111.468 11.593 9.015 639 HG22 THR 81 HG22 THR 81 110.025 10.874 8.261 640 HG23 THR 81 HG23 THR 81 111.574 10.885 7.385 641 H TRP 82 H TRP 82 112.160 8.559 6.106 642 HA TRP 82 HA TRP 82 113.345 5.803 6.407 643 HB2 TRP 82 HB2 TRP 82 113.698 7.649 4.022 644 HB3 TRP 82 HB3 TRP 82 113.866 5.878 4.088 645 HD1 TRP 82 HD1 TRP 82 111.182 8.626 4.290 646 HE1 TRP 82 HE1 TRP 82 108.908 7.647 3.578 647 HE3 TRP 82 HE3 TRP 82 112.555 3.746 3.735 648 HZ2 TRP 82 HZ2 TRP 82 107.845 5.057 2.844 649 HZ3 TRP 82 HZ3 TRP 82 110.903 2.045 3.022 650 HH2 TRP 82 HH2 TRP 82 108.552 2.692 2.574 651 H SER 83 H SER 83 115.571 5.524 6.584 652 HA SER 83 HA SER 83 117.249 8.029 6.608 653 HB2 SER 83 HB3 SER 83 116.749 6.105 8.868 654 HB3 SER 83 HB2 SER 83 118.390 6.766 8.677 655 HG SER 83 HG SER 83 117.038 8.109 10.000 656 H LEU 84 H LEU 84 119.584 7.507 6.304 657 HA LEU 84 HA LEU 84 119.792 4.938 4.772 658 HB2 LEU 84 HB2 LEU 84 120.843 6.389 3.369 659 HB3 LEU 84 HB3 LEU 84 121.063 7.604 4.649 660 HG LEU 84 HG LEU 84 122.941 6.184 5.564 661 HD11 LEU 84 HD11 LEU 84 123.410 4.779 3.043 662 HD12 LEU 84 HD12 LEU 84 123.385 4.139 4.703 663 HD13 LEU 84 HD13 LEU 84 121.869 4.281 3.782 664 HD21 LEU 84 HD21 LEU 84 124.554 6.850 3.803 665 HD22 LEU 84 HD22 LEU 84 123.208 7.106 2.668 666 HD23 LEU 84 HD23 LEU 84 123.367 8.141 4.107 667 H GLU 85 H GLU 85 120.807 3.216 5.651 668 HA GLU 85 HA GLU 85 122.657 3.728 7.987 669 HB2 GLU 85 HB2 GLU 85 120.327 1.844 7.703 670 HB3 GLU 85 HB3 GLU 85 121.751 1.281 8.611 671 HG2 GLU 85 HG2 GLU 85 120.492 3.992 9.150 672 HG3 GLU 85 HG3 GLU 85 119.896 2.514 9.943 673 H GLY 86 H GLY 86 124.666 3.153 7.328 674 HA2 GLY 86 HA2 GLY 86 126.365 1.876 6.292 675 HA3 GLY 86 HA3 GLY 86 125.233 0.500 6.325 676 H ASN 87 H ASN 87 124.331 -0.148 4.407 677 HA ASN 87 HA ASN 87 124.596 1.777 2.086 678 HB2 ASN 87 HB2 ASN 87 126.208 -0.264 2.167 679 HB3 ASN 87 HB3 ASN 87 124.765 -1.234 1.787 680 HD21 ASN 87 HD21 ASN 87 126.602 -1.372 -0.184 681 HD22 ASN 87 HD22 ASN 87 126.196 -0.325 -1.526 682 H LYS 88 H LYS 88 122.227 1.366 3.822 683 HA LYS 88 HA LYS 88 120.390 0.497 1.610 684 HB2 LYS 88 HB3 LYS 88 119.116 -0.981 3.043 685 HB3 LYS 88 HB2 LYS 88 120.823 -1.475 3.144 686 HG2 LYS 88 HG2 LYS 88 120.712 0.387 5.154 687 HG3 LYS 88 HG3 LYS 88 119.059 -0.271 5.222 688 HD2 LYS 88 HD2 LYS 88 120.250 -1.727 6.640 689 HD3 LYS 88 HD3 LYS 88 120.252 -2.605 5.092 690 HE2 LYS 88 HE3 LYS 88 122.495 -1.239 4.685 691 HE3 LYS 88 HE2 LYS 88 122.500 -1.131 6.461 692 HZ1 LYS 88 HZ1 LYS 88 123.659 -3.091 5.685 693 HZ2 LYS 88 HZ2 LYS 88 122.314 -3.628 4.895 694 HZ3 LYS 88 HZ3 LYS 88 122.319 -3.528 6.542 695 H LEU 89 H LEU 89 118.288 1.421 1.748 696 HA LEU 89 HA LEU 89 118.205 3.839 3.525 697 HB2 LEU 89 HB3 LEU 89 116.829 2.960 0.995 698 HB3 LEU 89 HB2 LEU 89 115.974 4.098 2.063 699 HG LEU 89 HG LEU 89 118.838 4.515 1.108 700 HD11 LEU 89 HD11 LEU 89 117.870 6.150 -0.487 701 HD12 LEU 89 HD12 LEU 89 116.232 5.677 0.025 702 HD13 LEU 89 HD13 LEU 89 117.275 4.505 -0.815 703 HD21 LEU 89 HD21 LEU 89 118.191 5.694 3.195 704 HD22 LEU 89 HD22 LEU 89 118.411 6.842 1.853 705 HD23 LEU 89 HD23 LEU 89 116.771 6.378 2.367 706 H ILE 90 H ILE 90 117.360 3.422 5.516 707 HA ILE 90 HA ILE 90 115.458 1.191 5.867 708 HB ILE 90 HB ILE 90 115.358 2.350 8.259 709 HG12 ILE 90 HG13 ILE 90 118.025 3.311 7.169 710 HG13 ILE 90 HG12 ILE 90 116.604 4.368 7.363 711 HG21 ILE 90 HG21 ILE 90 116.323 0.129 7.726 712 HG22 ILE 90 HG22 ILE 90 117.355 1.022 8.869 713 HG23 ILE 90 HG23 ILE 90 117.813 0.916 7.152 714 HD11 ILE 90 HD11 ILE 90 116.517 3.895 9.747 715 HD12 ILE 90 HD12 ILE 90 118.169 4.414 9.332 716 HD13 ILE 90 HD13 ILE 90 117.816 2.688 9.593 717 H GLY 91 H GLY 91 113.417 1.518 7.043 718 HA2 GLY 91 HA2 GLY 91 112.086 4.159 6.577 719 HA3 GLY 91 HA3 GLY 91 111.394 2.736 5.756 720 H LYS 92 H LYS 92 111.834 4.372 8.805 721 HA LYS 92 HA LYS 92 110.665 2.105 10.345 722 HB2 LYS 92 HB2 LYS 92 110.967 3.524 12.288 723 HB3 LYS 92 HB3 LYS 92 112.432 3.666 11.287 724 HG2 LYS 92 HG2 LYS 92 111.039 5.677 10.191 725 HG3 LYS 92 HG3 LYS 92 110.246 5.670 11.785 726 HD2 LYS 92 HD3 LYS 92 113.254 5.850 11.295 727 HD3 LYS 92 HD2 LYS 92 112.196 7.204 11.760 728 HE2 LYS 92 HE2 LYS 92 111.566 5.936 13.836 729 HE3 LYS 92 HE3 LYS 92 112.746 4.681 13.385 730 HZ1 LYS 92 HZ1 LYS 92 113.694 6.291 14.899 731 HZ2 LYS 92 HZ2 LYS 92 114.460 6.366 13.440 732 HZ3 LYS 92 HZ3 LYS 92 113.367 7.528 13.858 733 H PHE 93 H PHE 93 108.521 1.775 9.961 734 HA PHE 93 HA PHE 93 106.773 4.243 9.887 735 HB2 PHE 93 HB2 PHE 93 106.762 1.681 8.323 736 HB3 PHE 93 HB3 PHE 93 105.190 2.409 8.723 737 HD1 PHE 93 HD1 PHE 93 107.500 5.053 8.656 738 HD2 PHE 93 HD2 PHE 93 105.409 2.387 6.012 739 HE1 PHE 93 HE1 PHE 93 107.795 6.663 6.798 740 HE2 PHE 93 HE2 PHE 93 105.701 4.004 4.156 741 HZ PHE 93 HZ PHE 93 106.891 6.144 4.549 742 H LYS 94 H LYS 94 105.015 4.321 11.192 743 HA LYS 94 HA LYS 94 104.567 1.920 12.974 744 HB2 LYS 94 HB3 LYS 94 104.746 4.867 13.657 745 HB3 LYS 94 HB2 LYS 94 103.866 3.724 14.700 746 HG2 LYS 94 HG2 LYS 94 105.871 2.363 14.983 747 HG3 LYS 94 HG3 LYS 94 106.763 3.371 13.818 748 HD2 LYS 94 HD3 LYS 94 106.314 5.354 15.343 749 HD3 LYS 94 HD2 LYS 94 105.684 4.199 16.542 750 HE2 LYS 94 HE2 LYS 94 108.424 3.813 15.303 751 HE3 LYS 94 HE3 LYS 94 108.197 4.895 16.698 752 HZ1 LYS 94 HZ1 LYS 94 108.730 2.654 17.389 753 HZ2 LYS 94 HZ2 LYS 94 107.208 3.052 17.884 754 HZ3 LYS 94 HZ3 LYS 94 107.418 2.049 16.592 755 H ARG 95 H ARG 95 102.620 1.110 12.459 756 HA ARG 95 HA ARG 95 100.563 2.423 11.013 757 HB2 ARG 95 HB2 ARG 95 100.644 0.112 12.939 758 HB3 ARG 95 HB3 ARG 95 99.052 0.770 12.493 759 HG2 ARG 95 HG2 ARG 95 99.751 0.561 10.059 760 HG3 ARG 95 HG3 ARG 95 101.198 -0.312 10.618 761 HD2 ARG 95 HD2 ARG 95 99.572 -1.997 10.084 762 HD3 ARG 95 HD3 ARG 95 99.600 -1.888 11.860 763 HE ARG 95 HE ARG 95 97.592 -0.075 11.052 764 HH11 ARG 95 HH11 ARG 95 95.435 -0.735 10.919 765 HH12 ARG 95 HH12 ARG 95 95.050 -2.427 10.700 766 HH21 ARG 95 HH21 ARG 95 98.380 -3.443 10.657 767 HH22 ARG 95 HH22 ARG 95 96.711 -3.954 10.553 768 H THR 96 H THR 96 99.567 4.296 11.535 769 HA THR 96 HA THR 96 99.568 5.329 14.264 770 HB THR 96 HB THR 96 97.678 6.830 13.041 771 HG1 THR 96 HG1 THR 96 99.286 6.066 10.851 772 HG21 THR 96 HG21 THR 96 99.537 8.272 12.263 773 HG22 THR 96 HG22 THR 96 99.881 7.603 13.876 774 HG23 THR 96 HG23 THR 96 100.669 6.910 12.439 775 H ASP 97 H ASP 97 97.698 3.109 12.603 776 HA ASP 97 HA ASP 97 95.166 3.563 14.045 777 HB2 ASP 97 HB2 ASP 97 95.473 2.452 11.734 778 HB3 ASP 97 HB3 ASP 97 96.015 1.012 12.628 779 H ASN 98 H ASN 98 97.807 1.125 14.208 780 HA ASN 98 HA ASN 98 96.929 0.625 17.055 781 HB2 ASN 98 HB2 ASN 98 97.804 -1.495 15.043 782 HB3 ASN 98 HB3 ASN 98 97.371 -1.781 16.746 783 HD21 ASN 98 HD21 ASN 98 95.056 -0.860 17.340 784 HD22 ASN 98 HD22 ASN 98 93.814 -1.134 16.140 785 H GLY 99 H GLY 99 99.281 1.958 15.311 786 HA2 GLY 99 HA2 GLY 99 101.648 2.091 15.533 787 HA3 GLY 99 HA3 GLY 99 101.284 1.939 17.269 788 H ASN 100 H ASN 100 100.742 -0.510 14.721 789 HA ASN 100 HA ASN 100 102.093 -2.535 16.378 790 HB2 ASN 100 HB2 ASN 100 100.740 -2.465 13.692 791 HB3 ASN 100 HB3 ASN 100 101.823 -3.828 14.063 792 HD21 ASN 100 HD21 ASN 100 101.326 -4.053 16.889 793 HD22 ASN 100 HD22 ASN 100 99.666 -4.560 17.102 794 H GLU 101 H GLU 101 103.497 -0.089 15.179 795 HA GLU 101 HA GLU 101 105.537 0.413 14.110 796 HB2 GLU 101 HB2 GLU 101 107.410 -0.750 15.037 797 HB3 GLU 101 HB3 GLU 101 106.154 -0.741 16.296 798 HG2 GLU 101 HG2 GLU 101 105.566 -3.031 15.849 799 HG3 GLU 101 HG3 GLU 101 106.530 -3.054 14.353 800 H LEU 102 H LEU 102 107.183 -0.223 12.537 801 HA LEU 102 HA LEU 102 106.813 -2.726 11.017 802 HB2 LEU 102 HB2 LEU 102 104.931 -1.220 10.193 803 HB3 LEU 102 HB3 LEU 102 106.179 -0.085 9.626 804 HG LEU 102 HG LEU 102 106.122 -3.019 8.814 805 HD11 LEU 102 HD11 LEU 102 104.032 -1.908 8.073 806 HD12 LEU 102 HD12 LEU 102 105.100 -2.253 6.692 807 HD13 LEU 102 HD13 LEU 102 104.989 -0.599 7.340 808 HD21 LEU 102 HD21 LEU 102 107.351 -1.663 6.806 809 HD22 LEU 102 HD22 LEU 102 108.230 -2.309 8.212 810 HD23 LEU 102 HD23 LEU 102 107.755 -0.594 8.171 811 H ASN 103 H ASN 103 108.870 -3.233 10.386 812 HA ASN 103 HA ASN 103 110.784 -0.907 10.070 813 HB2 ASN 103 HB3 ASN 103 110.975 -3.519 11.425 814 HB3 ASN 103 HB2 ASN 103 112.332 -3.214 10.315 815 HD21 ASN 103 HD21 ASN 103 113.226 -0.801 10.531 816 HD22 ASN 103 HD22 ASN 103 113.405 -0.232 12.175 817 H THR 104 H THR 104 111.158 -0.487 7.949 818 HA THR 104 HA THR 104 111.323 -2.889 6.119 819 HB THR 104 HB THR 104 109.289 -1.705 5.582 820 HG1 THR 104 HG1 THR 104 110.023 -2.027 3.614 821 HG21 THR 104 HG21 THR 104 109.698 0.832 4.867 822 HG22 THR 104 HG22 THR 104 111.067 0.693 5.996 823 HG23 THR 104 HG23 THR 104 109.407 0.402 6.569 824 H VAL 105 H VAL 105 112.414 -2.166 3.967 825 HA VAL 105 HA VAL 105 114.588 -0.161 4.391 826 HB VAL 105 HB VAL 105 115.156 -3.093 3.762 827 HG11 VAL 105 HG11 VAL 105 117.568 -2.096 4.224 828 HG12 VAL 105 HG12 VAL 105 116.821 -1.915 2.619 829 HG13 VAL 105 HG13 VAL 105 116.796 -0.558 3.770 830 HG21 VAL 105 HG21 VAL 105 116.356 -3.039 5.952 831 HG22 VAL 105 HG22 VAL 105 114.610 -2.746 6.138 832 HG23 VAL 105 HG23 VAL 105 115.754 -1.386 6.220 833 H ARG 106 H ARG 106 115.629 0.410 2.343 834 HA ARG 106 HA ARG 106 114.094 -0.623 -0.055 835 HB2 ARG 106 HB2 ARG 106 114.717 2.202 0.811 836 HB3 ARG 106 HB3 ARG 106 114.592 1.825 -0.924 837 HG2 ARG 106 HG2 ARG 106 112.339 0.922 -0.608 838 HG3 ARG 106 HG3 ARG 106 112.464 1.146 1.153 839 HD2 ARG 106 HD2 ARG 106 111.175 2.983 0.052 840 HD3 ARG 106 HD3 ARG 106 112.645 3.580 0.858 841 HE ARG 106 HE ARG 106 113.474 3.068 -1.775 842 HH11 ARG 106 HH11 ARG 106 113.373 4.664 -3.374 843 HH12 ARG 106 HH12 ARG 106 112.237 5.985 -3.220 844 HH21 ARG 106 HH21 ARG 106 110.950 4.864 -0.185 845 HH22 ARG 106 HH22 ARG 106 110.871 6.098 -1.422 846 H GLU 107 H GLU 107 115.326 -1.167 -1.808 847 HA GLU 107 HA GLU 107 118.214 -0.293 -1.812 848 HB2 GLU 107 HB2 GLU 107 117.106 -3.102 -1.831 849 HB3 GLU 107 HB3 GLU 107 118.599 -2.749 -2.734 850 HG2 GLU 107 HG3 GLU 107 119.548 -1.717 -0.639 851 HG3 GLU 107 HG2 GLU 107 118.095 -2.257 0.234 852 H ILE 108 H ILE 108 119.188 -0.465 -4.001 853 HA ILE 108 HA ILE 108 117.051 -0.442 -6.141 854 HB ILE 108 HB ILE 108 119.656 1.134 -6.120 855 HG12 ILE 108 HG12 ILE 108 117.606 1.610 -4.371 856 HG13 ILE 108 HG13 ILE 108 118.643 2.888 -5.047 857 HG21 ILE 108 HG21 ILE 108 118.831 0.785 -8.339 858 HG22 ILE 108 HG22 ILE 108 117.152 1.094 -7.837 859 HG23 ILE 108 HG23 ILE 108 118.328 2.430 -7.881 860 HD11 ILE 108 HD11 ILE 108 116.119 3.291 -5.221 861 HD12 ILE 108 HD12 ILE 108 117.029 3.423 -6.744 862 HD13 ILE 108 HD13 ILE 108 116.080 1.958 -6.399 863 H ILE 109 H ILE 109 117.539 -2.742 -6.398 864 HA ILE 109 HA ILE 109 120.218 -3.675 -6.965 865 HB ILE 109 HB ILE 109 117.444 -4.723 -7.606 866 HG12 ILE 109 HG12 ILE 109 119.752 -5.825 -5.941 867 HG13 ILE 109 HG13 ILE 109 118.406 -4.866 -5.282 868 HG21 ILE 109 HG21 ILE 109 118.836 -6.853 -8.281 869 HG22 ILE 109 HG22 ILE 109 118.590 -5.564 -9.483 870 HG23 ILE 109 HG23 ILE 109 120.136 -5.682 -8.609 871 HD11 ILE 109 HD11 ILE 109 118.410 -7.675 -6.363 872 HD12 ILE 109 HD12 ILE 109 116.942 -6.691 -6.580 873 HD13 ILE 109 HD13 ILE 109 117.568 -7.006 -4.944 874 H GLY 110 H GLY 110 121.200 -2.227 -8.403 875 HA2 GLY 110 HA2 GLY 110 121.748 -1.362 -10.531 876 HA3 GLY 110 HA3 GLY 110 120.998 -2.838 -11.183 877 H ASP 111 H ASP 111 118.631 -2.792 -11.556 878 HA ASP 111 HA ASP 111 117.596 0.034 -11.860 879 HB2 ASP 111 HB2 ASP 111 117.708 -2.214 -13.879 880 HB3 ASP 111 HB3 ASP 111 116.411 -0.998 -13.970 881 H GLU 112 H GLU 112 117.125 -2.072 -9.794 882 HA GLU 112 HA GLU 112 114.128 -2.203 -10.157 883 HB2 GLU 112 HB2 GLU 112 115.526 -4.404 -8.659 884 HB3 GLU 112 HB3 GLU 112 114.016 -4.454 -9.600 885 HG2 GLU 112 HG2 GLU 112 115.547 -4.008 -11.664 886 HG3 GLU 112 HG3 GLU 112 116.879 -4.511 -10.597 887 H LEU 113 H LEU 113 112.959 -1.748 -8.237 888 HA LEU 113 HA LEU 113 114.729 -0.808 -5.974 889 HB2 LEU 113 HB2 LEU 113 113.139 0.844 -6.973 890 HB3 LEU 113 HB3 LEU 113 111.787 -0.213 -6.506 891 HG LEU 113 HG LEU 113 112.847 -0.069 -4.102 892 HD11 LEU 113 HD11 LEU 113 113.945 2.175 -3.751 893 HD12 LEU 113 HD12 LEU 113 114.018 2.366 -5.519 894 HD13 LEU 113 HD13 LEU 113 114.923 1.053 -4.727 895 HD21 LEU 113 HD21 LEU 113 111.509 1.975 -3.664 896 HD22 LEU 113 HD22 LEU 113 111.469 2.322 -5.410 897 HD23 LEU 113 HD23 LEU 113 110.651 0.876 -4.771 898 H VAL 114 H VAL 114 115.006 -2.375 -4.470 899 HA VAL 114 HA VAL 114 112.734 -4.277 -3.995 900 HB VAL 114 HB VAL 114 115.521 -4.304 -2.765 901 HG11 VAL 114 HG11 VAL 114 114.986 -6.701 -2.415 902 HG12 VAL 114 HG12 VAL 114 113.386 -6.450 -3.153 903 HG13 VAL 114 HG13 VAL 114 113.790 -5.654 -1.614 904 HG21 VAL 114 HG21 VAL 114 114.596 -4.933 -5.489 905 HG22 VAL 114 HG22 VAL 114 115.381 -6.319 -4.695 906 HG23 VAL 114 HG23 VAL 114 116.254 -4.776 -4.862 907 H GLN 115 H GLN 115 111.263 -3.523 -2.571 908 HA GLN 115 HA GLN 115 112.307 -1.990 -0.186 909 HB2 GLN 115 HB3 GLN 115 110.563 -0.904 -1.703 910 HB3 GLN 115 HB2 GLN 115 109.432 -2.177 -1.184 911 HG2 GLN 115 HG2 GLN 115 109.436 -1.432 1.064 912 HG3 GLN 115 HG3 GLN 115 110.937 -0.500 0.847 913 HE21 GLN 115 HE21 GLN 115 107.672 -0.058 1.255 914 HE22 GLN 115 HE22 GLN 115 107.469 1.432 0.362 915 H THR 116 H THR 116 112.682 -3.463 1.419 916 HA THR 116 HA THR 116 110.720 -5.731 1.690 917 HB THR 116 HB THR 116 113.149 -5.510 3.434 918 HG1 THR 116 HG1 THR 116 114.067 -4.987 1.477 919 HG21 THR 116 HG21 THR 116 113.185 -7.957 2.999 920 HG22 THR 116 HG22 THR 116 111.821 -7.769 1.872 921 HG23 THR 116 HG23 THR 116 111.599 -7.425 3.604 922 H TYR 117 H TYR 117 109.564 -6.054 3.578 923 HA TYR 117 HA TYR 117 109.810 -3.838 5.624 924 HB2 TYR 117 HB2 TYR 117 107.208 -5.303 5.148 925 HB3 TYR 117 HB3 TYR 117 107.479 -3.711 5.892 926 HD1 TYR 117 HD1 TYR 117 108.162 -5.477 2.679 927 HD2 TYR 117 HD2 TYR 117 106.948 -1.847 4.602 928 HE1 TYR 117 HE1 TYR 117 107.800 -4.432 0.462 929 HE2 TYR 117 HE2 TYR 117 106.583 -0.787 2.390 930 HH TYR 117 HH TYR 117 106.390 -1.193 0.143 931 H VAL 118 H VAL 118 109.406 -4.430 7.759 932 HA VAL 118 HA VAL 118 109.484 -7.413 8.268 933 HB VAL 118 HB VAL 118 110.671 -5.294 10.090 934 HG11 VAL 118 HG11 VAL 118 111.476 -7.076 11.335 935 HG12 VAL 118 HG12 VAL 118 111.561 -8.160 9.927 936 HG13 VAL 118 HG13 VAL 118 109.991 -7.816 10.691 937 HG21 VAL 118 HG21 VAL 118 112.572 -6.986 8.610 938 HG22 VAL 118 HG22 VAL 118 112.601 -5.231 8.905 939 HG23 VAL 118 HG23 VAL 118 111.650 -5.890 7.553 940 H TYR 119 H TYR 119 108.261 -8.128 10.019 941 HA TYR 119 HA TYR 119 106.642 -6.041 11.427 942 HB2 TYR 119 HB2 TYR 119 105.598 -7.243 9.202 943 HB3 TYR 119 HB3 TYR 119 105.054 -8.361 10.476 944 HD1 TYR 119 HD1 TYR 119 103.829 -7.446 12.463 945 HD2 TYR 119 HD2 TYR 119 104.619 -5.077 8.975 946 HE1 TYR 119 HE1 TYR 119 102.066 -5.845 13.153 947 HE2 TYR 119 HE2 TYR 119 102.863 -3.467 9.665 948 HH TYR 119 HH TYR 119 100.872 -3.380 11.063 949 H GLU 120 H GLU 120 107.091 -6.462 13.464 950 HA GLU 120 HA GLU 120 107.450 -7.653 15.462 951 HB2 GLU 120 HB2 GLU 120 105.150 -9.112 14.141 952 HB3 GLU 120 HB3 GLU 120 105.766 -9.616 15.733 953 HG2 GLU 120 HG3 GLU 120 105.467 -7.238 16.527 954 HG3 GLU 120 HG2 GLU 120 104.694 -6.864 14.968 955 H GLY 121 H GLY 121 108.853 -8.616 12.871 956 HA2 GLY 121 HA3 GLY 121 110.804 -10.158 13.189 957 HA3 GLY 121 HA2 GLY 121 109.721 -11.248 14.090 958 H VAL 122 H VAL 122 108.639 -9.561 11.221 959 HA VAL 122 HA VAL 122 108.831 -12.172 9.717 960 HB VAL 122 HB VAL 122 106.469 -11.113 10.510 961 HG11 VAL 122 HG11 VAL 122 106.751 -9.997 7.710 962 HG12 VAL 122 HG12 VAL 122 105.504 -9.652 8.932 963 HG13 VAL 122 HG13 VAL 122 107.149 -9.004 9.132 964 HG21 VAL 122 HG21 VAL 122 105.464 -12.327 8.600 965 HG22 VAL 122 HG22 VAL 122 107.047 -12.352 7.786 966 HG23 VAL 122 HG23 VAL 122 106.815 -13.242 9.310 967 H GLU 123 H GLU 123 108.484 -11.548 7.239 968 HA GLU 123 HA GLU 123 109.686 -8.894 6.670 969 HB2 GLU 123 HB3 GLU 123 111.280 -11.380 6.765 970 HB3 GLU 123 HB2 GLU 123 111.438 -10.487 5.234 971 HG2 GLU 123 HG2 GLU 123 111.888 -8.397 6.575 972 HG3 GLU 123 HG3 GLU 123 111.895 -9.398 8.047 973 H ALA 124 H ALA 124 108.754 -8.149 4.877 974 HA ALA 124 HA ALA 124 107.843 -10.169 2.812 975 HB1 ALA 124 HB1 ALA 124 106.529 -7.699 2.355 976 HB2 ALA 124 HB2 ALA 124 105.810 -9.189 3.011 977 HB3 ALA 124 HB3 ALA 124 106.463 -7.954 4.115 978 H LYS 125 H LYS 125 108.152 -9.472 0.537 979 HA LYS 125 HA LYS 125 110.152 -7.216 0.321 980 HB2 LYS 125 HB2 LYS 125 111.141 -9.617 0.267 981 HB3 LYS 125 HB3 LYS 125 110.381 -9.741 -1.338 982 HG2 LYS 125 HG3 LYS 125 111.566 -7.367 -1.689 983 HG3 LYS 125 HG2 LYS 125 112.649 -7.986 -0.420 984 HD2 LYS 125 HD2 LYS 125 111.937 -9.616 -2.888 985 HD3 LYS 125 HD3 LYS 125 113.325 -8.503 -2.850 986 HE2 LYS 125 HE2 LYS 125 114.536 -9.852 -1.437 987 HE3 LYS 125 HE3 LYS 125 113.092 -10.391 -0.546 988 HZ1 LYS 125 HZ1 LYS 125 114.004 -11.325 -3.191 989 HZ2 LYS 125 HZ2 LYS 125 112.530 -11.701 -2.554 990 HZ3 LYS 125 HZ3 LYS 125 113.907 -12.205 -1.800 991 H ARG 126 H ARG 126 109.938 -5.902 -1.427 992 HA ARG 126 HA ARG 126 108.004 -6.741 -3.590 993 HB2 ARG 126 HB3 ARG 126 107.911 -4.312 -1.804 994 HB3 ARG 126 HB2 ARG 126 107.403 -4.141 -3.501 995 HG2 ARG 126 HG2 ARG 126 105.719 -5.854 -3.252 996 HG3 ARG 126 HG3 ARG 126 106.340 -6.313 -1.648 997 HD2 ARG 126 HD2 ARG 126 104.308 -4.895 -1.461 998 HD3 ARG 126 HD3 ARG 126 105.731 -4.082 -0.766 999 HE ARG 126 HE ARG 126 105.708 -3.173 -3.403 1000 HH11 ARG 126 HH11 ARG 126 104.553 -1.338 -4.040 1001 HH12 ARG 126 HH12 ARG 126 103.160 -0.817 -3.117 1002 HH21 ARG 126 HH21 ARG 126 103.411 -3.401 -0.797 1003 HH22 ARG 126 HH22 ARG 126 102.516 -1.981 -1.289 1004 H ILE 127 H ILE 127 109.242 -6.730 -5.434 1005 HA ILE 127 HA ILE 127 111.451 -4.666 -5.560 1006 HB ILE 127 HB ILE 127 111.135 -7.210 -7.200 1007 HG12 ILE 127 HG13 ILE 127 113.267 -7.021 -5.136 1008 HG13 ILE 127 HG12 ILE 127 111.611 -7.141 -4.495 1009 HG21 ILE 127 HG21 ILE 127 113.530 -6.817 -7.715 1010 HG22 ILE 127 HG22 ILE 127 113.489 -5.321 -6.751 1011 HG23 ILE 127 HG23 ILE 127 112.525 -5.446 -8.242 1012 HD11 ILE 127 HD11 ILE 127 112.603 -9.392 -4.825 1013 HD12 ILE 127 HD12 ILE 127 112.867 -9.022 -6.546 1014 HD13 ILE 127 HD13 ILE 127 111.211 -9.143 -5.905 1015 H PHE 128 H PHE 128 111.168 -3.002 -6.923 1016 HA PHE 128 HA PHE 128 109.079 -3.282 -9.077 1017 HB2 PHE 128 HB3 PHE 128 110.594 -0.787 -8.167 1018 HB3 PHE 128 HB2 PHE 128 109.193 -0.841 -9.260 1019 HD1 PHE 128 HD1 PHE 128 108.194 -3.290 -7.281 1020 HD2 PHE 128 HD2 PHE 128 109.080 0.884 -6.896 1021 HE1 PHE 128 HE1 PHE 128 106.645 -3.145 -5.353 1022 HE2 PHE 128 HE2 PHE 128 107.537 1.037 -4.960 1023 HZ PHE 128 HZ PHE 128 106.317 -0.981 -4.187 1024 H LYS 129 H LYS 129 109.768 -1.914 -11.140 1025 HA LYS 129 HA LYS 129 112.640 -1.983 -11.789 1026 HB2 LYS 129 HB2 LYS 129 111.791 -4.433 -11.945 1027 HB3 LYS 129 HB3 LYS 129 110.880 -3.887 -13.372 1028 HG2 LYS 129 HG2 LYS 129 113.471 -2.828 -13.726 1029 HG3 LYS 129 HG3 LYS 129 113.736 -4.476 -13.109 1030 HD2 LYS 129 HD3 LYS 129 112.124 -5.321 -14.855 1031 HD3 LYS 129 HD2 LYS 129 112.050 -3.672 -15.520 1032 HE2 LYS 129 HE2 LYS 129 113.747 -4.555 -16.838 1033 HE3 LYS 129 HE3 LYS 129 114.713 -3.920 -15.485 1034 HZ1 LYS 129 HZ1 LYS 129 115.294 -6.195 -16.002 1035 HZ2 LYS 129 HZ2 LYS 129 113.744 -6.696 -15.746 1036 HZ3 LYS 129 HZ3 LYS 129 114.638 -6.108 -14.491 1037 H LYS 130 H LYS 130 113.001 -1.228 -14.057 1038 HA LYS 130 HA LYS 130 111.485 1.051 -14.716 1039 HB2 LYS 130 HB3 LYS 130 112.352 0.665 -17.102 1040 HB3 LYS 130 HB2 LYS 130 113.587 0.705 -15.821 1041 HG2 LYS 130 HG2 LYS 130 113.608 -1.758 -15.736 1042 HG3 LYS 130 HG3 LYS 130 112.326 -1.827 -16.969 1043 HD2 LYS 130 HD3 LYS 130 114.216 -2.090 -18.309 1044 HD3 LYS 130 HD2 LYS 130 114.034 -0.320 -18.352 1045 HE2 LYS 130 HE2 LYS 130 115.595 -0.235 -16.327 1046 HE3 LYS 130 HE3 LYS 130 115.925 -1.960 -16.618 1047 HZ1 LYS 130 HZ1 LYS 130 117.529 -0.549 -17.724 1048 HZ2 LYS 130 HZ2 LYS 130 116.643 -1.381 -18.839 1049 HZ3 LYS 130 HZ3 LYS 130 116.338 0.218 -18.569 1050 H ASP 131 H ASP 131 109.525 1.426 -15.648 1051 HA ASP 131 HA ASP 131 107.736 -0.847 -16.124 1052 HB2 ASP 131 HB2 ASP 131 106.075 0.825 -16.666 1053 HB3 ASP 131 HB3 ASP 131 107.040 1.463 -15.314 Start of MODEL 20 1 H1 ALA 1 H1 ALA 1 119.143 4.829 -12.209 2 H2 ALA 1 H2 ALA 1 119.726 4.970 -10.672 3 H3 ALA 1 H3 ALA 1 119.109 6.290 -11.444 4 HA ALA 1 HA ALA 1 117.573 3.899 -10.643 5 HB1 ALA 1 HB1 ALA 1 116.494 5.448 -9.034 6 HB2 ALA 1 HB2 ALA 1 118.244 5.330 -8.733 7 HB3 ALA 1 HB3 ALA 1 117.578 6.755 -9.566 8 H PHE 2 H PHE 2 115.381 3.935 -11.290 9 HA PHE 2 HA PHE 2 114.873 5.533 -13.724 10 HB2 PHE 2 HB3 PHE 2 112.879 3.829 -12.179 11 HB3 PHE 2 HB2 PHE 2 112.809 4.303 -13.892 12 HD1 PHE 2 HD1 PHE 2 113.048 1.496 -12.225 13 HD2 PHE 2 HD2 PHE 2 115.619 3.831 -14.751 14 HE1 PHE 2 HE1 PHE 2 114.304 -0.550 -12.833 15 HE2 PHE 2 HE2 PHE 2 116.877 1.782 -15.360 16 HZ PHE 2 HZ PHE 2 116.221 -0.408 -14.401 17 H ASP 3 H ASP 3 115.178 6.891 -11.024 18 HA ASP 3 HA ASP 3 113.225 7.947 -9.612 19 HB2 ASP 3 HB2 ASP 3 115.389 9.182 -10.433 20 HB3 ASP 3 HB3 ASP 3 114.309 9.930 -11.634 21 H SER 4 H SER 4 111.219 7.035 -10.423 22 HA SER 4 HA SER 4 109.395 8.826 -11.598 23 HB2 SER 4 HB2 SER 4 110.688 8.852 -13.661 24 HB3 SER 4 HB3 SER 4 110.744 7.073 -13.700 25 HG SER 4 HG SER 4 108.826 8.710 -14.645 26 H THR 5 H THR 5 108.467 6.557 -13.541 27 HA THR 5 HA THR 5 106.901 5.164 -11.418 28 HB THR 5 HB THR 5 106.717 5.258 -14.450 29 HG1 THR 5 HG1 THR 5 104.724 6.286 -13.865 30 HG21 THR 5 HG21 THR 5 104.661 3.895 -14.204 31 HG22 THR 5 HG22 THR 5 106.094 2.995 -13.652 32 HG23 THR 5 HG23 THR 5 104.986 3.719 -12.462 33 H TRP 6 H TRP 6 107.198 3.147 -10.765 34 HA TRP 6 HA TRP 6 108.963 1.310 -12.410 35 HB2 TRP 6 HB3 TRP 6 108.690 1.430 -9.370 36 HB3 TRP 6 HB2 TRP 6 109.683 0.274 -10.283 37 HD1 TRP 6 HD1 TRP 6 109.409 4.132 -10.656 38 HE1 TRP 6 HE1 TRP 6 111.765 5.148 -10.407 39 HE3 TRP 6 HE3 TRP 6 112.056 -0.146 -9.789 40 HZ2 TRP 6 HZ2 TRP 6 114.445 4.206 -9.957 41 HZ3 TRP 6 HZ3 TRP 6 114.513 -0.062 -9.485 42 HH2 TRP 6 HH2 TRP 6 115.711 2.108 -9.563 43 H LYS 7 H LYS 7 108.406 -1.106 -11.739 44 HA LYS 7 HA LYS 7 105.532 -1.318 -10.891 45 HB2 LYS 7 HB2 LYS 7 104.833 -2.517 -12.828 46 HB3 LYS 7 HB3 LYS 7 105.731 -1.114 -13.455 47 HG2 LYS 7 HG2 LYS 7 107.807 -2.679 -13.415 48 HG3 LYS 7 HG3 LYS 7 106.632 -4.007 -13.258 49 HD2 LYS 7 HD2 LYS 7 105.563 -3.408 -15.340 50 HD3 LYS 7 HD3 LYS 7 106.492 -1.894 -15.447 51 HE2 LYS 7 HE3 LYS 7 107.344 -3.825 -16.899 52 HE3 LYS 7 HE2 LYS 7 108.550 -3.077 -15.824 53 HZ1 LYS 7 HZ1 LYS 7 108.273 -5.630 -15.884 54 HZ2 LYS 7 HZ2 LYS 7 107.001 -5.360 -14.869 55 HZ3 LYS 7 HZ3 LYS 7 108.517 -4.873 -14.439 56 H VAL 8 H VAL 8 105.411 -2.897 -9.390 57 HA VAL 8 HA VAL 8 107.494 -4.517 -8.509 58 HB VAL 8 HB VAL 8 105.671 -4.740 -7.128 59 HG11 VAL 8 HG11 VAL 8 103.326 -5.184 -8.107 60 HG12 VAL 8 HG12 VAL 8 104.050 -4.817 -9.691 61 HG13 VAL 8 HG13 VAL 8 104.039 -3.582 -8.410 62 HG21 VAL 8 HG21 VAL 8 106.444 -7.053 -7.784 63 HG22 VAL 8 HG22 VAL 8 104.747 -6.988 -7.250 64 HG23 VAL 8 HG23 VAL 8 105.130 -7.098 -8.985 65 H ASP 9 H ASP 9 108.837 -5.630 -9.800 66 HA ASP 9 HA ASP 9 107.675 -7.240 -12.047 67 HB2 ASP 9 HB3 ASP 9 109.748 -5.787 -12.352 68 HB3 ASP 9 HB2 ASP 9 110.600 -6.898 -11.254 69 H ARG 10 H ARG 10 109.216 -7.518 -8.884 70 HA ARG 10 HA ARG 10 108.409 -10.393 -8.851 71 HB2 ARG 10 HB2 ARG 10 111.225 -9.767 -7.967 72 HB3 ARG 10 HB3 ARG 10 110.525 -11.315 -8.495 73 HG2 ARG 10 HG3 ARG 10 110.366 -10.448 -10.815 74 HG3 ARG 10 HG2 ARG 10 111.078 -8.905 -10.284 75 HD2 ARG 10 HD2 ARG 10 113.156 -9.992 -9.676 76 HD3 ARG 10 HD3 ARG 10 112.448 -11.605 -9.932 77 HE ARG 10 HE ARG 10 113.523 -9.835 -12.016 78 HH11 ARG 10 HH11 ARG 10 113.346 -10.622 -14.128 79 HH12 ARG 10 HH12 ARG 10 112.251 -11.939 -14.481 80 HH21 ARG 10 HH21 ARG 10 111.156 -12.251 -11.191 81 HH22 ARG 10 HH22 ARG 10 111.016 -12.858 -12.826 82 H SER 11 H SER 11 108.690 -11.320 -6.598 83 HA SER 11 HA SER 11 109.167 -9.479 -4.367 84 HB2 SER 11 HB3 SER 11 107.041 -8.506 -4.886 85 HB3 SER 11 HB2 SER 11 106.307 -10.097 -5.202 86 HG SER 11 HG SER 11 105.952 -9.018 -3.032 87 H GLU 12 H GLU 12 108.150 -10.637 -2.245 88 HA GLU 12 HA GLU 12 107.967 -13.582 -2.601 89 HB2 GLU 12 HB3 GLU 12 109.966 -14.202 -1.561 90 HB3 GLU 12 HB2 GLU 12 110.486 -12.787 -2.506 91 HG2 GLU 12 HG2 GLU 12 111.364 -12.199 -0.445 92 HG3 GLU 12 HG3 GLU 12 109.739 -11.494 -0.273 93 H ASN 13 H ASN 13 107.353 -14.678 -0.627 94 HA ASN 13 HA ASN 13 106.104 -14.824 1.363 95 HB2 ASN 13 HB2 ASN 13 107.885 -12.437 1.841 96 HB3 ASN 13 HB3 ASN 13 106.589 -12.794 3.008 97 HD21 ASN 13 HD21 ASN 13 108.657 -13.198 4.420 98 HD22 ASN 13 HD22 ASN 13 109.302 -14.824 4.384 99 H TYR 14 H TYR 14 105.840 -11.516 2.129 100 HA TYR 14 HA TYR 14 104.082 -9.963 1.835 101 HB2 TYR 14 HB2 TYR 14 104.317 -11.063 -0.659 102 HB3 TYR 14 HB3 TYR 14 102.650 -11.533 -0.251 103 HD1 TYR 14 HD1 TYR 14 104.596 -8.484 0.758 104 HD2 TYR 14 HD2 TYR 14 101.281 -10.063 -1.475 105 HE1 TYR 14 HE1 TYR 14 103.827 -6.179 0.267 106 HE2 TYR 14 HE2 TYR 14 100.512 -7.757 -1.963 107 HH TYR 14 HH TYR 14 101.082 -5.249 -0.468 108 H ASP 15 H ASP 15 102.900 -13.342 1.347 109 HA ASP 15 HA ASP 15 100.360 -12.837 2.631 110 HB2 ASP 15 HB3 ASP 15 102.007 -15.365 2.246 111 HB3 ASP 15 HB2 ASP 15 100.412 -15.376 3.034 112 H LYS 16 H LYS 16 103.493 -14.022 3.896 113 HA LYS 16 HA LYS 16 102.515 -14.319 6.623 114 HB2 LYS 16 HB2 LYS 16 105.380 -13.608 5.941 115 HB3 LYS 16 HB3 LYS 16 104.768 -14.692 7.213 116 HG2 LYS 16 HG2 LYS 16 104.737 -15.194 4.205 117 HG3 LYS 16 HG3 LYS 16 105.710 -16.054 5.422 118 HD2 LYS 16 HD3 LYS 16 103.508 -16.719 6.538 119 HD3 LYS 16 HD2 LYS 16 102.682 -16.086 5.094 120 HE2 LYS 16 HE2 LYS 16 104.677 -18.379 5.252 121 HE3 LYS 16 HE3 LYS 16 102.982 -18.440 4.712 122 HZ1 LYS 16 HZ1 LYS 16 104.113 -18.327 2.746 123 HZ2 LYS 16 HZ2 LYS 16 105.317 -17.362 3.328 124 HZ3 LYS 16 HZ3 LYS 16 103.832 -16.722 3.001 125 H PHE 17 H PHE 17 103.787 -11.641 4.705 126 HA PHE 17 HA PHE 17 104.128 -9.832 6.988 127 HB2 PHE 17 HB2 PHE 17 105.345 -9.442 4.931 128 HB3 PHE 17 HB3 PHE 17 103.841 -9.418 3.985 129 HD1 PHE 17 HD1 PHE 17 105.697 -7.659 6.688 130 HD2 PHE 17 HD2 PHE 17 102.622 -7.402 3.711 131 HE1 PHE 17 HE1 PHE 17 105.546 -5.214 7.061 132 HE2 PHE 17 HE2 PHE 17 102.456 -4.955 4.089 133 HZ PHE 17 HZ PHE 17 103.922 -3.860 5.765 134 H MET 18 H MET 18 101.732 -9.985 4.326 135 HA MET 18 HA MET 18 99.910 -8.085 5.493 136 HB2 MET 18 HB2 MET 18 99.632 -10.346 3.500 137 HB3 MET 18 HB3 MET 18 98.182 -9.495 4.083 138 HG2 MET 18 HG2 MET 18 100.610 -8.039 2.965 139 HG3 MET 18 HG3 MET 18 99.241 -8.552 1.950 140 HE1 MET 18 HE1 MET 18 100.700 -5.758 2.891 141 HE2 MET 18 HE2 MET 18 99.686 -4.690 3.891 142 HE3 MET 18 HE3 MET 18 100.568 -6.041 4.644 143 H GLU 19 H GLU 19 100.456 -11.523 6.092 144 HA GLU 19 HA GLU 19 97.941 -11.863 7.592 145 HB2 GLU 19 HB2 GLU 19 99.070 -13.779 6.504 146 HB3 GLU 19 HB3 GLU 19 100.486 -13.546 7.556 147 HG2 GLU 19 HG2 GLU 19 99.004 -15.331 8.434 148 HG3 GLU 19 HG3 GLU 19 99.074 -13.947 9.552 149 H LYS 20 H LYS 20 101.238 -10.843 8.317 150 HA LYS 20 HA LYS 20 100.952 -11.226 11.214 151 HB2 LYS 20 HB2 LYS 20 103.095 -10.796 9.600 152 HB3 LYS 20 HB3 LYS 20 102.823 -9.136 10.183 153 HG2 LYS 20 HG3 LYS 20 104.219 -9.987 11.859 154 HG3 LYS 20 HG2 LYS 20 102.610 -10.320 12.543 155 HD2 LYS 20 HD2 LYS 20 102.705 -12.622 11.582 156 HD3 LYS 20 HD3 LYS 20 104.344 -12.282 10.976 157 HE2 LYS 20 HE2 LYS 20 105.271 -12.228 13.126 158 HE3 LYS 20 HE3 LYS 20 103.715 -11.836 13.897 159 HZ1 LYS 20 HZ1 LYS 20 104.346 -14.125 14.281 160 HZ2 LYS 20 HZ2 LYS 20 104.412 -14.425 12.660 161 HZ3 LYS 20 HZ3 LYS 20 102.970 -14.062 13.374 162 H MET 21 H MET 21 100.420 -8.531 8.936 163 HA MET 21 HA MET 21 99.886 -6.576 11.038 164 HB2 MET 21 HB3 MET 21 98.597 -6.444 8.306 165 HB3 MET 21 HB2 MET 21 99.258 -5.126 9.303 166 HG2 MET 21 HG2 MET 21 101.515 -6.590 8.949 167 HG3 MET 21 HG3 MET 21 100.657 -7.009 7.447 168 HE1 MET 21 HE1 MET 21 98.956 -3.785 7.406 169 HE2 MET 21 HE2 MET 21 99.136 -5.277 6.452 170 HE3 MET 21 HE3 MET 21 99.782 -3.739 5.831 171 H GLY 22 H GLY 22 98.221 -9.343 10.025 172 HA2 GLY 22 HA3 GLY 22 96.154 -10.145 10.923 173 HA3 GLY 22 HA2 GLY 22 95.875 -8.549 11.658 174 H VAL 23 H VAL 23 96.699 -8.922 8.243 175 HA VAL 23 HA VAL 23 94.222 -7.501 7.506 176 HB VAL 23 HB VAL 23 96.244 -8.885 5.691 177 HG11 VAL 23 HG11 VAL 23 95.435 -7.219 4.043 178 HG12 VAL 23 HG12 VAL 23 94.102 -8.243 4.627 179 HG13 VAL 23 HG13 VAL 23 94.288 -6.586 5.248 180 HG21 VAL 23 HG21 VAL 23 97.368 -7.289 7.228 181 HG22 VAL 23 HG22 VAL 23 97.347 -6.664 5.561 182 HG23 VAL 23 HG23 VAL 23 96.203 -6.025 6.766 183 H ASN 24 H ASN 24 92.298 -8.431 6.999 184 HA ASN 24 HA ASN 24 91.629 -11.112 7.383 185 HB2 ASN 24 HB2 ASN 24 90.448 -9.671 5.001 186 HB3 ASN 24 HB3 ASN 24 89.637 -10.691 6.214 187 HD21 ASN 24 HD21 ASN 24 91.454 -9.078 8.281 188 HD22 ASN 24 HD22 ASN 24 90.511 -7.626 8.527 189 H ILE 25 H ILE 25 91.119 -12.848 5.739 190 HA ILE 25 HA ILE 25 93.514 -13.250 4.046 191 HB ILE 25 HB ILE 25 91.114 -14.873 4.863 192 HG12 ILE 25 HG13 ILE 25 93.472 -14.719 5.995 193 HG13 ILE 25 HG12 ILE 25 92.742 -16.324 5.755 194 HG21 ILE 25 HG21 ILE 25 91.897 -16.667 3.250 195 HG22 ILE 25 HG22 ILE 25 91.116 -15.267 2.477 196 HG23 ILE 25 HG23 ILE 25 92.889 -15.424 2.450 197 HD11 ILE 25 HD11 ILE 25 94.229 -16.903 4.077 198 HD12 ILE 25 HD12 ILE 25 94.438 -15.221 3.535 199 HD13 ILE 25 HD13 ILE 25 95.267 -15.792 5.002 200 H VAL 26 H VAL 26 90.751 -11.549 3.689 201 HA VAL 26 HA VAL 26 90.142 -12.270 0.880 202 HB VAL 26 HB VAL 26 89.281 -9.769 2.389 203 HG11 VAL 26 HG11 VAL 26 88.841 -9.835 -0.052 204 HG12 VAL 26 HG12 VAL 26 88.027 -11.407 0.138 205 HG13 VAL 26 HG13 VAL 26 87.325 -9.946 0.873 206 HG21 VAL 26 HG21 VAL 26 87.298 -11.080 3.099 207 HG22 VAL 26 HG22 VAL 26 88.795 -11.779 3.759 208 HG23 VAL 26 HG23 VAL 26 87.999 -12.540 2.361 209 H LYS 27 H LYS 27 91.320 -9.267 2.481 210 HA LYS 27 HA LYS 27 92.219 -8.078 -0.003 211 HB2 LYS 27 HB2 LYS 27 92.697 -7.599 2.930 212 HB3 LYS 27 HB3 LYS 27 93.813 -6.840 1.769 213 HG2 LYS 27 HG3 LYS 27 92.147 -5.509 0.830 214 HG3 LYS 27 HG2 LYS 27 90.849 -6.648 1.259 215 HD2 LYS 27 HD3 LYS 27 92.389 -5.316 3.480 216 HD3 LYS 27 HD2 LYS 27 91.164 -4.367 2.604 217 HE2 LYS 27 HE2 LYS 27 90.601 -7.123 3.768 218 HE3 LYS 27 HE3 LYS 27 90.319 -5.615 4.671 219 HZ1 LYS 27 HZ1 LYS 27 88.343 -6.340 3.506 220 HZ2 LYS 27 HZ2 LYS 27 89.129 -6.299 2.057 221 HZ3 LYS 27 HZ3 LYS 27 88.866 -4.901 2.892 222 H ARG 28 H ARG 28 93.643 -10.381 2.247 223 HA ARG 28 HA ARG 28 96.378 -10.123 1.243 224 HB2 ARG 28 HB3 ARG 28 95.757 -11.165 3.447 225 HB3 ARG 28 HB2 ARG 28 95.038 -12.528 2.558 226 HG2 ARG 28 HG2 ARG 28 97.390 -12.631 1.367 227 HG3 ARG 28 HG3 ARG 28 97.942 -11.720 2.793 228 HD2 ARG 28 HD2 ARG 28 96.888 -14.530 2.603 229 HD3 ARG 28 HD3 ARG 28 98.222 -13.883 3.588 230 HE ARG 28 HE ARG 28 95.463 -14.152 4.452 231 HH11 ARG 28 HH11 ARG 28 94.913 -13.174 6.413 232 HH12 ARG 28 HH12 ARG 28 95.936 -11.925 7.086 233 HH21 ARG 28 HH21 ARG 28 98.235 -12.046 4.473 234 HH22 ARG 28 HH22 ARG 28 97.810 -11.289 5.992 235 H LYS 29 H LYS 29 93.633 -12.318 0.505 236 HA LYS 29 HA LYS 29 95.114 -13.891 -1.438 237 HB2 LYS 29 HB3 LYS 29 92.872 -14.470 -0.334 238 HB3 LYS 29 HB2 LYS 29 92.121 -13.341 -1.487 239 HG2 LYS 29 HG2 LYS 29 93.096 -14.633 -3.374 240 HG3 LYS 29 HG3 LYS 29 93.818 -15.772 -2.212 241 HD2 LYS 29 HD3 LYS 29 91.542 -16.315 -1.355 242 HD3 LYS 29 HD2 LYS 29 90.838 -15.208 -2.558 243 HE2 LYS 29 HE2 LYS 29 92.542 -17.660 -3.188 244 HE3 LYS 29 HE3 LYS 29 90.772 -17.560 -3.350 245 HZ1 LYS 29 HZ1 LYS 29 91.882 -17.135 -5.440 246 HZ2 LYS 29 HZ2 LYS 29 92.723 -15.875 -4.789 247 HZ3 LYS 29 HZ3 LYS 29 91.083 -15.782 -4.939 248 H LEU 30 H LEU 30 93.312 -10.842 -1.618 249 HA LEU 30 HA LEU 30 93.564 -10.800 -4.585 250 HB2 LEU 30 HB2 LEU 30 92.487 -8.766 -2.589 251 HB3 LEU 30 HB3 LEU 30 92.495 -8.533 -4.353 252 HG LEU 30 HG LEU 30 91.301 -11.053 -3.192 253 HD11 LEU 30 HD11 LEU 30 90.280 -9.187 -1.917 254 HD12 LEU 30 HD12 LEU 30 89.895 -8.356 -3.443 255 HD13 LEU 30 HD13 LEU 30 89.109 -9.903 -3.049 256 HD21 LEU 30 HD21 LEU 30 91.620 -10.815 -5.640 257 HD22 LEU 30 HD22 LEU 30 90.677 -9.306 -5.615 258 HD23 LEU 30 HD23 LEU 30 89.891 -10.854 -5.221 259 H ALA 31 H ALA 31 95.396 -9.970 -1.887 260 HA ALA 31 HA ALA 31 96.863 -7.752 -3.222 261 HB1 ALA 31 HB1 ALA 31 98.360 -8.048 -1.122 262 HB2 ALA 31 HB2 ALA 31 96.691 -7.484 -0.867 263 HB3 ALA 31 HB3 ALA 31 97.113 -9.185 -0.557 264 H ALA 32 H ALA 32 97.307 -11.205 -2.472 265 HA ALA 32 HA ALA 32 100.035 -11.565 -2.985 266 HB1 ALA 32 HB1 ALA 32 99.448 -13.789 -3.912 267 HB2 ALA 32 HB2 ALA 32 97.757 -13.267 -4.094 268 HB3 ALA 32 HB3 ALA 32 98.471 -13.419 -2.471 269 H HIS 33 H HIS 33 97.696 -10.245 -5.135 270 HA HIS 33 HA HIS 33 99.147 -10.982 -7.607 271 HB2 HIS 33 HB2 HIS 33 96.906 -9.005 -7.010 272 HB3 HIS 33 HB3 HIS 33 97.576 -9.268 -8.638 273 HD2 HIS 33 HD2 HIS 33 95.917 -11.053 -9.922 274 HE1 HIS 33 HE1 HIS 33 95.016 -13.553 -6.640 275 HE2 HIS 33 HE2 HIS 33 94.630 -13.203 -9.140 276 H ASP 34 H ASP 34 100.967 -9.872 -5.814 277 HA ASP 34 HA ASP 34 101.402 -7.106 -5.792 278 HB2 ASP 34 HB2 ASP 34 103.719 -8.873 -6.566 279 HB3 ASP 34 HB3 ASP 34 103.641 -7.578 -5.347 280 H ASN 35 H ASN 35 100.527 -6.132 -7.690 281 HA ASN 35 HA ASN 35 102.457 -6.145 -9.980 282 HB2 ASN 35 HB2 ASN 35 100.681 -7.860 -10.499 283 HB3 ASN 35 HB3 ASN 35 99.462 -6.569 -10.377 284 HD21 ASN 35 HD21 ASN 35 99.492 -7.706 -12.832 285 HD22 ASN 35 HD22 ASN 35 100.348 -6.715 -13.993 286 H LEU 36 H LEU 36 102.048 -4.170 -7.996 287 HA LEU 36 HA LEU 36 100.242 -2.161 -9.307 288 HB2 LEU 36 HB2 LEU 36 100.520 -0.854 -7.258 289 HB3 LEU 36 HB3 LEU 36 100.093 -2.528 -6.834 290 HG LEU 36 HG LEU 36 103.012 -2.040 -7.085 291 HD11 LEU 36 HD11 LEU 36 102.300 0.124 -6.099 292 HD12 LEU 36 HD12 LEU 36 103.174 -0.867 -4.907 293 HD13 LEU 36 HD13 LEU 36 101.399 -0.749 -4.837 294 HD21 LEU 36 HD21 LEU 36 102.116 -4.147 -6.228 295 HD22 LEU 36 HD22 LEU 36 102.954 -3.299 -4.906 296 HD23 LEU 36 HD23 LEU 36 101.176 -3.282 -4.988 297 H LYS 37 H LYS 37 101.168 0.180 -9.110 298 HA LYS 37 HA LYS 37 104.005 0.139 -10.170 299 HB2 LYS 37 HB2 LYS 37 101.515 1.590 -11.078 300 HB3 LYS 37 HB3 LYS 37 103.102 2.361 -11.312 301 HG2 LYS 37 HG2 LYS 37 103.841 0.704 -12.784 302 HG3 LYS 37 HG3 LYS 37 102.736 -0.524 -12.120 303 HD2 LYS 37 HD2 LYS 37 100.884 0.320 -13.295 304 HD3 LYS 37 HD3 LYS 37 101.621 1.928 -13.497 305 HE2 LYS 37 HE2 LYS 37 103.016 1.213 -15.244 306 HE3 LYS 37 HE3 LYS 37 102.929 -0.494 -14.748 307 HZ1 LYS 37 HZ1 LYS 37 101.597 -0.067 -16.703 308 HZ2 LYS 37 HZ2 LYS 37 100.628 -0.511 -15.444 309 HZ3 LYS 37 HZ3 LYS 37 100.709 1.071 -15.904 310 H LEU 38 H LEU 38 105.310 1.991 -9.570 311 HA LEU 38 HA LEU 38 104.101 3.737 -7.434 312 HB2 LEU 38 HB2 LEU 38 106.799 2.352 -7.127 313 HB3 LEU 38 HB3 LEU 38 105.950 3.344 -5.918 314 HG LEU 38 HG LEU 38 104.009 1.558 -6.312 315 HD11 LEU 38 HD11 LEU 38 105.795 -0.632 -6.438 316 HD12 LEU 38 HD12 LEU 38 106.289 0.453 -7.760 317 HD13 LEU 38 HD13 LEU 38 104.614 -0.143 -7.676 318 HD21 LEU 38 HD21 LEU 38 104.934 0.252 -4.413 319 HD22 LEU 38 HD22 LEU 38 105.173 1.999 -4.169 320 HD23 LEU 38 HD23 LEU 38 106.534 0.980 -4.695 321 H THR 39 H THR 39 104.651 5.834 -7.751 322 HA THR 39 HA THR 39 106.814 6.384 -9.767 323 HB THR 39 HB THR 39 105.124 8.566 -8.575 324 HG1 THR 39 HG1 THR 39 103.546 7.046 -8.952 325 HG21 THR 39 HG21 THR 39 105.191 9.356 -10.924 326 HG22 THR 39 HG22 THR 39 106.032 7.862 -11.402 327 HG23 THR 39 HG23 THR 39 106.830 9.024 -10.315 328 H ILE 40 H ILE 40 108.782 6.419 -8.719 329 HA ILE 40 HA ILE 40 108.887 7.931 -6.107 330 HB ILE 40 HB ILE 40 111.273 6.427 -7.098 331 HG12 ILE 40 HG13 ILE 40 110.034 4.366 -5.914 332 HG13 ILE 40 HG12 ILE 40 108.590 5.189 -6.553 333 HG21 ILE 40 HG21 ILE 40 111.219 7.584 -4.905 334 HG22 ILE 40 HG22 ILE 40 111.392 5.824 -4.700 335 HG23 ILE 40 HG23 ILE 40 109.815 6.602 -4.423 336 HD11 ILE 40 HD11 ILE 40 110.542 3.590 -7.971 337 HD12 ILE 40 HD12 ILE 40 109.036 4.314 -8.584 338 HD13 ILE 40 HD13 ILE 40 110.551 5.247 -8.621 339 H THR 41 H THR 41 109.770 9.889 -6.091 340 HA THR 41 HA THR 41 111.789 10.582 -8.221 341 HB THR 41 HB THR 41 109.853 12.651 -7.183 342 HG1 THR 41 HG1 THR 41 108.429 11.131 -7.923 343 HG21 THR 41 HG21 THR 41 110.397 13.772 -9.211 344 HG22 THR 41 HG22 THR 41 111.936 13.065 -8.665 345 HG23 THR 41 HG23 THR 41 111.010 12.281 -9.967 346 H GLN 42 H GLN 42 113.370 12.161 -7.462 347 HA GLN 42 HA GLN 42 113.219 12.679 -4.490 348 HB2 GLN 42 HB2 GLN 42 114.669 10.752 -4.699 349 HB3 GLN 42 HB3 GLN 42 115.563 11.504 -6.042 350 HG2 GLN 42 HG3 GLN 42 116.493 13.189 -4.591 351 HG3 GLN 42 HG2 GLN 42 115.404 12.732 -3.259 352 HE21 GLN 42 HE21 GLN 42 116.607 10.038 -5.102 353 HE22 GLN 42 HE22 GLN 42 117.836 9.538 -3.962 354 H GLU 43 H GLU 43 114.089 14.648 -3.841 355 HA GLU 43 HA GLU 43 115.508 16.267 -5.946 356 HB2 GLU 43 HB2 GLU 43 112.920 16.957 -4.536 357 HB3 GLU 43 HB3 GLU 43 114.039 18.249 -5.031 358 HG2 GLU 43 HG3 GLU 43 113.218 16.082 -6.984 359 HG3 GLU 43 HG2 GLU 43 112.177 17.498 -6.710 360 H GLY 44 H GLY 44 117.318 15.661 -4.496 361 HA2 GLY 44 HA2 GLY 44 118.808 16.166 -2.740 362 HA3 GLY 44 HA3 GLY 44 118.066 17.781 -2.748 363 H ASN 45 H ASN 45 116.231 18.170 -1.349 364 HA ASN 45 HA ASN 45 116.085 16.167 0.918 365 HB2 ASN 45 HB2 ASN 45 115.296 18.456 2.116 366 HB3 ASN 45 HB3 ASN 45 117.004 17.967 2.020 367 HD21 ASN 45 HD21 ASN 45 114.609 20.294 0.897 368 HD22 ASN 45 HD22 ASN 45 115.716 21.256 -0.057 369 H LYS 46 H LYS 46 114.390 16.351 -1.539 370 HA LYS 46 HA LYS 46 111.789 16.442 -0.070 371 HB2 LYS 46 HB2 LYS 46 112.553 18.173 -2.435 372 HB3 LYS 46 HB3 LYS 46 110.871 17.628 -2.238 373 HG2 LYS 46 HG3 LYS 46 110.637 19.456 -0.895 374 HG3 LYS 46 HG2 LYS 46 111.512 18.492 0.319 375 HD2 LYS 46 HD2 LYS 46 112.776 20.477 0.235 376 HD3 LYS 46 HD3 LYS 46 113.664 19.407 -0.876 377 HE2 LYS 46 HE2 LYS 46 112.562 20.415 -2.807 378 HE3 LYS 46 HE3 LYS 46 111.518 21.393 -1.747 379 HZ1 LYS 46 HZ1 LYS 46 113.402 22.654 -2.550 380 HZ2 LYS 46 HZ2 LYS 46 114.461 21.573 -1.896 381 HZ3 LYS 46 HZ3 LYS 46 113.495 22.478 -0.913 382 H PHE 47 H PHE 47 111.153 14.434 -0.373 383 HA PHE 47 HA PHE 47 111.716 13.101 -3.013 384 HB2 PHE 47 HB3 PHE 47 110.891 12.032 -0.281 385 HB3 PHE 47 HB2 PHE 47 110.976 11.022 -1.744 386 HD1 PHE 47 HD1 PHE 47 113.052 13.529 0.146 387 HD2 PHE 47 HD2 PHE 47 112.986 9.941 -2.214 388 HE1 PHE 47 HE1 PHE 47 115.498 13.274 0.464 389 HE2 PHE 47 HE2 PHE 47 115.432 9.685 -1.896 390 HZ PHE 47 HZ PHE 47 116.688 11.350 -0.554 391 H THR 48 H THR 48 109.892 11.666 -3.826 392 HA THR 48 HA THR 48 107.176 12.535 -2.981 393 HB THR 48 HB THR 48 108.131 12.952 -5.848 394 HG1 THR 48 HG1 THR 48 108.891 14.771 -5.106 395 HG21 THR 48 HG21 THR 48 105.971 14.148 -6.075 396 HG22 THR 48 HG22 THR 48 105.720 12.457 -5.579 397 HG23 THR 48 HG23 THR 48 105.582 13.766 -4.380 398 H VAL 49 H VAL 49 106.522 10.451 -2.634 399 HA VAL 49 HA VAL 49 107.032 8.452 -4.835 400 HB VAL 49 HB VAL 49 106.133 8.069 -1.944 401 HG11 VAL 49 HG11 VAL 49 105.186 6.362 -3.475 402 HG12 VAL 49 HG12 VAL 49 106.812 6.044 -4.125 403 HG13 VAL 49 HG13 VAL 49 106.440 5.655 -2.429 404 HG21 VAL 49 HG21 VAL 49 108.378 7.045 -1.685 405 HG22 VAL 49 HG22 VAL 49 108.749 7.430 -3.382 406 HG23 VAL 49 HG23 VAL 49 108.507 8.743 -2.205 407 H LYS 50 H LYS 50 105.295 7.460 -5.890 408 HA LYS 50 HA LYS 50 102.543 8.298 -4.969 409 HB2 LYS 50 HB3 LYS 50 103.722 9.545 -7.077 410 HB3 LYS 50 HB2 LYS 50 103.013 8.145 -7.917 411 HG2 LYS 50 HG2 LYS 50 100.857 8.747 -6.520 412 HG3 LYS 50 HG3 LYS 50 101.630 10.343 -6.366 413 HD2 LYS 50 HD2 LYS 50 101.976 10.100 -8.978 414 HD3 LYS 50 HD3 LYS 50 100.645 8.925 -8.845 415 HE2 LYS 50 HE3 LYS 50 99.482 10.929 -9.214 416 HE3 LYS 50 HE2 LYS 50 99.479 10.829 -7.437 417 HZ1 LYS 50 HZ1 LYS 50 100.173 13.000 -8.205 418 HZ2 LYS 50 HZ2 LYS 50 101.419 12.347 -9.066 419 HZ3 LYS 50 HZ3 LYS 50 101.417 12.254 -7.419 420 H GLU 51 H GLU 51 101.909 6.264 -4.275 421 HA GLU 51 HA GLU 51 102.528 3.846 -5.825 422 HB2 GLU 51 HB3 GLU 51 100.435 4.329 -3.654 423 HB3 GLU 51 HB2 GLU 51 100.959 2.738 -4.257 424 HG2 GLU 51 HG2 GLU 51 103.073 2.911 -3.271 425 HG3 GLU 51 HG3 GLU 51 103.026 4.690 -3.239 426 H SER 52 H SER 52 100.887 2.519 -6.945 427 HA SER 52 HA SER 52 98.321 3.848 -7.595 428 HB2 SER 52 HB2 SER 52 100.113 3.172 -9.937 429 HB3 SER 52 HB3 SER 52 98.697 4.250 -9.879 430 HG SER 52 HG SER 52 100.611 5.482 -9.911 431 H SER 53 H SER 53 97.111 2.158 -7.129 432 HA SER 53 HA SER 53 97.596 -0.379 -8.676 433 HB2 SER 53 HB2 SER 53 96.662 -1.511 -6.481 434 HB3 SER 53 HB3 SER 53 98.389 -1.090 -6.578 435 HG SER 53 HG SER 53 97.087 -0.364 -4.639 436 H ALA 54 H ALA 54 95.651 -1.387 -9.325 437 HA ALA 54 HA ALA 54 93.356 0.291 -9.650 438 HB1 ALA 54 HB1 ALA 54 92.152 -1.793 -10.252 439 HB2 ALA 54 HB2 ALA 54 93.768 -1.752 -10.996 440 HB3 ALA 54 HB3 ALA 54 93.476 -2.758 -9.557 441 H PHE 55 H PHE 55 94.548 -0.579 -6.765 442 HA PHE 55 HA PHE 55 91.855 -1.186 -5.555 443 HB2 PHE 55 HB3 PHE 55 93.659 -2.750 -4.963 444 HB3 PHE 55 HB2 PHE 55 94.664 -1.398 -4.390 445 HD1 PHE 55 HD1 PHE 55 94.491 -0.671 -2.165 446 HD2 PHE 55 HD2 PHE 55 91.320 -3.020 -3.861 447 HE1 PHE 55 HE1 PHE 55 93.395 -0.798 0.058 448 HE2 PHE 55 HE2 PHE 55 90.225 -3.147 -1.640 449 HZ PHE 55 HZ PHE 55 91.263 -2.034 0.320 450 H ARG 56 H ARG 56 94.414 1.259 -5.682 451 HA ARG 56 HA ARG 56 92.901 3.438 -4.876 452 HB2 ARG 56 HB2 ARG 56 93.386 1.640 -2.577 453 HB3 ARG 56 HB3 ARG 56 93.910 3.316 -2.287 454 HG2 ARG 56 HG2 ARG 56 91.220 2.831 -3.564 455 HG3 ARG 56 HG3 ARG 56 91.395 2.587 -1.810 456 HD2 ARG 56 HD2 ARG 56 91.788 4.829 -1.398 457 HD3 ARG 56 HD3 ARG 56 92.565 5.092 -2.978 458 HE ARG 56 HE ARG 56 90.416 5.535 -3.936 459 HH11 ARG 56 HH11 ARG 56 88.202 5.921 -3.699 460 HH12 ARG 56 HH12 ARG 56 87.389 5.472 -2.217 461 HH21 ARG 56 HH21 ARG 56 90.268 4.202 -0.723 462 HH22 ARG 56 HH22 ARG 56 88.554 4.503 -0.539 463 H ASN 57 H ASN 57 94.540 4.278 -6.251 464 HA ASN 57 HA ASN 57 97.366 4.095 -5.685 465 HB2 ASN 57 HB2 ASN 57 97.605 5.957 -7.245 466 HB3 ASN 57 HB3 ASN 57 96.346 4.859 -7.859 467 HD21 ASN 57 HD21 ASN 57 96.991 8.108 -7.442 468 HD22 ASN 57 HD22 ASN 57 95.353 8.697 -7.267 469 H ILE 58 H ILE 58 98.762 5.494 -4.553 470 HA ILE 58 HA ILE 58 97.406 7.631 -2.907 471 HB ILE 58 HB ILE 58 99.625 5.997 -1.706 472 HG12 ILE 58 HG12 ILE 58 96.776 5.116 -2.178 473 HG13 ILE 58 HG13 ILE 58 98.279 4.163 -2.252 474 HG21 ILE 58 HG21 ILE 58 98.474 8.148 -0.755 475 HG22 ILE 58 HG22 ILE 58 97.109 7.065 -0.394 476 HG23 ILE 58 HG23 ILE 58 98.704 6.759 0.333 477 HD11 ILE 58 HD11 ILE 58 97.301 3.472 -0.214 478 HD12 ILE 58 HD12 ILE 58 96.748 5.116 0.183 479 HD13 ILE 58 HD13 ILE 58 98.477 4.708 0.295 480 H GLU 59 H GLU 59 99.173 8.971 -1.759 481 HA GLU 59 HA GLU 59 101.702 9.159 -3.339 482 HB2 GLU 59 HB3 GLU 59 101.362 11.382 -4.108 483 HB3 GLU 59 HB2 GLU 59 99.829 10.553 -4.469 484 HG2 GLU 59 HG2 GLU 59 99.176 11.387 -2.030 485 HG3 GLU 59 HG3 GLU 59 100.447 12.594 -2.336 486 H CYS 60 H CYS 60 103.345 10.271 -2.220 487 HA CYS 60 HA CYS 60 102.650 11.552 0.387 488 HB2 CYS 60 HB3 CYS 60 103.497 8.807 0.215 489 HB3 CYS 60 HB2 CYS 60 104.832 9.753 0.917 490 HG CYS 60 HG CYS 60 101.731 10.493 2.140 491 H VAL 61 H VAL 61 103.711 13.457 0.097 492 HA VAL 61 HA VAL 61 106.484 13.333 -1.102 493 HB VAL 61 HB VAL 61 105.090 15.949 -0.729 494 HG11 VAL 61 HG11 VAL 61 106.026 16.271 -3.041 495 HG12 VAL 61 HG12 VAL 61 106.663 14.611 -2.970 496 HG13 VAL 61 HG13 VAL 61 107.262 15.843 -1.834 497 HG21 VAL 61 HG21 VAL 61 103.835 15.494 -2.930 498 HG22 VAL 61 HG22 VAL 61 103.168 14.734 -1.465 499 HG23 VAL 61 HG23 VAL 61 104.126 13.767 -2.613 500 H PHE 62 H PHE 62 108.211 14.280 0.062 501 HA PHE 62 HA PHE 62 107.876 16.029 2.308 502 HB2 PHE 62 HB2 PHE 62 107.341 13.182 2.870 503 HB3 PHE 62 HB3 PHE 62 108.582 13.888 3.932 504 HD1 PHE 62 HD1 PHE 62 105.194 13.274 3.750 505 HD2 PHE 62 HD2 PHE 62 107.902 16.509 4.553 506 HE1 PHE 62 HE1 PHE 62 103.426 14.433 5.047 507 HE2 PHE 62 HE2 PHE 62 106.136 17.667 5.851 508 HZ PHE 62 HZ PHE 62 103.896 16.629 6.097 509 H GLU 63 H GLU 63 109.853 16.032 3.775 510 HA GLU 63 HA GLU 63 112.258 15.510 2.059 511 HB2 GLU 63 HB3 GLU 63 112.157 17.739 2.982 512 HB3 GLU 63 HB2 GLU 63 111.780 17.115 4.606 513 HG2 GLU 63 HG2 GLU 63 113.993 16.130 4.809 514 HG3 GLU 63 HG3 GLU 63 114.373 16.522 3.115 515 H LEU 64 H LEU 64 114.076 14.296 2.893 516 HA LEU 64 HA LEU 64 113.226 12.088 4.653 517 HB2 LEU 64 HB2 LEU 64 115.263 11.061 4.092 518 HB3 LEU 64 HB3 LEU 64 114.926 12.050 2.652 519 HG LEU 64 HG LEU 64 116.304 13.897 3.934 520 HD11 LEU 64 HD11 LEU 64 118.147 12.030 5.053 521 HD12 LEU 64 HD12 LEU 64 117.183 13.252 5.916 522 HD13 LEU 64 HD13 LEU 64 116.544 11.606 5.698 523 HD21 LEU 64 HD21 LEU 64 118.379 13.018 2.892 524 HD22 LEU 64 HD22 LEU 64 116.977 12.804 1.816 525 HD23 LEU 64 HD23 LEU 64 117.616 11.417 2.731 526 H GLY 65 H GLY 65 113.579 11.886 6.826 527 HA2 GLY 65 HA2 GLY 65 114.916 12.316 8.844 528 HA3 GLY 65 HA3 GLY 65 115.501 13.825 8.105 529 H VAL 66 H VAL 66 112.122 13.063 7.756 530 HA VAL 66 HA VAL 66 111.422 14.763 10.132 531 HB VAL 66 HB VAL 66 110.392 15.331 7.318 532 HG11 VAL 66 HG11 VAL 66 108.822 15.872 9.160 533 HG12 VAL 66 HG12 VAL 66 109.453 17.353 8.400 534 HG13 VAL 66 HG13 VAL 66 110.098 16.814 9.969 535 HG21 VAL 66 HG21 VAL 66 111.726 17.520 7.748 536 HG22 VAL 66 HG22 VAL 66 112.651 16.067 7.298 537 HG23 VAL 66 HG23 VAL 66 112.585 16.589 8.999 538 H THR 67 H THR 67 110.166 13.286 11.199 539 HA THR 67 HA THR 67 108.740 11.117 10.136 540 HB THR 67 HB THR 67 107.447 12.788 12.290 541 HG1 THR 67 HG1 THR 67 109.560 12.911 12.906 542 HG21 THR 67 HG21 THR 67 107.101 10.545 13.293 543 HG22 THR 67 HG22 THR 67 106.456 10.612 11.635 544 HG23 THR 67 HG23 THR 67 108.011 9.806 11.954 545 H PHE 68 H PHE 68 106.743 10.764 9.315 546 HA PHE 68 HA PHE 68 104.769 12.930 9.026 547 HB2 PHE 68 HB2 PHE 68 104.793 12.404 6.406 548 HB3 PHE 68 HB3 PHE 68 105.796 13.699 7.096 549 HD1 PHE 68 HD1 PHE 68 106.098 9.940 6.835 550 HD2 PHE 68 HD2 PHE 68 107.900 13.781 6.160 551 HE1 PHE 68 HE1 PHE 68 108.139 8.834 5.948 552 HE2 PHE 68 HE2 PHE 68 109.934 12.674 5.283 553 HZ PHE 68 HZ PHE 68 110.051 10.203 5.175 554 H ASN 69 H ASN 69 103.115 11.819 7.132 555 HA ASN 69 HA ASN 69 102.836 8.984 8.150 556 HB2 ASN 69 HB2 ASN 69 100.600 10.963 7.526 557 HB3 ASN 69 HB3 ASN 69 100.395 9.296 8.115 558 HD21 ASN 69 HD21 ASN 69 102.759 11.851 9.136 559 HD22 ASN 69 HD22 ASN 69 102.250 11.848 10.809 560 H CYS 70 H CYS 70 101.873 7.482 6.695 561 HA CYS 70 HA CYS 70 101.296 8.330 3.916 562 HB2 CYS 70 HB2 CYS 70 103.750 6.660 4.613 563 HB3 CYS 70 HB3 CYS 70 103.040 6.728 2.983 564 HG CYS 70 HG CYS 70 105.204 8.829 4.291 565 H ASN 71 H ASN 71 99.714 6.972 3.170 566 HA ASN 71 HA ASN 71 99.108 4.595 4.877 567 HB2 ASN 71 HB2 ASN 71 97.603 5.881 2.560 568 HB3 ASN 71 HB3 ASN 71 97.018 4.487 3.499 569 HD21 ASN 71 HD21 ASN 71 95.358 5.328 4.797 570 HD22 ASN 71 HD22 ASN 71 95.536 6.739 5.816 571 H LEU 72 H LEU 72 98.971 2.469 4.083 572 HA LEU 72 HA LEU 72 100.617 2.031 1.599 573 HB2 LEU 72 HB2 LEU 72 99.845 0.272 3.956 574 HB3 LEU 72 HB3 LEU 72 100.572 -0.398 2.476 575 HG LEU 72 HG LEU 72 101.825 1.909 4.016 576 HD11 LEU 72 HD11 LEU 72 102.640 -1.015 4.210 577 HD12 LEU 72 HD12 LEU 72 101.525 -0.262 5.375 578 HD13 LEU 72 HD13 LEU 72 103.188 0.350 5.212 579 HD21 LEU 72 HD21 LEU 72 102.536 1.583 1.660 580 HD22 LEU 72 HD22 LEU 72 103.853 1.181 2.788 581 HD23 LEU 72 HD23 LEU 72 102.918 -0.119 2.012 582 H ALA 73 H ALA 73 99.842 0.743 -0.112 583 HA ALA 73 HA ALA 73 97.202 1.003 -0.958 584 HB1 ALA 73 HB1 ALA 73 97.563 -1.006 -2.367 585 HB2 ALA 73 HB2 ALA 73 98.969 -1.452 -1.370 586 HB3 ALA 73 HB3 ALA 73 99.008 0.033 -2.351 587 H ASP 74 H ASP 74 98.455 -1.342 1.386 588 HA ASP 74 HA ASP 74 96.094 -3.032 1.429 589 HB2 ASP 74 HB3 ASP 74 98.185 -3.791 2.433 590 HB3 ASP 74 HB2 ASP 74 98.179 -2.421 3.570 591 H GLY 75 H GLY 75 95.932 0.100 1.705 592 HA2 GLY 75 HA3 GLY 75 94.386 1.547 2.756 593 HA3 GLY 75 HA2 GLY 75 93.519 0.095 3.313 594 H THR 76 H THR 76 96.920 0.568 4.058 595 HA THR 76 HA THR 76 96.144 0.766 6.953 596 HB THR 76 HB THR 76 99.011 0.552 6.238 597 HG1 THR 76 HG1 THR 76 98.191 -0.735 4.588 598 HG21 THR 76 HG21 THR 76 98.902 -1.221 7.967 599 HG22 THR 76 HG22 THR 76 97.128 -1.085 7.993 600 HG23 THR 76 HG23 THR 76 98.133 0.280 8.537 601 H GLU 77 H GLU 77 97.428 2.241 8.318 602 HA GLU 77 HA GLU 77 98.428 4.653 6.803 603 HB2 GLU 77 HB2 GLU 77 96.044 4.914 7.732 604 HB3 GLU 77 HB3 GLU 77 96.774 4.813 9.352 605 HG2 GLU 77 HG3 GLU 77 98.143 6.764 8.936 606 HG3 GLU 77 HG2 GLU 77 97.677 6.790 7.219 607 H LEU 78 H LEU 78 100.528 5.010 7.417 608 HA LEU 78 HA LEU 78 101.197 4.454 10.311 609 HB2 LEU 78 HB3 LEU 78 103.219 3.813 8.171 610 HB3 LEU 78 HB2 LEU 78 103.049 3.135 9.808 611 HG LEU 78 HG LEU 78 100.748 2.226 8.880 612 HD11 LEU 78 HD11 LEU 78 101.849 1.692 6.290 613 HD12 LEU 78 HD12 LEU 78 100.369 2.597 6.686 614 HD13 LEU 78 HD13 LEU 78 101.924 3.451 6.548 615 HD21 LEU 78 HD21 LEU 78 101.910 0.162 8.142 616 HD22 LEU 78 HD22 LEU 78 103.438 1.066 8.022 617 HD23 LEU 78 HD23 LEU 78 102.664 0.832 9.608 618 H ARG 79 H ARG 79 103.267 5.511 10.980 619 HA ARG 79 HA ARG 79 104.032 7.832 9.228 620 HB2 ARG 79 HB2 ARG 79 103.813 9.409 11.106 621 HB3 ARG 79 HB3 ARG 79 102.245 8.636 10.770 622 HG2 ARG 79 HG2 ARG 79 102.761 6.955 12.579 623 HG3 ARG 79 HG3 ARG 79 104.221 7.894 12.972 624 HD2 ARG 79 HD3 ARG 79 102.918 9.822 13.593 625 HD3 ARG 79 HD2 ARG 79 101.431 9.112 12.920 626 HE ARG 79 HE ARG 79 101.162 7.883 14.935 627 HH11 ARG 79 HH11 ARG 79 101.856 7.219 16.982 628 HH12 ARG 79 HH12 ARG 79 103.506 7.512 17.484 629 HH21 ARG 79 HH21 ARG 79 104.408 9.066 14.502 630 HH22 ARG 79 HH22 ARG 79 104.944 8.553 16.087 631 H GLY 80 H GLY 80 106.184 8.403 9.424 632 HA2 GLY 80 HA3 GLY 80 107.858 7.970 11.676 633 HA3 GLY 80 HA2 GLY 80 107.979 6.506 10.666 634 H THR 81 H THR 81 109.587 6.608 9.163 635 HA THR 81 HA THR 81 109.865 8.700 7.254 636 HB THR 81 HB THR 81 112.249 9.287 8.741 637 HG1 THR 81 HG1 THR 81 111.451 9.961 10.670 638 HG21 THR 81 HG21 THR 81 111.277 11.602 8.676 639 HG22 THR 81 HG22 THR 81 111.243 10.779 7.099 640 HG23 THR 81 HG23 THR 81 109.757 10.904 8.069 641 H TRP 82 H TRP 82 111.757 8.483 5.921 642 HA TRP 82 HA TRP 82 113.073 5.797 6.303 643 HB2 TRP 82 HB2 TRP 82 113.242 7.510 3.805 644 HB3 TRP 82 HB3 TRP 82 113.456 5.751 3.963 645 HD1 TRP 82 HD1 TRP 82 110.651 8.353 4.561 646 HE1 TRP 82 HE1 TRP 82 108.395 7.322 3.868 647 HE3 TRP 82 HE3 TRP 82 112.271 3.700 3.246 648 HZ2 TRP 82 HZ2 TRP 82 107.435 4.782 2.867 649 HZ3 TRP 82 HZ3 TRP 82 110.674 1.992 2.428 650 HH2 TRP 82 HH2 TRP 82 108.259 2.526 2.236 651 H SER 83 H SER 83 115.321 5.632 6.408 652 HA SER 83 HA SER 83 116.882 8.194 6.163 653 HB2 SER 83 HB3 SER 83 117.792 6.572 8.429 654 HB3 SER 83 HB2 SER 83 117.411 8.310 8.366 655 HG SER 83 HG SER 83 115.950 7.229 9.746 656 H LEU 84 H LEU 84 119.233 7.741 5.868 657 HA LEU 84 HA LEU 84 119.520 5.064 4.564 658 HB2 LEU 84 HB3 LEU 84 120.556 6.429 3.068 659 HB3 LEU 84 HB2 LEU 84 120.735 7.739 4.258 660 HG LEU 84 HG LEU 84 122.631 6.422 5.295 661 HD11 LEU 84 HD11 LEU 84 123.174 4.887 2.868 662 HD12 LEU 84 HD12 LEU 84 121.636 4.392 3.613 663 HD13 LEU 84 HD13 LEU 84 123.141 4.344 4.562 664 HD21 LEU 84 HD21 LEU 84 124.252 7.027 3.517 665 HD22 LEU 84 HD22 LEU 84 122.915 7.178 2.351 666 HD23 LEU 84 HD23 LEU 84 123.027 8.302 3.728 667 H GLU 85 H GLU 85 120.533 3.430 5.571 668 HA GLU 85 HA GLU 85 122.330 4.117 7.907 669 HB2 GLU 85 HB3 GLU 85 120.072 2.161 7.641 670 HB3 GLU 85 HB2 GLU 85 121.508 1.620 8.544 671 HG2 GLU 85 HG2 GLU 85 120.326 4.341 9.113 672 HG3 GLU 85 HG3 GLU 85 119.565 2.890 9.808 673 H GLY 86 H GLY 86 124.382 3.642 7.285 674 HA2 GLY 86 HA3 GLY 86 126.164 2.417 6.325 675 HA3 GLY 86 HA2 GLY 86 125.113 0.981 6.411 676 H ASN 87 H ASN 87 124.233 0.211 4.519 677 HA ASN 87 HA ASN 87 124.453 2.036 2.112 678 HB2 ASN 87 HB2 ASN 87 126.190 0.270 2.052 679 HB3 ASN 87 HB3 ASN 87 124.929 -0.975 2.221 680 HD21 ASN 87 HD21 ASN 87 125.498 1.961 0.139 681 HD22 ASN 87 HD22 ASN 87 125.022 1.163 -1.343 682 H LYS 88 H LYS 88 122.087 1.615 3.850 683 HA LYS 88 HA LYS 88 120.297 0.593 1.668 684 HB2 LYS 88 HB2 LYS 88 118.971 -0.695 3.404 685 HB3 LYS 88 HB3 LYS 88 120.577 -1.374 3.047 686 HG2 LYS 88 HG2 LYS 88 120.441 0.655 5.243 687 HG3 LYS 88 HG3 LYS 88 119.699 -0.928 5.576 688 HD2 LYS 88 HD3 LYS 88 121.845 -2.015 4.795 689 HD3 LYS 88 HD2 LYS 88 122.566 -0.391 4.685 690 HE2 LYS 88 HE2 LYS 88 123.197 -0.951 6.849 691 HE3 LYS 88 HE3 LYS 88 121.619 -0.199 7.184 692 HZ1 LYS 88 HZ1 LYS 88 121.832 -2.338 8.261 693 HZ2 LYS 88 HZ2 LYS 88 122.098 -3.089 6.817 694 HZ3 LYS 88 HZ3 LYS 88 120.636 -2.392 7.127 695 H LEU 89 H LEU 89 118.161 1.443 1.763 696 HA LEU 89 HA LEU 89 117.979 3.927 3.440 697 HB2 LEU 89 HB2 LEU 89 116.716 2.920 0.912 698 HB3 LEU 89 HB3 LEU 89 115.730 3.991 1.936 699 HG LEU 89 HG LEU 89 118.592 4.741 1.325 700 HD11 LEU 89 HD11 LEU 89 117.569 4.193 -0.867 701 HD12 LEU 89 HD12 LEU 89 116.185 5.244 -0.483 702 HD13 LEU 89 HD13 LEU 89 117.806 5.948 -0.693 703 HD21 LEU 89 HD21 LEU 89 117.275 6.023 2.990 704 HD22 LEU 89 HD22 LEU 89 116.014 6.313 1.768 705 HD23 LEU 89 HD23 LEU 89 117.635 7.017 1.557 706 H ILE 90 H ILE 90 117.160 3.527 5.450 707 HA ILE 90 HA ILE 90 115.318 1.259 5.866 708 HB ILE 90 HB ILE 90 115.172 2.499 8.216 709 HG12 ILE 90 HG12 ILE 90 117.820 3.495 7.113 710 HG13 ILE 90 HG13 ILE 90 116.365 4.517 7.233 711 HG21 ILE 90 HG21 ILE 90 116.207 0.290 7.766 712 HG22 ILE 90 HG22 ILE 90 117.208 1.255 8.877 713 HG23 ILE 90 HG23 ILE 90 117.673 1.101 7.166 714 HD11 ILE 90 HD11 ILE 90 116.250 4.170 9.632 715 HD12 ILE 90 HD12 ILE 90 117.570 2.978 9.566 716 HD13 ILE 90 HD13 ILE 90 117.902 4.693 9.225 717 H GLY 91 H GLY 91 113.261 1.548 7.005 718 HA2 GLY 91 HA2 GLY 91 111.844 4.131 6.482 719 HA3 GLY 91 HA3 GLY 91 111.211 2.676 5.673 720 H LYS 92 H LYS 92 111.561 4.360 8.712 721 HA LYS 92 HA LYS 92 110.404 2.063 10.232 722 HB2 LYS 92 HB3 LYS 92 110.738 3.438 12.197 723 HB3 LYS 92 HB2 LYS 92 112.194 3.595 11.187 724 HG2 LYS 92 HG2 LYS 92 110.823 5.639 10.146 725 HG3 LYS 92 HG3 LYS 92 110.014 5.597 11.730 726 HD2 LYS 92 HD2 LYS 92 113.036 5.709 11.333 727 HD3 LYS 92 HD3 LYS 92 112.012 7.120 11.689 728 HE2 LYS 92 HE2 LYS 92 112.817 6.440 13.817 729 HE3 LYS 92 HE3 LYS 92 111.179 5.749 13.734 730 HZ1 LYS 92 HZ1 LYS 92 113.380 4.346 14.283 731 HZ2 LYS 92 HZ2 LYS 92 113.255 4.078 12.660 732 HZ3 LYS 92 HZ3 LYS 92 112.001 3.690 13.659 733 H PHE 93 H PHE 93 108.251 1.758 9.911 734 HA PHE 93 HA PHE 93 106.525 4.244 9.878 735 HB2 PHE 93 HB2 PHE 93 106.439 1.684 8.298 736 HB3 PHE 93 HB3 PHE 93 104.897 2.465 8.713 737 HD1 PHE 93 HD1 PHE 93 107.229 5.064 8.628 738 HD2 PHE 93 HD2 PHE 93 105.145 2.391 5.986 739 HE1 PHE 93 HE1 PHE 93 107.545 6.662 6.760 740 HE2 PHE 93 HE2 PHE 93 105.461 3.994 4.120 741 HZ PHE 93 HZ PHE 93 106.661 6.128 4.508 742 H LYS 94 H LYS 94 104.909 4.362 11.319 743 HA LYS 94 HA LYS 94 104.462 1.925 13.052 744 HB2 LYS 94 HB2 LYS 94 104.581 4.881 13.712 745 HB3 LYS 94 HB3 LYS 94 103.708 3.740 14.762 746 HG2 LYS 94 HG2 LYS 94 105.744 2.384 15.024 747 HG3 LYS 94 HG3 LYS 94 106.624 3.460 13.912 748 HD2 LYS 94 HD3 LYS 94 106.182 5.369 15.476 749 HD3 LYS 94 HD2 LYS 94 105.416 4.228 16.606 750 HE2 LYS 94 HE2 LYS 94 107.468 3.042 16.954 751 HE3 LYS 94 HE3 LYS 94 108.249 3.844 15.570 752 HZ1 LYS 94 HZ1 LYS 94 108.924 4.821 17.662 753 HZ2 LYS 94 HZ2 LYS 94 107.362 5.180 18.049 754 HZ3 LYS 94 HZ3 LYS 94 108.085 5.924 16.767 755 H ARG 95 H ARG 95 102.514 1.057 12.618 756 HA ARG 95 HA ARG 95 100.447 2.222 11.086 757 HB2 ARG 95 HB2 ARG 95 100.148 0.314 13.453 758 HB3 ARG 95 HB3 ARG 95 98.912 0.614 12.208 759 HG2 ARG 95 HG2 ARG 95 100.960 0.014 10.575 760 HG3 ARG 95 HG3 ARG 95 101.509 -0.885 12.010 761 HD2 ARG 95 HD3 ARG 95 98.734 -1.138 10.764 762 HD3 ARG 95 HD2 ARG 95 100.079 -2.267 10.472 763 HE ARG 95 HE ARG 95 99.691 -2.010 13.323 764 HH11 ARG 95 HH11 ARG 95 98.576 -3.676 14.373 765 HH12 ARG 95 HH12 ARG 95 97.556 -4.761 13.455 766 HH21 ARG 95 HH21 ARG 95 98.212 -3.210 10.408 767 HH22 ARG 95 HH22 ARG 95 97.351 -4.498 11.221 768 H THR 96 H THR 96 99.425 4.129 11.434 769 HA THR 96 HA THR 96 99.381 5.344 14.104 770 HB THR 96 HB THR 96 97.506 6.726 12.619 771 HG1 THR 96 HG1 THR 96 99.492 5.803 10.797 772 HG21 THR 96 HG21 THR 96 99.380 8.260 12.102 773 HG22 THR 96 HG22 THR 96 100.543 6.974 12.503 774 HG23 THR 96 HG23 THR 96 99.494 7.652 13.771 775 H ASP 97 H ASP 97 97.597 3.014 12.564 776 HA ASP 97 HA ASP 97 95.038 3.600 13.975 777 HB2 ASP 97 HB2 ASP 97 95.366 2.550 11.583 778 HB3 ASP 97 HB3 ASP 97 95.647 1.041 12.483 779 H ASN 98 H ASN 98 97.700 1.205 14.054 780 HA ASN 98 HA ASN 98 96.710 0.450 16.806 781 HB2 ASN 98 HB2 ASN 98 96.238 -1.245 14.851 782 HB3 ASN 98 HB3 ASN 98 97.979 -1.597 14.977 783 HD21 ASN 98 HD21 ASN 98 97.935 -0.951 17.963 784 HD22 ASN 98 HD22 ASN 98 97.190 -2.354 18.697 785 H GLY 99 H GLY 99 99.121 1.947 15.208 786 HA2 GLY 99 HA3 GLY 99 101.476 2.107 15.549 787 HA3 GLY 99 HA2 GLY 99 101.009 1.971 17.261 788 H ASN 100 H ASN 100 100.553 -0.578 14.820 789 HA ASN 100 HA ASN 100 101.951 -2.499 16.558 790 HB2 ASN 100 HB2 ASN 100 99.994 -2.859 14.825 791 HB3 ASN 100 HB3 ASN 100 101.325 -3.029 13.655 792 HD21 ASN 100 HD21 ASN 100 99.635 -5.254 14.294 793 HD22 ASN 100 HD22 ASN 100 100.591 -6.427 15.172 794 H GLU 101 H GLU 101 103.297 -0.092 15.224 795 HA GLU 101 HA GLU 101 105.325 0.401 14.134 796 HB2 GLU 101 HB2 GLU 101 107.216 -0.661 15.113 797 HB3 GLU 101 HB3 GLU 101 105.954 -0.689 16.365 798 HG2 GLU 101 HG2 GLU 101 105.473 -3.006 15.962 799 HG3 GLU 101 HG3 GLU 101 106.420 -3.012 14.454 800 H LEU 102 H LEU 102 106.918 -0.206 12.541 801 HA LEU 102 HA LEU 102 106.623 -2.786 11.120 802 HB2 LEU 102 HB2 LEU 102 104.727 -1.551 10.145 803 HB3 LEU 102 HB3 LEU 102 105.781 -0.157 9.808 804 HG LEU 102 HG LEU 102 106.699 -2.792 8.734 805 HD11 LEU 102 HD11 LEU 102 104.259 -2.886 8.287 806 HD12 LEU 102 HD12 LEU 102 104.336 -1.272 7.541 807 HD13 LEU 102 HD13 LEU 102 105.179 -2.644 6.783 808 HD21 LEU 102 HD21 LEU 102 107.920 -0.666 8.339 809 HD22 LEU 102 HD22 LEU 102 107.313 -1.350 6.813 810 HD23 LEU 102 HD23 LEU 102 106.470 0.022 7.571 811 H ASN 103 H ASN 103 108.642 -3.261 10.279 812 HA ASN 103 HA ASN 103 110.528 -0.902 10.014 813 HB2 ASN 103 HB3 ASN 103 111.756 -3.575 10.344 814 HB3 ASN 103 HB2 ASN 103 112.133 -2.040 11.163 815 HD21 ASN 103 HD21 ASN 103 109.205 -4.204 11.034 816 HD22 ASN 103 HD22 ASN 103 109.008 -4.260 12.772 817 H THR 104 H THR 104 111.049 -0.518 7.919 818 HA THR 104 HA THR 104 111.225 -2.933 6.108 819 HB THR 104 HB THR 104 109.154 -1.864 5.526 820 HG1 THR 104 HG1 THR 104 109.923 -2.093 3.560 821 HG21 THR 104 HG21 THR 104 109.304 0.677 4.906 822 HG22 THR 104 HG22 THR 104 109.223 0.224 6.625 823 HG23 THR 104 HG23 THR 104 110.785 0.663 5.894 824 H VAL 105 H VAL 105 112.297 -2.184 3.937 825 HA VAL 105 HA VAL 105 114.398 -0.100 4.385 826 HB VAL 105 HB VAL 105 114.939 -3.053 3.873 827 HG11 VAL 105 HG11 VAL 105 117.370 -2.196 3.656 828 HG12 VAL 105 HG12 VAL 105 116.650 -0.596 3.353 829 HG13 VAL 105 HG13 VAL 105 116.299 -1.952 2.254 830 HG21 VAL 105 HG21 VAL 105 114.816 -2.308 6.237 831 HG22 VAL 105 HG22 VAL 105 116.481 -2.752 5.792 832 HG23 VAL 105 HG23 VAL 105 116.016 -1.038 5.899 833 H ARG 106 H ARG 106 115.482 0.459 2.313 834 HA ARG 106 HA ARG 106 113.913 -0.508 -0.084 835 HB2 ARG 106 HB3 ARG 106 112.967 1.639 0.355 836 HB3 ARG 106 HB2 ARG 106 114.552 2.344 0.753 837 HG2 ARG 106 HG2 ARG 106 115.236 2.395 -1.503 838 HG3 ARG 106 HG3 ARG 106 114.037 1.174 -1.993 839 HD2 ARG 106 HD2 ARG 106 113.553 3.646 -2.622 840 HD3 ARG 106 HD3 ARG 106 112.238 2.722 -1.857 841 HE ARG 106 HE ARG 106 113.511 3.889 0.322 842 HH11 ARG 106 HH11 ARG 106 112.988 5.953 1.081 843 HH12 ARG 106 HH12 ARG 106 112.290 7.133 -0.004 844 HH21 ARG 106 HH21 ARG 106 112.311 4.996 -2.753 845 HH22 ARG 106 HH22 ARG 106 111.908 6.594 -2.166 846 H GLU 107 H GLU 107 115.163 -0.988 -1.837 847 HA GLU 107 HA GLU 107 117.977 0.072 -1.906 848 HB2 GLU 107 HB2 GLU 107 117.122 -2.827 -1.760 849 HB3 GLU 107 HB3 GLU 107 118.592 -2.381 -2.659 850 HG2 GLU 107 HG3 GLU 107 119.378 -1.141 -0.594 851 HG3 GLU 107 HG2 GLU 107 117.985 -1.826 0.277 852 H ILE 108 H ILE 108 118.934 -0.156 -4.085 853 HA ILE 108 HA ILE 108 116.799 -0.517 -6.191 854 HB ILE 108 HB ILE 108 119.170 1.301 -6.588 855 HG12 ILE 108 HG13 ILE 108 116.885 1.691 -4.697 856 HG13 ILE 108 HG12 ILE 108 118.501 2.436 -4.697 857 HG21 ILE 108 HG21 ILE 108 117.469 0.575 -8.365 858 HG22 ILE 108 HG22 ILE 108 117.696 2.330 -8.169 859 HG23 ILE 108 HG23 ILE 108 116.270 1.533 -7.463 860 HD11 ILE 108 HD11 ILE 108 116.981 4.210 -5.210 861 HD12 ILE 108 HD12 ILE 108 117.725 3.759 -6.762 862 HD13 ILE 108 HD13 ILE 108 116.080 3.203 -6.369 863 H ILE 109 H ILE 109 117.500 -2.715 -6.331 864 HA ILE 109 HA ILE 109 120.231 -3.503 -6.756 865 HB ILE 109 HB ILE 109 117.563 -4.723 -7.537 866 HG12 ILE 109 HG12 ILE 109 118.598 -4.587 -5.120 867 HG13 ILE 109 HG13 ILE 109 117.909 -6.126 -5.687 868 HG21 ILE 109 HG21 ILE 109 118.931 -5.594 -9.254 869 HG22 ILE 109 HG22 ILE 109 120.376 -5.626 -8.214 870 HG23 ILE 109 HG23 ILE 109 119.075 -6.816 -7.967 871 HD11 ILE 109 HD11 ILE 109 120.278 -6.150 -4.569 872 HD12 ILE 109 HD12 ILE 109 120.841 -5.494 -6.124 873 HD13 ILE 109 HD13 ILE 109 120.036 -7.080 -6.067 874 H GLY 110 H GLY 110 121.225 -2.081 -8.198 875 HA2 GLY 110 HA2 GLY 110 121.792 -1.190 -10.311 876 HA3 GLY 110 HA3 GLY 110 121.399 -2.820 -10.899 877 H ASP 111 H ASP 111 119.002 -3.221 -11.339 878 HA ASP 111 HA ASP 111 117.730 -0.656 -12.317 879 HB2 ASP 111 HB2 ASP 111 116.800 -2.545 -14.079 880 HB3 ASP 111 HB3 ASP 111 118.207 -1.497 -14.383 881 H GLU 112 H GLU 112 117.224 -2.230 -9.810 882 HA GLU 112 HA GLU 112 114.280 -2.539 -10.298 883 HB2 GLU 112 HB2 GLU 112 116.130 -4.708 -9.258 884 HB3 GLU 112 HB3 GLU 112 114.399 -4.685 -8.845 885 HG2 GLU 112 HG2 GLU 112 113.784 -4.751 -11.207 886 HG3 GLU 112 HG3 GLU 112 115.490 -4.603 -11.692 887 H LEU 113 H LEU 113 113.017 -2.136 -8.406 888 HA LEU 113 HA LEU 113 114.641 -0.925 -6.167 889 HB2 LEU 113 HB2 LEU 113 112.780 0.382 -7.421 890 HB3 LEU 113 HB3 LEU 113 111.638 -0.666 -6.545 891 HG LEU 113 HG LEU 113 113.092 0.043 -4.439 892 HD11 LEU 113 HD11 LEU 113 114.788 1.272 -5.768 893 HD12 LEU 113 HD12 LEU 113 113.931 2.366 -4.656 894 HD13 LEU 113 HD13 LEU 113 113.517 2.354 -6.387 895 HD21 LEU 113 HD21 LEU 113 111.538 1.943 -4.082 896 HD22 LEU 113 HD22 LEU 113 110.688 0.544 -4.781 897 HD23 LEU 113 HD23 LEU 113 111.123 1.927 -5.813 898 H VAL 114 H VAL 114 114.952 -2.272 -4.465 899 HA VAL 114 HA VAL 114 112.852 -4.383 -3.992 900 HB VAL 114 HB VAL 114 115.615 -4.177 -2.728 901 HG11 VAL 114 HG11 VAL 114 115.254 -6.601 -2.351 902 HG12 VAL 114 HG12 VAL 114 113.656 -6.483 -3.127 903 HG13 VAL 114 HG13 VAL 114 113.965 -5.637 -1.591 904 HG21 VAL 114 HG21 VAL 114 115.816 -4.269 -5.199 905 HG22 VAL 114 HG22 VAL 114 114.739 -5.685 -5.234 906 HG23 VAL 114 HG23 VAL 114 116.336 -5.801 -4.458 907 H GLN 115 H GLN 115 111.313 -3.647 -2.623 908 HA GLN 115 HA GLN 115 112.240 -2.035 -0.238 909 HB2 GLN 115 HB2 GLN 115 110.413 -1.184 -1.941 910 HB3 GLN 115 HB3 GLN 115 109.350 -2.331 -1.090 911 HG2 GLN 115 HG2 GLN 115 109.789 -1.239 1.044 912 HG3 GLN 115 HG3 GLN 115 111.015 -0.185 0.299 913 HE21 GLN 115 HE21 GLN 115 110.089 1.153 -1.679 914 HE22 GLN 115 HE22 GLN 115 108.490 1.824 -1.444 915 H THR 116 H THR 116 112.637 -3.500 1.381 916 HA THR 116 HA THR 116 110.708 -5.802 1.640 917 HB THR 116 HB THR 116 113.185 -5.536 3.328 918 HG1 THR 116 HG1 THR 116 114.046 -5.115 1.332 919 HG21 THR 116 HG21 THR 116 113.183 -7.980 3.073 920 HG22 THR 116 HG22 THR 116 111.852 -7.876 1.896 921 HG23 THR 116 HG23 THR 116 111.574 -7.425 3.596 922 H TYR 117 H TYR 117 109.605 -6.169 3.559 923 HA TYR 117 HA TYR 117 109.854 -3.958 5.611 924 HB2 TYR 117 HB2 TYR 117 107.252 -5.426 5.119 925 HB3 TYR 117 HB3 TYR 117 107.520 -3.863 5.927 926 HD1 TYR 117 HD1 TYR 117 108.170 -5.507 2.646 927 HD2 TYR 117 HD2 TYR 117 107.003 -1.942 4.716 928 HE1 TYR 117 HE1 TYR 117 107.795 -4.375 0.474 929 HE2 TYR 117 HE2 TYR 117 106.630 -0.795 2.549 930 HH TYR 117 HH TYR 117 106.517 -2.470 -0.437 931 H VAL 118 H VAL 118 109.259 -4.566 7.740 932 HA VAL 118 HA VAL 118 109.399 -7.544 8.241 933 HB VAL 118 HB VAL 118 110.588 -5.443 10.083 934 HG11 VAL 118 HG11 VAL 118 111.385 -7.243 11.312 935 HG12 VAL 118 HG12 VAL 118 109.892 -7.961 10.664 936 HG13 VAL 118 HG13 VAL 118 111.457 -8.317 9.894 937 HG21 VAL 118 HG21 VAL 118 111.771 -5.346 7.909 938 HG22 VAL 118 HG22 VAL 118 112.800 -6.066 9.171 939 HG23 VAL 118 HG23 VAL 118 112.011 -7.109 7.963 940 H TYR 119 H TYR 119 108.171 -8.248 10.002 941 HA TYR 119 HA TYR 119 106.530 -6.151 11.373 942 HB2 TYR 119 HB3 TYR 119 105.520 -7.370 9.146 943 HB3 TYR 119 HB2 TYR 119 104.982 -8.499 10.412 944 HD1 TYR 119 HD1 TYR 119 103.740 -7.572 12.414 945 HD2 TYR 119 HD2 TYR 119 104.455 -5.267 8.867 946 HE1 TYR 119 HE1 TYR 119 101.909 -6.025 13.052 947 HE2 TYR 119 HE2 TYR 119 102.637 -3.709 9.508 948 HH TYR 119 HH TYR 119 100.695 -4.237 12.458 949 H GLU 120 H GLU 120 106.978 -6.563 13.421 950 HA GLU 120 HA GLU 120 107.346 -7.753 15.419 951 HB2 GLU 120 HB2 GLU 120 104.990 -9.119 14.112 952 HB3 GLU 120 HB3 GLU 120 105.626 -9.720 15.663 953 HG2 GLU 120 HG2 GLU 120 105.099 -6.766 15.316 954 HG3 GLU 120 HG3 GLU 120 103.738 -7.866 15.642 955 H GLY 121 H GLY 121 108.738 -8.747 12.840 956 HA2 GLY 121 HA3 GLY 121 110.655 -10.329 13.180 957 HA3 GLY 121 HA2 GLY 121 109.538 -11.399 14.060 958 H VAL 122 H VAL 122 108.526 -9.685 11.181 959 HA VAL 122 HA VAL 122 108.713 -12.290 9.666 960 HB VAL 122 HB VAL 122 106.347 -11.228 10.436 961 HG11 VAL 122 HG11 VAL 122 106.675 -10.085 7.651 962 HG12 VAL 122 HG12 VAL 122 105.412 -9.747 8.858 963 HG13 VAL 122 HG13 VAL 122 107.057 -9.109 9.089 964 HG21 VAL 122 HG21 VAL 122 105.360 -12.417 8.502 965 HG22 VAL 122 HG22 VAL 122 106.952 -12.441 7.707 966 HG23 VAL 122 HG23 VAL 122 106.698 -13.347 9.218 967 H GLU 123 H GLU 123 108.407 -11.656 7.188 968 HA GLU 123 HA GLU 123 109.596 -8.996 6.644 969 HB2 GLU 123 HB3 GLU 123 111.680 -9.729 5.777 970 HB3 GLU 123 HB2 GLU 123 111.495 -10.601 7.317 971 HG2 GLU 123 HG2 GLU 123 110.400 -12.478 5.884 972 HG3 GLU 123 HG3 GLU 123 111.131 -11.645 4.491 973 H ALA 124 H ALA 124 108.746 -8.257 4.799 974 HA ALA 124 HA ALA 124 107.913 -10.300 2.720 975 HB1 ALA 124 HB1 ALA 124 106.604 -7.845 2.187 976 HB2 ALA 124 HB2 ALA 124 106.474 -8.075 3.947 977 HB3 ALA 124 HB3 ALA 124 105.868 -9.329 2.838 978 H LYS 125 H LYS 125 108.407 -9.719 0.483 979 HA LYS 125 HA LYS 125 110.357 -7.410 0.314 980 HB2 LYS 125 HB2 LYS 125 111.266 -9.892 0.231 981 HB3 LYS 125 HB3 LYS 125 110.659 -9.844 -1.441 982 HG2 LYS 125 HG3 LYS 125 111.940 -7.591 -1.631 983 HG3 LYS 125 HG2 LYS 125 112.776 -8.096 -0.144 984 HD2 LYS 125 HD2 LYS 125 112.586 -9.923 -2.564 985 HD3 LYS 125 HD3 LYS 125 113.889 -8.722 -2.400 986 HE2 LYS 125 HE2 LYS 125 113.221 -10.880 -0.349 987 HE3 LYS 125 HE3 LYS 125 114.562 -10.957 -1.517 988 HZ1 LYS 125 HZ1 LYS 125 115.289 -10.124 0.619 989 HZ2 LYS 125 HZ2 LYS 125 115.449 -8.952 -0.530 990 HZ3 LYS 125 HZ3 LYS 125 114.207 -8.881 0.553 991 H ARG 126 H ARG 126 110.170 -6.078 -1.425 992 HA ARG 126 HA ARG 126 108.181 -6.877 -3.562 993 HB2 ARG 126 HB3 ARG 126 108.067 -4.655 -1.661 994 HB3 ARG 126 HB2 ARG 126 108.101 -4.061 -3.338 995 HG2 ARG 126 HG2 ARG 126 106.179 -5.398 -3.933 996 HG3 ARG 126 HG3 ARG 126 106.233 -6.269 -2.382 997 HD2 ARG 126 HD3 ARG 126 105.469 -4.401 -1.163 998 HD3 ARG 126 HD2 ARG 126 105.935 -3.256 -2.444 999 HE ARG 126 HE ARG 126 103.987 -4.887 -3.648 1000 HH11 ARG 126 HH11 ARG 126 101.797 -4.332 -3.593 1001 HH12 ARG 126 HH12 ARG 126 101.192 -3.285 -2.329 1002 HH21 ARG 126 HH21 ARG 126 104.295 -2.917 -0.793 1003 HH22 ARG 126 HH22 ARG 126 102.600 -2.487 -0.751 1004 H ILE 127 H ILE 127 109.361 -7.027 -5.431 1005 HA ILE 127 HA ILE 127 111.695 -5.122 -5.717 1006 HB ILE 127 HB ILE 127 111.160 -7.741 -7.183 1007 HG12 ILE 127 HG12 ILE 127 113.346 -7.367 -5.146 1008 HG13 ILE 127 HG13 ILE 127 111.689 -7.651 -4.562 1009 HG21 ILE 127 HG21 ILE 127 113.536 -7.506 -7.849 1010 HG22 ILE 127 HG22 ILE 127 113.624 -5.952 -6.985 1011 HG23 ILE 127 HG23 ILE 127 112.573 -6.118 -8.412 1012 HD11 ILE 127 HD11 ILE 127 112.918 -9.788 -4.829 1013 HD12 ILE 127 HD12 ILE 127 113.205 -9.409 -6.544 1014 HD13 ILE 127 HD13 ILE 127 111.547 -9.694 -5.961 1015 H PHE 128 H PHE 128 111.433 -3.498 -7.138 1016 HA PHE 128 HA PHE 128 109.304 -3.830 -9.257 1017 HB2 PHE 128 HB2 PHE 128 110.634 -1.213 -8.476 1018 HB3 PHE 128 HB3 PHE 128 109.087 -1.457 -9.315 1019 HD1 PHE 128 HD1 PHE 128 108.351 -3.835 -7.390 1020 HD2 PHE 128 HD2 PHE 128 109.552 0.229 -6.772 1021 HE1 PHE 128 HE1 PHE 128 107.117 -3.807 -5.244 1022 HE2 PHE 128 HE2 PHE 128 108.334 0.264 -4.610 1023 HZ PHE 128 HZ PHE 128 107.109 -1.756 -3.846 1024 H LYS 129 H LYS 129 109.850 -2.328 -11.223 1025 HA LYS 129 HA LYS 129 112.740 -2.317 -11.938 1026 HB2 LYS 129 HB3 LYS 129 111.764 -4.643 -12.488 1027 HB3 LYS 129 HB2 LYS 129 110.769 -3.814 -13.708 1028 HG2 LYS 129 HG2 LYS 129 112.811 -2.913 -14.775 1029 HG3 LYS 129 HG3 LYS 129 113.815 -3.718 -13.545 1030 HD2 LYS 129 HD2 LYS 129 111.883 -5.187 -15.392 1031 HD3 LYS 129 HD3 LYS 129 113.623 -5.000 -15.721 1032 HE2 LYS 129 HE2 LYS 129 113.886 -5.965 -13.268 1033 HE3 LYS 129 HE3 LYS 129 112.245 -6.592 -13.555 1034 HZ1 LYS 129 HZ1 LYS 129 113.931 -8.159 -14.253 1035 HZ2 LYS 129 HZ2 LYS 129 114.587 -7.059 -15.292 1036 HZ3 LYS 129 HZ3 LYS 129 113.066 -7.640 -15.558 1037 H LYS 130 H LYS 130 113.000 -1.224 -14.135 1038 HA LYS 130 HA LYS 130 111.654 1.246 -14.251 1039 HB2 LYS 130 HB2 LYS 130 112.496 1.489 -16.486 1040 HB3 LYS 130 HB3 LYS 130 113.676 0.468 -15.630 1041 HG2 LYS 130 HG3 LYS 130 112.360 -1.550 -16.535 1042 HG3 LYS 130 HG2 LYS 130 111.530 -0.395 -17.606 1043 HD2 LYS 130 HD2 LYS 130 113.752 0.347 -18.477 1044 HD3 LYS 130 HD3 LYS 130 114.539 -0.880 -17.457 1045 HE2 LYS 130 HE2 LYS 130 114.138 -1.595 -19.866 1046 HE3 LYS 130 HE3 LYS 130 113.436 -2.679 -18.641 1047 HZ1 LYS 130 HZ1 LYS 130 112.016 -1.841 -20.621 1048 HZ2 LYS 130 HZ2 LYS 130 111.816 -0.493 -19.693 1049 HZ3 LYS 130 HZ3 LYS 130 111.341 -1.965 -19.121 1050 H ASP 131 H ASP 131 109.716 1.993 -15.088 1051 HA ASP 131 HA ASP 131 107.437 0.401 -15.238 1052 HB2 ASP 131 HB2 ASP 131 106.373 2.161 -16.466 1053 HB3 ASP 131 HB3 ASP 131 107.628 2.956 -15.486
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