NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
517901 | 2lge | 17806 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 28.590 -10.200 3.346 2 HA2 GLY 1 1HA GLY 1 27.603 -12.321 4.077 3 HA3 GLY 1 2HA GLY 1 26.011 -11.555 3.881 4 H ASP 2 H ASP 2 28.275 -13.523 2.385 5 HA ASP 2 HA ASP 2 28.549 -14.425 0.362 6 HB2 ASP 2 1HB ASP 2 26.115 -12.910 -0.627 7 HB3 ASP 2 2HB ASP 2 27.076 -14.063 -1.544 8 H ASP 3 H ASP 3 27.571 -11.105 -0.696 9 HA ASP 3 HA ASP 3 30.182 -10.106 -0.633 10 HB2 ASP 3 1HB ASP 3 30.677 -9.941 -2.960 11 HB3 ASP 3 2HB ASP 3 30.368 -11.647 -2.594 12 H ASP 4 H ASP 4 30.072 -7.883 -1.320 13 HA ASP 4 HA ASP 4 27.421 -6.694 -1.656 14 HB2 ASP 4 1HB ASP 4 27.961 -4.959 -0.167 15 HB3 ASP 4 2HB ASP 4 28.227 -6.431 0.729 16 H GLU 5 H GLU 5 27.884 -4.252 -2.239 17 HA GLU 5 HA GLU 5 29.776 -4.115 -4.459 18 HB2 GLU 5 1HB GLU 5 27.959 -4.067 -6.147 19 HB3 GLU 5 2HB GLU 5 28.259 -5.621 -5.376 20 HG2 GLU 5 1HG GLU 5 26.269 -4.982 -3.806 21 HG3 GLU 5 2HG GLU 5 25.863 -3.796 -5.049 22 HA PRO 6 HA PRO 6 28.439 -0.172 -2.550 23 HB2 PRO 6 1HB PRO 6 30.838 0.978 -2.152 24 HB3 PRO 6 2HB PRO 6 30.273 -0.423 -1.163 25 HG2 PRO 6 1HG PRO 6 32.111 -0.524 -3.582 26 HG3 PRO 6 2HG PRO 6 32.397 -1.213 -1.944 27 HD2 PRO 6 1HD PRO 6 31.323 -2.672 -4.003 28 HD3 PRO 6 2HD PRO 6 30.850 -2.942 -2.296 29 H GLY 7 H GLY 7 28.554 2.019 -3.394 30 HA2 GLY 7 1HA GLY 7 29.438 3.483 -5.287 31 HA3 GLY 7 2HA GLY 7 28.991 2.133 -6.337 32 H GLY 8 H GLY 8 27.791 4.950 -4.695 33 HA2 GLY 8 1HA GLY 8 26.109 6.040 -5.868 34 HA3 GLY 8 2HA GLY 8 25.298 4.520 -6.212 35 H LYS 9 H LYS 9 23.425 6.039 -5.366 36 HA LYS 9 HA LYS 9 23.284 5.968 -2.468 37 HB2 LYS 9 1HB LYS 9 23.781 8.286 -4.115 38 HB3 LYS 9 2HB LYS 9 22.084 8.360 -3.666 39 HG2 LYS 9 1HG LYS 9 23.321 9.558 -2.021 40 HG3 LYS 9 2HG LYS 9 22.730 8.071 -1.259 41 HD2 LYS 9 1HD LYS 9 24.954 7.040 -1.490 42 HD3 LYS 9 2HD LYS 9 25.540 8.452 -2.390 43 HE2 LYS 9 1HE LYS 9 25.191 9.876 -0.407 44 HE3 LYS 9 2HE LYS 9 24.500 8.503 0.476 45 HZ1 LYS 9 3HZ LYS 9 26.621 7.379 0.273 46 HZ2 LYS 9 1HZ LYS 9 26.801 8.769 1.075 47 HZ3 LYS 9 2HZ LYS 9 27.275 8.687 -0.518 48 H GLY 10 H GLY 10 21.179 6.498 -1.856 49 HA2 GLY 10 1HA GLY 10 18.772 6.766 -2.905 50 HA3 GLY 10 2HA GLY 10 18.954 5.022 -3.091 51 H ALA 11 H ALA 11 17.468 4.455 -1.428 52 HA ALA 11 HA ALA 11 17.953 5.386 1.344 53 HB1 ALA 11 1HB ALA 11 15.330 5.636 -0.221 54 HB2 ALA 11 2HB ALA 11 15.550 6.072 1.479 55 HB3 ALA 11 3HB ALA 11 16.393 6.986 0.221 56 H MET 12 H MET 12 15.521 4.327 2.291 57 HA MET 12 HA MET 12 15.046 1.660 1.388 58 HB2 MET 12 1HB MET 12 15.168 2.384 4.361 59 HB3 MET 12 2HB MET 12 14.684 0.860 3.647 60 HG2 MET 12 1HG MET 12 17.102 0.883 2.624 61 HG3 MET 12 2HG MET 12 17.442 2.098 3.844 62 HE1 MET 12 3HE MET 12 15.081 -1.144 4.204 63 HE2 MET 12 1HE MET 12 16.364 -1.489 3.034 64 HE3 MET 12 2HE MET 12 16.329 -2.331 4.606 65 H TYR 13 H TYR 13 12.693 1.244 2.147 66 HA TYR 13 HA TYR 13 11.181 3.600 3.018 67 HB2 TYR 13 1HB TYR 13 10.779 2.174 0.361 68 HB3 TYR 13 2HB TYR 13 9.558 3.190 1.130 69 HD1 TYR 13 1HD TYR 13 10.237 5.611 1.760 70 HD2 TYR 13 2HD TYR 13 12.041 3.251 -1.355 71 HE1 TYR 13 1HE TYR 13 10.992 7.679 0.651 72 HE2 TYR 13 2HE TYR 13 12.764 5.337 -2.529 73 HH TYR 13 HH TYR 13 13.110 7.739 -2.188 74 H GLU 14 H GLU 14 9.067 3.057 3.775 75 HA GLU 14 HA GLU 14 8.177 0.262 3.862 76 HB2 GLU 14 1HB GLU 14 9.525 0.474 5.925 77 HB3 GLU 14 2HB GLU 14 8.635 1.933 6.374 78 HG2 GLU 14 1HG GLU 14 6.513 0.514 6.396 79 HG3 GLU 14 2HG GLU 14 7.532 -0.900 6.171 80 H VAL 15 H VAL 15 6.063 0.473 3.165 81 HA VAL 15 HA VAL 15 4.463 2.907 3.871 82 HB VAL 15 HB VAL 15 4.435 2.486 1.498 83 HG11 VAL 15 1HG1 VAL 15 3.604 0.379 0.480 84 HG12 VAL 15 2HG1 VAL 15 5.112 0.149 1.359 85 HG13 VAL 15 3HG1 VAL 15 3.580 -0.380 2.088 86 HG21 VAL 15 3HG2 VAL 15 2.267 3.172 2.440 87 HG22 VAL 15 1HG2 VAL 15 2.140 2.239 0.945 88 HG23 VAL 15 2HG2 VAL 15 1.771 1.464 2.484 89 H THR 16 H THR 16 2.383 2.709 4.841 90 HA THR 16 HA THR 16 1.651 0.030 5.825 91 HB THR 16 HB THR 16 0.558 1.806 7.631 92 HG1 THR 16 1HG THR 16 3.269 2.536 7.570 93 HG21 THR 16 3HG2 THR 16 1.393 -0.316 8.254 94 HG22 THR 16 1HG2 THR 16 2.149 0.921 9.297 95 HG23 THR 16 2HG2 THR 16 3.063 0.192 7.959 96 H ILE 17 H ILE 17 -0.448 -0.408 5.962 97 HA ILE 17 HA ILE 17 -2.408 1.623 5.124 98 HB ILE 17 HB ILE 17 -1.970 0.441 3.148 99 HG12 ILE 17 1HG1 ILE 17 -4.035 -1.019 2.783 100 HG13 ILE 17 2HG1 ILE 17 -4.336 -0.969 4.504 101 HG21 ILE 17 1HG2 ILE 17 -1.916 -1.935 2.767 102 HG22 ILE 17 2HG2 ILE 17 -0.625 -1.443 3.858 103 HG23 ILE 17 3HG2 ILE 17 -2.093 -2.238 4.499 104 HD11 ILE 17 3HD1 ILE 17 -5.715 0.651 3.417 105 HD12 ILE 17 1HD1 ILE 17 -4.501 1.551 4.343 106 HD13 ILE 17 2HD1 ILE 17 -4.327 1.383 2.584 107 H GLU 18 H GLU 18 -3.699 1.829 6.883 108 HA GLU 18 HA GLU 18 -4.597 -0.613 8.349 109 HB2 GLU 18 1HB GLU 18 -4.462 2.295 9.140 110 HB3 GLU 18 2HB GLU 18 -5.802 1.333 9.725 111 HG2 GLU 18 1HG GLU 18 -3.279 -0.075 10.139 112 HG3 GLU 18 2HG GLU 18 -3.152 1.553 10.765 113 H GLN 19 H GLN 19 -6.868 -0.856 8.397 114 HA GLN 19 HA GLN 19 -8.299 0.286 6.054 115 HB2 GLN 19 1HB GLN 19 -8.020 -2.615 6.998 116 HB3 GLN 19 2HB GLN 19 -9.143 -2.036 5.786 117 HG2 GLN 19 1HG GLN 19 -6.850 -0.957 4.779 118 HG3 GLN 19 2HG GLN 19 -6.135 -2.302 5.672 119 HE21 GLN 19 1HE2 GLN 19 -7.238 -4.557 5.173 120 HE22 GLN 19 2HE2 GLN 19 -7.647 -4.807 3.501 121 H SER 20 H SER 20 -9.922 1.450 6.947 122 HA SER 20 HA SER 20 -11.112 0.375 9.439 123 HB2 SER 20 1HB SER 20 -11.296 3.257 8.643 124 HB3 SER 20 2HB SER 20 -11.343 2.545 10.253 125 HG SER 20 HG SER 20 -9.120 2.065 10.028 126 H GLY 21 H GLY 21 -13.400 1.162 9.845 127 HA2 GLY 21 1HA GLY 21 -15.585 0.972 9.230 128 HA3 GLY 21 2HA GLY 21 -15.148 1.649 7.646 129 H ASP 22 H ASP 22 -16.420 0.211 6.441 130 HA ASP 22 HA ASP 22 -16.589 -2.521 7.303 131 HB2 ASP 22 1HB ASP 22 -18.347 -0.678 6.408 132 HB3 ASP 22 2HB ASP 22 -18.061 -1.507 4.888 133 H PHE 23 H PHE 23 -14.053 -2.038 6.196 134 HA PHE 23 HA PHE 23 -13.752 -2.275 3.453 135 HB2 PHE 23 1HB PHE 23 -11.432 -2.532 3.872 136 HB3 PHE 23 2HB PHE 23 -12.058 -1.546 5.181 137 HD1 PHE 23 1HD PHE 23 -12.129 -2.430 7.512 138 HD2 PHE 23 2HD PHE 23 -10.564 -4.790 4.244 139 HE1 PHE 23 1HE PHE 23 -11.023 -3.952 9.119 140 HE2 PHE 23 2HE PHE 23 -9.471 -6.294 5.866 141 HZ PHE 23 HZ PHE 23 -9.686 -5.876 8.305 142 H ARG 24 H ARG 24 -14.989 -4.802 5.168 143 HA ARG 24 HA ARG 24 -13.302 -6.965 4.136 144 HB2 ARG 24 1HB ARG 24 -15.687 -7.027 6.008 145 HB3 ARG 24 2HB ARG 24 -14.580 -8.352 5.633 146 HG2 ARG 24 1HG ARG 24 -12.659 -6.880 6.403 147 HG3 ARG 24 2HG ARG 24 -13.855 -5.762 7.061 148 HD2 ARG 24 1HD ARG 24 -14.666 -7.319 8.598 149 HD3 ARG 24 2HD ARG 24 -13.939 -8.702 7.791 150 HE ARG 24 HE ARG 24 -12.662 -6.897 9.676 151 HH11 ARG 24 1HH1 ARG 24 -12.060 -9.216 7.018 152 HH12 ARG 24 2HH1 ARG 24 -10.413 -9.421 7.390 153 HH21 ARG 24 1HH2 ARG 24 -10.501 -7.384 10.327 154 HH22 ARG 24 2HH2 ARG 24 -9.644 -8.707 9.599 155 H SER 25 H SER 25 -15.814 -5.290 2.799 156 HA SER 25 HA SER 25 -16.768 -7.584 1.166 157 HB2 SER 25 1HB SER 25 -18.408 -5.321 2.369 158 HB3 SER 25 2HB SER 25 -19.023 -6.646 1.366 159 HG SER 25 HG SER 25 -18.850 -6.639 3.950 160 H PHE 26 H PHE 26 -14.611 -5.783 0.443 161 HA PHE 26 HA PHE 26 -15.782 -4.076 -1.685 162 HB2 PHE 26 1HB PHE 26 -14.251 -3.167 0.758 163 HB3 PHE 26 2HB PHE 26 -14.081 -2.312 -0.730 164 HD1 PHE 26 2HD PHE 26 -15.958 -1.359 -1.949 165 HD2 PHE 26 1HD PHE 26 -16.259 -2.704 2.108 166 HE1 PHE 26 2HE PHE 26 -18.149 -0.150 -1.711 167 HE2 PHE 26 1HE PHE 26 -18.333 -1.379 2.413 168 HZ PHE 26 HZ PHE 26 -19.306 -0.134 0.496 169 H ILE 27 H ILE 27 -14.804 -5.008 -3.355 170 HA ILE 27 HA ILE 27 -12.335 -6.444 -3.166 171 HB ILE 27 HB ILE 27 -14.030 -5.714 -5.557 172 HG12 ILE 27 1HG1 ILE 27 -15.304 -7.132 -4.092 173 HG13 ILE 27 2HG1 ILE 27 -14.765 -8.096 -5.453 174 HG21 ILE 27 1HG2 ILE 27 -11.801 -6.228 -6.381 175 HG22 ILE 27 2HG2 ILE 27 -11.688 -7.650 -5.351 176 HG23 ILE 27 3HG2 ILE 27 -12.842 -7.614 -6.709 177 HD11 ILE 27 3HD1 ILE 27 -13.666 -8.100 -2.626 178 HD12 ILE 27 1HD1 ILE 27 -14.548 -9.401 -3.443 179 HD13 ILE 27 2HD1 ILE 27 -12.900 -8.978 -3.960 180 H LYS 28 H LYS 28 -10.589 -5.340 -2.666 181 HA LYS 28 HA LYS 28 -10.075 -2.738 -4.015 182 HB2 LYS 28 1HB LYS 28 -9.058 -2.046 -1.983 183 HB3 LYS 28 2HB LYS 28 -10.573 -2.828 -1.578 184 HG2 LYS 28 1HG LYS 28 -9.075 -4.988 -1.206 185 HG3 LYS 28 2HG LYS 28 -7.766 -3.825 -1.157 186 HD2 LYS 28 1HD LYS 28 -8.412 -4.196 1.098 187 HD3 LYS 28 2HD LYS 28 -8.974 -2.588 0.655 188 HE2 LYS 28 1HE LYS 28 -10.651 -3.691 2.006 189 HE3 LYS 28 2HE LYS 28 -11.280 -3.484 0.369 190 HZ1 LYS 28 3HZ LYS 28 -10.142 -6.041 1.350 191 HZ2 LYS 28 1HZ LYS 28 -10.920 -5.767 -0.070 192 HZ3 LYS 28 2HZ LYS 28 -11.756 -5.655 1.302 193 H SER 29 H SER 29 -7.860 -2.015 -4.303 194 HA SER 29 HA SER 29 -6.169 -4.199 -5.425 195 HB2 SER 29 1HB SER 29 -7.340 -1.701 -6.739 196 HB3 SER 29 2HB SER 29 -6.323 -2.896 -7.542 197 HG SER 29 HG SER 29 -7.937 -4.465 -7.069 198 H VAL 30 H VAL 30 -3.974 -3.818 -5.117 199 HA VAL 30 HA VAL 30 -3.010 -1.009 -4.898 200 HB VAL 30 HB VAL 30 -2.410 -3.251 -2.946 201 HG11 VAL 30 1HG1 VAL 30 -0.332 -2.056 -3.206 202 HG12 VAL 30 2HG1 VAL 30 -1.165 -0.481 -3.082 203 HG13 VAL 30 3HG1 VAL 30 -1.062 -1.570 -1.686 204 HG21 VAL 30 3HG2 VAL 30 -3.345 -1.771 -1.241 205 HG22 VAL 30 1HG2 VAL 30 -3.674 -0.521 -2.468 206 HG23 VAL 30 2HG2 VAL 30 -4.555 -2.061 -2.474 207 H VAL 31 H VAL 31 -0.781 -0.758 -5.467 208 HA VAL 31 HA VAL 31 0.586 -2.942 -6.941 209 HB VAL 31 HB VAL 31 -0.310 -1.110 -8.377 210 HG11 VAL 31 1HG1 VAL 31 1.377 0.787 -6.723 211 HG12 VAL 31 2HG1 VAL 31 0.574 1.164 -8.256 212 HG13 VAL 31 3HG1 VAL 31 -0.403 0.732 -6.861 213 HG21 VAL 31 3HG2 VAL 31 1.783 -0.389 -9.505 214 HG22 VAL 31 1HG2 VAL 31 2.724 -1.012 -8.155 215 HG23 VAL 31 2HG2 VAL 31 1.756 -2.106 -9.153 216 H VAL 32 H VAL 32 2.971 -2.993 -6.519 217 HA VAL 32 HA VAL 32 4.060 -0.858 -4.837 218 HB VAL 32 HB VAL 32 4.913 -3.672 -4.166 219 HG11 VAL 32 1HG1 VAL 32 5.299 -2.509 -1.952 220 HG12 VAL 32 2HG1 VAL 32 6.183 -1.817 -3.314 221 HG13 VAL 32 3HG1 VAL 32 4.721 -1.027 -2.679 222 HG21 VAL 32 3HG2 VAL 32 3.385 -3.923 -2.292 223 HG22 VAL 32 1HG2 VAL 32 2.431 -2.535 -2.840 224 HG23 VAL 32 2HG2 VAL 32 2.543 -3.999 -3.838 225 H VAL 33 H VAL 33 6.010 -0.213 -5.808 226 HA VAL 33 HA VAL 33 7.363 -2.125 -7.641 227 HB VAL 33 HB VAL 33 7.057 0.858 -8.136 228 HG11 VAL 33 1HG1 VAL 33 9.006 -0.443 -9.193 229 HG12 VAL 33 2HG1 VAL 33 7.794 -1.397 -10.066 230 HG13 VAL 33 3HG1 VAL 33 7.926 0.341 -10.343 231 HG21 VAL 33 3HG2 VAL 33 5.386 -1.421 -9.290 232 HG22 VAL 33 1HG2 VAL 33 4.811 -0.002 -8.375 233 HG23 VAL 33 2HG2 VAL 33 5.473 0.211 -9.992 234 H ALA 34 H ALA 34 9.531 -2.331 -7.096 235 HA ALA 34 HA ALA 34 10.736 -0.273 -5.313 236 HB1 ALA 34 1HB ALA 34 10.183 -2.303 -3.985 237 HB2 ALA 34 2HB ALA 34 11.125 -3.293 -5.114 238 HB3 ALA 34 3HB ALA 34 11.928 -2.051 -4.137 239 H ASN 35 H ASN 35 12.152 0.720 -6.477 240 HA ASN 35 HA ASN 35 13.777 -0.443 -8.599 241 HB2 ASN 35 1HB ASN 35 13.047 1.955 -8.378 242 HB3 ASN 35 2HB ASN 35 14.116 2.133 -6.992 243 HD21 ASN 35 1HD2 ASN 35 14.012 3.467 -9.615 244 HD22 ASN 35 2HD2 ASN 35 15.688 3.394 -10.192 245 H GLY 36 H GLY 36 15.674 -1.577 -8.249 246 HA2 GLY 36 1HA GLY 36 17.758 -1.982 -7.468 247 HA3 GLY 36 2HA GLY 36 17.581 -0.563 -6.442 248 H THR 37 H THR 37 15.109 -2.715 -5.526 249 HA THR 37 HA THR 37 16.775 -4.508 -4.021 250 HB THR 37 HB THR 37 16.790 -2.284 -2.764 251 HG1 THR 37 1HG THR 37 17.523 -4.014 -1.849 252 HG21 THR 37 3HG2 THR 37 14.998 -1.859 -1.254 253 HG22 THR 37 1HG2 THR 37 14.029 -3.187 -1.920 254 HG23 THR 37 2HG2 THR 37 14.386 -1.769 -2.922 255 H GLN 38 H GLN 38 15.160 -5.741 -2.380 256 HA GLN 38 HA GLN 38 12.761 -6.497 -3.977 257 HB2 GLN 38 1HB GLN 38 14.739 -8.065 -2.340 258 HB3 GLN 38 2HB GLN 38 13.057 -8.606 -2.325 259 HG2 GLN 38 1HG GLN 38 12.993 -9.035 -4.609 260 HG3 GLN 38 2HG GLN 38 14.280 -7.918 -5.006 261 HE21 GLN 38 1HE2 GLN 38 13.579 -11.184 -3.907 262 HE22 GLN 38 2HE2 GLN 38 15.200 -11.794 -4.168 263 H LEU 39 H LEU 39 10.896 -7.190 -2.618 264 HA LEU 39 HA LEU 39 10.459 -5.088 -0.608 265 HB2 LEU 39 1HB LEU 39 8.897 -6.019 -2.722 266 HB3 LEU 39 2HB LEU 39 8.269 -6.936 -1.363 267 HG LEU 39 HG LEU 39 8.068 -4.745 -0.110 268 HD11 LEU 39 1HD1 LEU 39 9.526 -3.318 -1.491 269 HD12 LEU 39 2HD1 LEU 39 7.880 -2.693 -1.614 270 HD13 LEU 39 3HD1 LEU 39 8.539 -3.660 -2.927 271 HD21 LEU 39 3HD2 LEU 39 6.177 -5.978 -1.128 272 HD22 LEU 39 1HD2 LEU 39 6.328 -4.945 -2.565 273 HD23 LEU 39 2HD2 LEU 39 5.931 -4.254 -0.965 274 H LYS 40 H LYS 40 9.034 -5.805 1.282 275 HA LYS 40 HA LYS 40 9.469 -8.623 2.102 276 HB2 LYS 40 1HB LYS 40 11.205 -7.102 3.116 277 HB3 LYS 40 2HB LYS 40 9.894 -6.189 3.883 278 HG2 LYS 40 1HG LYS 40 9.189 -8.274 5.086 279 HG3 LYS 40 2HG LYS 40 10.530 -9.156 4.305 280 HD2 LYS 40 1HD LYS 40 12.156 -7.631 5.342 281 HD3 LYS 40 2HD LYS 40 10.813 -6.665 6.008 282 HE2 LYS 40 1HE LYS 40 10.092 -8.655 7.325 283 HE3 LYS 40 2HE LYS 40 11.546 -9.515 6.763 284 HZ1 LYS 40 3HZ LYS 40 12.851 -7.745 7.808 285 HZ2 LYS 40 1HZ LYS 40 11.891 -8.512 8.892 286 HZ3 LYS 40 2HZ LYS 40 11.474 -7.012 8.336 287 H ASP 41 H ASP 41 7.751 -9.491 3.146 288 HA ASP 41 HA ASP 41 5.197 -8.070 2.913 289 HB2 ASP 41 1HB ASP 41 5.847 -10.473 2.064 290 HB3 ASP 41 2HB ASP 41 5.648 -10.954 3.727 291 H GLY 42 H GLY 42 4.066 -7.292 4.735 292 HA2 GLY 42 1HA GLY 42 5.340 -7.292 7.261 293 HA3 GLY 42 2HA GLY 42 3.704 -6.732 6.916 294 H ALA 43 H ALA 43 3.012 -9.573 5.927 295 HA ALA 43 HA ALA 43 1.699 -10.456 8.219 296 HB1 ALA 43 1HB ALA 43 2.592 -12.058 5.770 297 HB2 ALA 43 2HB ALA 43 1.363 -12.576 6.912 298 HB3 ALA 43 3HB ALA 43 1.072 -11.147 5.911 299 H THR 44 H THR 44 4.795 -11.446 6.899 300 HA THR 44 HA THR 44 5.384 -13.299 9.146 301 HB THR 44 HB THR 44 6.241 -14.702 7.106 302 HG1 THR 44 1HG THR 44 4.516 -13.979 5.331 303 HG21 THR 44 3HG2 THR 44 4.113 -15.749 6.792 304 HG22 THR 44 1HG2 THR 44 3.225 -14.327 7.354 305 HG23 THR 44 2HG2 THR 44 4.221 -15.266 8.489 306 H GLY 45 H GLY 45 6.625 -10.986 6.729 307 HA2 GLY 45 1HA GLY 45 8.578 -9.854 6.768 308 HA3 GLY 45 2HA GLY 45 9.267 -10.938 7.973 309 H GLU 46 H GLU 46 7.730 -12.458 5.170 310 HA GLU 46 HA GLU 46 10.097 -13.661 4.141 311 HB2 GLU 46 1HB GLU 46 7.336 -13.256 2.959 312 HB3 GLU 46 2HB GLU 46 8.569 -14.354 2.334 313 HG2 GLU 46 1HG GLU 46 7.329 -14.570 5.113 314 HG3 GLU 46 2HG GLU 46 6.695 -15.354 3.682 315 H SER 47 H SER 47 11.412 -12.785 2.431 316 HA SER 47 HA SER 47 11.081 -10.224 1.394 317 HB2 SER 47 1HB SER 47 12.624 -12.646 0.361 318 HB3 SER 47 2HB SER 47 13.031 -10.947 0.334 319 HG SER 47 HG SER 47 14.274 -12.092 1.832 320 H LEU 48 H LEU 48 10.505 -9.728 -0.792 321 HA LEU 48 HA LEU 48 9.077 -11.838 -2.340 322 HB2 LEU 48 1HB LEU 48 8.220 -8.970 -1.989 323 HB3 LEU 48 2HB LEU 48 7.337 -10.231 -2.845 324 HG LEU 48 HG LEU 48 7.799 -10.176 0.185 325 HD11 LEU 48 1HD1 LEU 48 6.490 -8.279 -0.557 326 HD12 LEU 48 2HD1 LEU 48 5.430 -9.436 0.232 327 HD13 LEU 48 3HD1 LEU 48 5.437 -9.355 -1.525 328 HD21 LEU 48 3HD2 LEU 48 6.090 -11.927 0.232 329 HD22 LEU 48 1HD2 LEU 48 7.423 -12.429 -0.807 330 HD23 LEU 48 2HD2 LEU 48 5.920 -11.859 -1.546 331 H ALA 49 H ALA 49 9.303 -11.727 -4.439 332 HA ALA 49 HA ALA 49 11.308 -9.991 -5.666 333 HB1 ALA 49 1HB ALA 49 11.103 -12.346 -6.326 334 HB2 ALA 49 2HB ALA 49 9.414 -12.105 -6.792 335 HB3 ALA 49 3HB ALA 49 10.708 -11.309 -7.715 336 H SER 50 H SER 50 10.152 -7.878 -5.140 337 HA SER 50 HA SER 50 7.833 -7.021 -6.435 338 HB2 SER 50 1HB SER 50 9.337 -4.820 -6.322 339 HB3 SER 50 2HB SER 50 8.599 -5.530 -4.893 340 HG SER 50 HG SER 50 11.265 -5.678 -5.817 341 HA PRO 51 HA PRO 51 7.401 -4.816 -7.597 342 HB2 PRO 51 1HB PRO 51 6.107 -4.086 -9.829 343 HB3 PRO 51 2HB PRO 51 7.788 -3.563 -9.543 344 HG2 PRO 51 1HG PRO 51 6.856 -5.942 -11.179 345 HG3 PRO 51 2HG PRO 51 7.909 -4.621 -11.724 346 HD2 PRO 51 1HD PRO 51 8.941 -6.944 -10.720 347 HD3 PRO 51 2HD PRO 51 9.716 -5.364 -10.387 348 H VAL 52 H VAL 52 5.193 -5.131 -7.032 349 HA VAL 52 HA VAL 52 3.823 -7.584 -7.959 350 HB VAL 52 HB VAL 52 4.924 -6.956 -5.199 351 HG11 VAL 52 1HG1 VAL 52 2.782 -9.071 -5.659 352 HG12 VAL 52 2HG1 VAL 52 3.755 -8.898 -4.208 353 HG13 VAL 52 3HG1 VAL 52 2.638 -7.617 -4.667 354 HG21 VAL 52 3HG2 VAL 52 6.280 -8.428 -6.764 355 HG22 VAL 52 1HG2 VAL 52 5.818 -9.255 -5.295 356 HG23 VAL 52 2HG2 VAL 52 4.930 -9.556 -6.811 357 H ILE 53 H ILE 53 1.700 -7.792 -7.184 358 HA ILE 53 HA ILE 53 0.233 -5.258 -6.751 359 HB ILE 53 HB ILE 53 -0.394 -7.735 -8.449 360 HG12 ILE 53 1HG1 ILE 53 1.103 -6.494 -9.774 361 HG13 ILE 53 2HG1 ILE 53 -0.491 -6.067 -10.359 362 HG21 ILE 53 1HG2 ILE 53 -2.428 -6.607 -9.188 363 HG22 ILE 53 2HG2 ILE 53 -2.451 -6.863 -7.449 364 HG23 ILE 53 3HG2 ILE 53 -2.081 -5.249 -8.106 365 HD11 ILE 53 3HD1 ILE 53 0.750 -4.050 -10.292 366 HD12 ILE 53 1HD1 ILE 53 -0.328 -3.947 -8.874 367 HD13 ILE 53 2HD1 ILE 53 1.367 -4.410 -8.682 368 H LEU 54 H LEU 54 -1.453 -5.506 -5.261 369 HA LEU 54 HA LEU 54 -1.606 -8.119 -3.806 370 HB2 LEU 54 1HB LEU 54 -2.014 -5.324 -2.730 371 HB3 LEU 54 2HB LEU 54 -2.615 -6.774 -1.955 372 HG LEU 54 HG LEU 54 -0.595 -5.904 -0.901 373 HD11 LEU 54 1HD1 LEU 54 0.674 -7.996 -0.757 374 HD12 LEU 54 2HD1 LEU 54 -0.166 -8.637 -2.179 375 HD13 LEU 54 3HD1 LEU 54 -1.060 -8.292 -0.674 376 HD21 LEU 54 3HD2 LEU 54 1.554 -5.985 -1.887 377 HD22 LEU 54 1HD2 LEU 54 0.505 -5.118 -3.036 378 HD23 LEU 54 2HD2 LEU 54 0.925 -6.829 -3.328 379 H SER 55 H SER 55 -3.451 -9.089 -4.053 380 HA SER 55 HA SER 55 -5.749 -7.729 -5.325 381 HB2 SER 55 1HB SER 55 -5.184 -10.670 -4.739 382 HB3 SER 55 2HB SER 55 -6.512 -10.024 -5.724 383 HG SER 55 HG SER 55 -4.221 -10.754 -6.623 384 H ASP 56 H ASP 56 -7.909 -8.601 -4.426 385 HA ASP 56 HA ASP 56 -8.240 -7.347 -2.010 386 HB2 ASP 56 1HB ASP 56 -10.010 -7.810 -3.698 387 HB3 ASP 56 2HB ASP 56 -10.090 -9.490 -3.133 388 H GLU 57 H GLU 57 -7.712 -10.802 -2.512 389 HA GLU 57 HA GLU 57 -8.592 -11.737 0.045 390 HB2 GLU 57 1HB GLU 57 -6.597 -12.850 -1.981 391 HB3 GLU 57 2HB GLU 57 -7.069 -13.706 -0.508 392 HG2 GLU 57 1HG GLU 57 -9.440 -13.687 -1.239 393 HG3 GLU 57 2HG GLU 57 -8.968 -12.854 -2.727 394 H GLU 58 H GLU 58 -5.499 -10.458 -1.117 395 HA GLU 58 HA GLU 58 -3.978 -11.272 1.213 396 HB2 GLU 58 1HB GLU 58 -3.121 -9.086 -0.692 397 HB3 GLU 58 2HB GLU 58 -2.145 -10.347 0.084 398 HG2 GLU 58 1HG GLU 58 -3.433 -12.005 -1.474 399 HG3 GLU 58 2HG GLU 58 -4.005 -10.526 -2.296 400 H LEU 59 H LEU 59 -5.708 -8.477 0.023 401 HA LEU 59 HA LEU 59 -5.022 -6.684 2.254 402 HB2 LEU 59 1HB LEU 59 -6.833 -6.311 -0.160 403 HB3 LEU 59 2HB LEU 59 -6.342 -5.045 0.967 404 HG LEU 59 HG LEU 59 -4.379 -6.598 -0.743 405 HD11 LEU 59 1HD1 LEU 59 -5.930 -5.341 -2.173 406 HD12 LEU 59 2HD1 LEU 59 -4.291 -4.699 -2.246 407 HD13 LEU 59 3HD1 LEU 59 -5.519 -3.850 -1.291 408 HD21 LEU 59 3HD2 LEU 59 -3.305 -5.617 1.202 409 HD22 LEU 59 1HD2 LEU 59 -4.070 -4.041 0.892 410 HD23 LEU 59 2HD2 LEU 59 -2.853 -4.683 -0.233 411 H ALA 60 H ALA 60 -6.630 -9.262 2.567 412 HA ALA 60 HA ALA 60 -9.221 -8.268 3.526 413 HB1 ALA 60 1HB ALA 60 -8.950 -10.469 2.398 414 HB2 ALA 60 2HB ALA 60 -7.970 -11.022 3.785 415 HB3 ALA 60 3HB ALA 60 -9.679 -10.583 4.007 416 H VAL 61 H VAL 61 -6.085 -8.229 4.811 417 HA VAL 61 HA VAL 61 -6.839 -8.833 7.583 418 HB VAL 61 HB VAL 61 -4.510 -8.175 8.071 419 HG11 VAL 61 1HG1 VAL 61 -3.406 -10.053 6.975 420 HG12 VAL 61 2HG1 VAL 61 -5.010 -10.509 7.531 421 HG13 VAL 61 3HG1 VAL 61 -4.732 -10.197 5.805 422 HG21 VAL 61 3HG2 VAL 61 -4.132 -7.844 5.063 423 HG22 VAL 61 1HG2 VAL 61 -4.179 -6.506 6.231 424 HG23 VAL 61 2HG2 VAL 61 -2.905 -7.730 6.328 425 H GLU 62 H GLU 62 -6.425 -7.228 9.286 426 HA GLU 62 HA GLU 62 -7.769 -4.718 8.920 427 HB2 GLU 62 1HB GLU 62 -6.953 -4.283 11.225 428 HB3 GLU 62 2HB GLU 62 -7.731 -5.872 11.091 429 HG2 GLU 62 1HG GLU 62 -5.520 -6.955 10.963 430 HG3 GLU 62 2HG GLU 62 -4.744 -5.366 11.011 431 H LYS 63 H LYS 63 -4.284 -5.601 8.745 432 HA LYS 63 HA LYS 63 -3.723 -2.875 7.837 433 HB2 LYS 63 1HB LYS 63 -3.519 -2.707 10.291 434 HB3 LYS 63 2HB LYS 63 -2.468 -4.123 10.324 435 HG2 LYS 63 1HG LYS 63 -0.729 -2.856 9.045 436 HG3 LYS 63 2HG LYS 63 -1.782 -1.431 9.053 437 HD2 LYS 63 1HD LYS 63 -1.757 -1.501 11.560 438 HD3 LYS 63 2HD LYS 63 -0.656 -2.869 11.484 439 HE2 LYS 63 1HE LYS 63 0.838 -1.164 11.817 440 HE3 LYS 63 2HE LYS 63 0.862 -1.236 10.058 441 HZ1 LYS 63 3HZ LYS 63 -0.737 0.621 11.722 442 HZ2 LYS 63 1HZ LYS 63 -0.699 0.677 10.075 443 HZ3 LYS 63 2HZ LYS 63 0.635 1.036 10.962 444 H VAL 64 H VAL 64 -1.941 -2.848 6.426 445 HA VAL 64 HA VAL 64 -0.174 -5.198 6.583 446 HB VAL 64 HB VAL 64 -0.483 -3.876 3.898 447 HG11 VAL 64 1HG1 VAL 64 0.338 -6.156 3.198 448 HG12 VAL 64 2HG1 VAL 64 1.474 -5.278 4.223 449 HG13 VAL 64 3HG1 VAL 64 0.479 -6.576 4.907 450 HG21 VAL 64 3HG2 VAL 64 -2.039 -6.335 4.760 451 HG22 VAL 64 1HG2 VAL 64 -2.787 -4.756 4.403 452 HG23 VAL 64 2HG2 VAL 64 -1.962 -5.663 3.133 453 H THR 65 H THR 65 1.971 -4.694 6.213 454 HA THR 65 HA THR 65 2.794 -1.917 5.947 455 HB THR 65 HB THR 65 4.090 -3.891 7.883 456 HG1 THR 65 1HG THR 65 2.121 -3.244 8.658 457 HG21 THR 65 3HG2 THR 65 5.144 -1.640 8.665 458 HG22 THR 65 1HG2 THR 65 4.635 -1.008 7.100 459 HG23 THR 65 2HG2 THR 65 5.748 -2.379 7.170 460 H LEU 66 H LEU 66 4.386 -1.965 4.246 461 HA LEU 66 HA LEU 66 5.737 -4.552 3.805 462 HB2 LEU 66 1HB LEU 66 4.520 -3.035 1.481 463 HB3 LEU 66 2HB LEU 66 5.701 -4.331 1.394 464 HG LEU 66 HG LEU 66 3.684 -5.487 2.965 465 HD11 LEU 66 1HD1 LEU 66 2.519 -3.815 0.719 466 HD12 LEU 66 2HD1 LEU 66 2.246 -3.579 2.470 467 HD13 LEU 66 3HD1 LEU 66 1.633 -5.052 1.651 468 HD21 LEU 66 3HD2 LEU 66 4.999 -6.593 1.224 469 HD22 LEU 66 1HD2 LEU 66 4.047 -5.749 -0.022 470 HD23 LEU 66 2HD2 LEU 66 3.274 -6.918 1.077 471 H SER 67 H SER 67 7.683 -4.325 3.109 472 HA SER 67 HA SER 67 8.877 -1.583 3.072 473 HB2 SER 67 1HB SER 67 10.417 -3.246 4.852 474 HB3 SER 67 2HB SER 67 9.621 -1.669 5.103 475 HG SER 67 HG SER 67 8.966 -3.247 6.558 476 H THR 68 H THR 68 11.536 -2.123 3.250 477 HA THR 68 HA THR 68 11.980 -3.611 0.699 478 HB THR 68 HB THR 68 13.870 -1.865 0.583 479 HG1 THR 68 1HG THR 68 12.003 -0.503 2.252 480 HG21 THR 68 3HG2 THR 68 11.992 -1.889 -1.012 481 HG22 THR 68 1HG2 THR 68 12.214 -0.206 -0.494 482 HG23 THR 68 2HG2 THR 68 10.903 -1.170 0.189 483 H THR 69 H THR 69 13.719 -5.035 0.568 484 HA THR 69 HA THR 69 14.834 -5.661 3.123 485 HB THR 69 HB THR 69 15.949 -7.520 1.919 486 HG1 THR 69 1HG THR 69 16.059 -7.600 -0.143 487 HG21 THR 69 3HG2 THR 69 13.040 -7.212 1.075 488 HG22 THR 69 1HG2 THR 69 13.597 -7.819 2.649 489 HG23 THR 69 2HG2 THR 69 13.957 -8.725 1.167 490 H GLY 70 H GLY 70 15.847 -3.447 0.733 491 HA2 GLY 70 1HA GLY 70 18.495 -3.104 1.906 492 HA3 GLY 70 2HA GLY 70 18.434 -3.848 0.298 493 H LYS 71 H LYS 71 19.480 -2.090 -0.565 494 HA LYS 71 HA LYS 71 18.709 0.627 -0.031 495 HB2 LYS 71 1HB LYS 71 21.031 -0.704 -0.797 496 HB3 LYS 71 2HB LYS 71 20.588 0.051 -2.310 497 HG2 LYS 71 1HG LYS 71 20.851 1.460 0.387 498 HG3 LYS 71 2HG LYS 71 22.118 1.394 -0.832 499 HD2 LYS 71 1HD LYS 71 19.373 2.683 -1.158 500 HD3 LYS 71 2HD LYS 71 20.874 3.538 -0.859 501 HE2 LYS 71 1HE LYS 71 20.128 1.955 -3.356 502 HE3 LYS 71 2HE LYS 71 20.250 3.712 -3.156 503 HZ1 LYS 71 3HZ LYS 71 22.438 1.729 -3.163 504 HZ2 LYS 71 1HZ LYS 71 22.683 3.260 -2.635 505 HZ3 LYS 71 2HZ LYS 71 22.257 2.938 -4.211 506 H ALA 72 H ALA 72 16.784 1.180 -0.713 507 HA ALA 72 HA ALA 72 15.715 0.335 -3.332 508 HB1 ALA 72 1HB ALA 72 14.389 1.966 -1.105 509 HB2 ALA 72 2HB ALA 72 13.598 1.212 -2.510 510 HB3 ALA 72 3HB ALA 72 14.280 0.204 -1.227 511 H ILE 73 H ILE 73 15.055 1.972 -4.830 512 HA ILE 73 HA ILE 73 16.148 4.718 -4.270 513 HB ILE 73 HB ILE 73 15.778 3.849 -7.090 514 HG12 ILE 73 1HG1 ILE 73 16.851 1.803 -6.167 515 HG13 ILE 73 2HG1 ILE 73 17.822 2.637 -7.323 516 HG21 ILE 73 1HG2 ILE 73 17.792 5.211 -7.418 517 HG22 ILE 73 2HG2 ILE 73 16.606 6.102 -6.472 518 HG23 ILE 73 3HG2 ILE 73 17.995 5.389 -5.663 519 HD11 ILE 73 3HD1 ILE 73 18.241 3.104 -4.365 520 HD12 ILE 73 1HD1 ILE 73 18.969 1.755 -5.239 521 HD13 ILE 73 2HD1 ILE 73 19.326 3.439 -5.699 522 H GLU 74 H GLU 74 13.172 3.044 -4.569 523 HA GLU 74 HA GLU 74 11.813 5.539 -5.262 524 HB2 GLU 74 1HB GLU 74 11.511 2.922 -6.818 525 HB3 GLU 74 2HB GLU 74 10.339 4.250 -6.852 526 HG2 GLU 74 1HG GLU 74 12.198 5.773 -7.563 527 HG3 GLU 74 2HG GLU 74 13.209 4.348 -7.827 528 H PHE 75 H PHE 75 9.704 5.466 -4.705 529 HA PHE 75 HA PHE 75 8.503 2.883 -3.975 530 HB2 PHE 75 1HB PHE 75 8.802 5.026 -2.004 531 HB3 PHE 75 2HB PHE 75 7.115 4.868 -2.414 532 HD1 PHE 75 2HD PHE 75 9.343 1.854 -2.361 533 HD2 PHE 75 1HD PHE 75 6.516 4.208 -0.114 534 HE1 PHE 75 2HE PHE 75 9.145 0.058 -0.711 535 HE2 PHE 75 1HE PHE 75 6.525 2.562 1.599 536 HZ PHE 75 HZ PHE 75 7.770 0.396 1.336 537 H ALA 76 H ALA 76 6.505 2.630 -4.919 538 HA ALA 76 HA ALA 76 5.062 5.062 -5.749 539 HB1 ALA 76 1HB ALA 76 4.621 4.326 -7.944 540 HB2 ALA 76 2HB ALA 76 6.361 4.131 -7.742 541 HB3 ALA 76 3HB ALA 76 5.312 2.701 -7.644 542 H VAL 77 H VAL 77 2.949 4.919 -5.120 543 HA VAL 77 HA VAL 77 1.876 2.311 -4.188 544 HB VAL 77 HB VAL 77 2.226 4.860 -2.551 545 HG11 VAL 77 1HG1 VAL 77 0.858 2.254 -1.777 546 HG12 VAL 77 2HG1 VAL 77 1.165 3.638 -0.702 547 HG13 VAL 77 3HG1 VAL 77 0.061 3.807 -2.063 548 HG21 VAL 77 3HG2 VAL 77 3.530 3.419 -1.000 549 HG22 VAL 77 1HG2 VAL 77 3.469 2.110 -2.205 550 HG23 VAL 77 2HG2 VAL 77 4.312 3.646 -2.564 551 H SER 78 H SER 78 0.150 2.201 -5.641 552 HA SER 78 HA SER 78 -1.738 4.473 -5.590 553 HB2 SER 78 1HB SER 78 -0.784 4.509 -7.771 554 HB3 SER 78 2HB SER 78 -0.876 2.757 -7.932 555 HG SER 78 HG SER 78 -2.465 4.196 -9.007 556 H GLY 79 H GLY 79 -3.988 3.766 -5.782 557 HA2 GLY 79 1HA GLY 79 -4.797 1.135 -5.951 558 HA3 GLY 79 2HA GLY 79 -4.618 1.446 -4.217 559 H GLY 80 H GLY 80 -7.024 0.738 -5.072 560 HA2 GLY 80 1HA GLY 80 -8.759 2.809 -4.258 561 HA3 GLY 80 2HA GLY 80 -8.862 2.593 -6.017 562 H VAL 81 H VAL 81 -11.150 1.915 -5.219 563 HA VAL 81 HA VAL 81 -11.285 -0.991 -5.001 564 HB VAL 81 HB VAL 81 -11.154 0.010 -2.661 565 HG11 VAL 81 1HG1 VAL 81 -13.975 0.961 -3.177 566 HG12 VAL 81 2HG1 VAL 81 -13.065 1.037 -1.655 567 HG13 VAL 81 3HG1 VAL 81 -12.555 2.013 -3.060 568 HG21 VAL 81 3HG2 VAL 81 -12.209 -2.220 -3.246 569 HG22 VAL 81 1HG2 VAL 81 -12.470 -1.474 -1.682 570 HG23 VAL 81 2HG2 VAL 81 -13.756 -1.426 -2.918 571 H VAL 82 H VAL 82 -13.988 -1.350 -4.797 572 HA VAL 82 HA VAL 82 -15.343 0.385 -6.757 573 HB VAL 82 HB VAL 82 -16.142 -1.671 -7.895 574 HG11 VAL 82 1HG1 VAL 82 -14.173 -2.125 -9.223 575 HG12 VAL 82 2HG1 VAL 82 -14.254 -0.407 -8.820 576 HG13 VAL 82 3HG1 VAL 82 -13.120 -1.475 -7.958 577 HG21 VAL 82 3HG2 VAL 82 -15.797 -3.346 -6.127 578 HG22 VAL 82 1HG2 VAL 82 -15.038 -3.832 -7.653 579 HG23 VAL 82 2HG2 VAL 82 -14.044 -3.208 -6.320 580 H ASP 83 H ASP 83 -17.691 -1.122 -6.901 581 HA ASP 83 HA ASP 83 -18.397 -2.105 -4.344 582 HB2 ASP 83 1HB ASP 83 -19.013 0.379 -4.222 583 HB3 ASP 83 2HB ASP 83 -20.071 0.044 -5.599 584 H GLY 84 H GLY 84 -18.742 -4.062 -5.352 585 HA2 GLY 84 1HA GLY 84 -20.664 -4.223 -7.610 586 HA3 GLY 84 2HA GLY 84 -18.989 -4.712 -7.921 587 H GLU 85 H GLU 85 -20.451 -5.143 -4.792 588 HA GLU 85 HA GLU 85 -19.992 -8.093 -5.033 589 HB2 GLU 85 1HB GLU 85 -20.239 -6.225 -2.707 590 HB3 GLU 85 2HB GLU 85 -20.670 -7.908 -2.461 591 HG2 GLU 85 1HG GLU 85 -18.016 -7.129 -3.710 592 HG3 GLU 85 2HG GLU 85 -18.251 -7.318 -1.971 593 H ASP 86 H ASP 86 -21.749 -7.629 -6.686 594 HA ASP 86 HA ASP 86 -23.819 -7.772 -7.518 595 HB2 ASP 86 1HB ASP 86 -23.287 -10.141 -6.712 596 HB3 ASP 86 2HB ASP 86 -24.469 -9.861 -5.436 597 H GLY 87 H GLY 87 -23.482 -5.645 -5.622 598 HA2 GLY 87 1HA GLY 87 -24.857 -3.906 -5.192 599 HA3 GLY 87 2HA GLY 87 -26.277 -4.910 -5.517 600 H VAL 88 H VAL 88 -24.036 -6.227 -3.135 601 HA VAL 88 HA VAL 88 -25.991 -6.003 -1.058 602 HB VAL 88 HB VAL 88 -24.327 -7.740 -1.042 603 HG11 VAL 88 1HG1 VAL 88 -22.019 -7.407 -0.490 604 HG12 VAL 88 2HG1 VAL 88 -22.395 -6.311 -1.837 605 HG13 VAL 88 3HG1 VAL 88 -22.272 -5.676 -0.202 606 HG21 VAL 88 3HG2 VAL 88 -24.008 -5.981 1.428 607 HG22 VAL 88 1HG2 VAL 88 -25.437 -6.965 1.067 608 HG23 VAL 88 2HG2 VAL 88 -23.876 -7.743 1.329 609 H VAL 89 H VAL 89 -26.466 -4.418 0.338 610 HA VAL 89 HA VAL 89 -24.902 -1.918 0.261 611 HB VAL 89 HB VAL 89 -27.527 -2.538 1.675 612 HG11 VAL 89 1HG1 VAL 89 -27.733 -0.036 1.650 613 HG12 VAL 89 2HG1 VAL 89 -26.358 -0.598 2.610 614 HG13 VAL 89 3HG1 VAL 89 -26.093 0.068 0.982 615 HG21 VAL 89 3HG2 VAL 89 -27.039 -1.276 -1.066 616 HG22 VAL 89 1HG2 VAL 89 -27.907 -2.785 -0.745 617 HG23 VAL 89 2HG2 VAL 89 -28.594 -1.257 -0.211 618 H ASN 90 H ASN 90 -23.780 -1.244 2.028 619 HA ASN 90 HA ASN 90 -23.612 -2.774 4.487 620 HB2 ASN 90 1HB ASN 90 -21.014 -2.735 4.213 621 HB3 ASN 90 2HB ASN 90 -22.011 -4.012 3.583 622 HD21 ASN 90 1HD2 ASN 90 -21.562 -4.586 1.733 623 HD22 ASN 90 2HD2 ASN 90 -20.869 -3.679 0.357 624 H GLU 91 H GLU 91 -21.082 -1.165 5.082 625 HA GLU 91 HA GLU 91 -22.097 1.620 5.003 626 HB2 GLU 91 1HB GLU 91 -20.537 0.096 7.117 627 HB3 GLU 91 2HB GLU 91 -20.571 1.857 7.085 628 HG2 GLU 91 1HG GLU 91 -23.048 1.791 7.231 629 HG3 GLU 91 2HG GLU 91 -22.978 0.025 7.322 630 HA PRO 92 HA PRO 92 -18.353 2.242 2.811 631 HB2 PRO 92 1HB PRO 92 -17.491 4.781 3.549 632 HB3 PRO 92 2HB PRO 92 -19.025 4.506 2.660 633 HG2 PRO 92 1HG PRO 92 -18.658 4.820 5.655 634 HG3 PRO 92 2HG PRO 92 -19.763 5.736 4.570 635 HD2 PRO 92 1HD PRO 92 -20.644 3.591 5.926 636 HD3 PRO 92 2HD PRO 92 -21.146 3.835 4.229 637 H MET 93 H MET 93 -15.892 3.157 3.079 638 HA MET 93 HA MET 93 -14.764 2.072 5.583 639 HB2 MET 93 1HB MET 93 -13.387 0.498 4.516 640 HB3 MET 93 2HB MET 93 -14.990 0.198 3.908 641 HG2 MET 93 1HG MET 93 -14.480 1.027 1.776 642 HG3 MET 93 2HG MET 93 -13.095 1.959 2.339 643 HE1 MET 93 3HE MET 93 -11.290 0.222 4.010 644 HE2 MET 93 1HE MET 93 -10.262 -0.563 2.796 645 HE3 MET 93 2HE MET 93 -10.707 1.152 2.614 646 H GLN 94 H GLN 94 -12.218 2.371 5.476 647 HA GLN 94 HA GLN 94 -11.415 4.766 3.944 648 HB2 GLN 94 1HB GLN 94 -11.207 4.580 6.986 649 HB3 GLN 94 2HB GLN 94 -10.367 5.763 5.995 650 HG2 GLN 94 1HG GLN 94 -12.572 6.600 5.173 651 HG3 GLN 94 2HG GLN 94 -13.378 5.507 6.308 652 HE21 GLN 94 1HE2 GLN 94 -13.322 6.042 8.617 653 HE22 GLN 94 2HE2 GLN 94 -12.680 7.585 9.142 654 H TRP 95 H TRP 95 -9.098 5.085 4.040 655 HA TRP 95 HA TRP 95 -7.446 2.663 4.626 656 HB2 TRP 95 1HB TRP 95 -7.665 4.358 2.116 657 HB3 TRP 95 2HB TRP 95 -6.119 3.700 2.579 658 HD1 TRP 95 HD TRP 95 -8.377 0.991 3.407 659 HE1 TRP 95 1HE TRP 95 -8.191 -0.820 1.630 660 HE3 TRP 95 3HE TRP 95 -6.096 3.718 -0.266 661 HZ2 TRP 95 2HZ TRP 95 -7.309 -1.022 -1.143 662 HZ3 TRP 95 3HZ TRP 95 -5.558 2.690 -2.443 663 HH2 TRP 95 HH TRP 95 -6.176 0.300 -2.892 664 H VAL 96 H VAL 96 -6.212 3.381 6.330 665 HA VAL 96 HA VAL 96 -5.340 6.232 6.346 666 HB VAL 96 HB VAL 96 -5.079 4.249 8.616 667 HG11 VAL 96 1HG1 VAL 96 -3.619 6.243 8.688 668 HG12 VAL 96 2HG1 VAL 96 -5.046 7.293 8.503 669 HG13 VAL 96 3HG1 VAL 96 -4.848 6.289 9.956 670 HG21 VAL 96 3HG2 VAL 96 -7.057 5.355 9.640 671 HG22 VAL 96 1HG2 VAL 96 -7.374 6.174 8.092 672 HG23 VAL 96 2HG2 VAL 96 -7.474 4.407 8.219 673 H VAL 97 H VAL 97 -3.385 6.487 5.257 674 HA VAL 97 HA VAL 97 -1.563 4.174 5.073 675 HB VAL 97 HB VAL 97 -1.392 4.882 2.668 676 HG11 VAL 97 1HG1 VAL 97 -4.046 3.781 3.586 677 HG12 VAL 97 2HG1 VAL 97 -3.401 3.663 1.934 678 HG13 VAL 97 3HG1 VAL 97 -2.546 2.880 3.269 679 HG21 VAL 97 3HG2 VAL 97 -2.455 7.097 2.731 680 HG22 VAL 97 1HG2 VAL 97 -3.263 6.028 1.584 681 HG23 VAL 97 2HG2 VAL 97 -4.022 6.354 3.148 682 H THR 98 H THR 98 0.573 4.638 5.101 683 HA THR 98 HA THR 98 1.421 7.475 5.240 684 HB THR 98 HB THR 98 2.039 5.394 7.366 685 HG1 THR 98 1HG THR 98 0.082 5.721 7.953 686 HG21 THR 98 3HG2 THR 98 3.623 7.281 7.339 687 HG22 THR 98 1HG2 THR 98 2.587 7.325 8.777 688 HG23 THR 98 2HG2 THR 98 2.271 8.428 7.450 689 H VAL 99 H VAL 99 3.789 7.634 5.020 690 HA VAL 99 HA VAL 99 5.083 5.168 3.984 691 HB VAL 99 HB VAL 99 5.196 7.837 2.526 692 HG11 VAL 99 1HG1 VAL 99 7.208 6.485 2.234 693 HG12 VAL 99 2HG1 VAL 99 6.240 5.044 1.923 694 HG13 VAL 99 3HG1 VAL 99 6.259 6.388 0.753 695 HG21 VAL 99 3HG2 VAL 99 3.644 5.315 1.781 696 HG22 VAL 99 1HG2 VAL 99 2.939 6.894 2.179 697 HG23 VAL 99 2HG2 VAL 99 3.900 6.711 0.714 698 H TYR 100 H TYR 100 7.037 4.889 4.752 699 HA TYR 100 HA TYR 100 8.464 7.069 6.155 700 HB2 TYR 100 1HB TYR 100 8.216 4.104 6.797 701 HB3 TYR 100 2HB TYR 100 9.310 5.202 7.599 702 HD1 TYR 100 2HD TYR 100 5.790 4.229 7.157 703 HD2 TYR 100 1HD TYR 100 8.507 6.852 9.255 704 HE1 TYR 100 2HE TYR 100 3.981 4.850 8.711 705 HE2 TYR 100 1HE TYR 100 6.681 7.510 10.790 706 HH TYR 100 HH TYR 100 4.062 7.658 10.447 707 H LYS 101 H LYS 101 10.733 6.718 6.228 708 HA LYS 101 HA LYS 101 11.847 5.680 3.682 709 HB2 LYS 101 1HB LYS 101 11.716 8.217 4.468 710 HB3 LYS 101 2HB LYS 101 13.151 7.831 5.392 711 HG2 LYS 101 1HG LYS 101 14.399 7.328 3.385 712 HG3 LYS 101 2HG LYS 101 12.942 7.105 2.450 713 HD2 LYS 101 1HD LYS 101 13.256 9.096 1.643 714 HD3 LYS 101 2HD LYS 101 12.669 9.756 3.151 715 HE2 LYS 101 1HE LYS 101 15.608 9.213 2.541 716 HE3 LYS 101 2HE LYS 101 14.811 10.742 2.219 717 HZ1 LYS 101 3HZ LYS 101 15.966 10.832 4.293 718 HZ2 LYS 101 1HZ LYS 101 15.174 9.558 4.921 719 HZ3 LYS 101 2HZ LYS 101 14.390 10.966 4.622 720 H ASN 102 H ASN 102 14.506 5.867 4.389 721 HA ASN 102 HA ASN 102 15.231 3.698 6.135 722 HB2 ASN 102 1HB ASN 102 17.499 4.440 5.830 723 HB3 ASN 102 2HB ASN 102 16.676 4.432 4.290 724 HD21 ASN 102 1HD2 ASN 102 16.450 6.513 3.107 725 HD22 ASN 102 2HD2 ASN 102 17.316 7.888 3.735 726 H GLY 103 H GLY 103 13.462 5.848 7.477 727 HA2 GLY 103 1HA GLY 103 13.759 5.963 9.912 728 HA3 GLY 103 2HA GLY 103 15.333 6.676 9.645 729 H LYS 104 H LYS 104 12.114 7.373 8.224 730 HA LYS 104 HA LYS 104 11.390 9.318 9.926 731 HB2 LYS 104 1HB LYS 104 13.175 10.454 7.938 732 HB3 LYS 104 2HB LYS 104 11.568 11.089 7.632 733 HG2 LYS 104 1HG LYS 104 12.953 11.143 10.357 734 HG3 LYS 104 2HG LYS 104 12.976 12.481 9.219 735 HD2 LYS 104 1HD LYS 104 10.436 11.287 10.426 736 HD3 LYS 104 2HD LYS 104 11.276 12.683 11.057 737 HE2 LYS 104 1HE LYS 104 10.292 12.618 8.181 738 HE3 LYS 104 2HE LYS 104 9.236 13.080 9.520 739 HZ1 LYS 104 3HZ LYS 104 10.162 15.019 8.655 740 HZ2 LYS 104 1HZ LYS 104 11.710 14.433 8.683 741 HZ3 LYS 104 2HZ LYS 104 10.896 14.773 10.090 742 H GLU 105 H GLU 105 9.255 10.134 9.357 743 HA GLU 105 HA GLU 105 7.714 8.681 7.324 744 HB2 GLU 105 1HB GLU 105 6.947 9.479 9.652 745 HB3 GLU 105 2HB GLU 105 7.003 11.110 9.011 746 HG2 GLU 105 1HG GLU 105 5.282 10.531 7.333 747 HG3 GLU 105 2HG GLU 105 5.306 8.844 7.882 748 H ILE 106 H ILE 106 7.093 9.614 5.276 749 HA ILE 106 HA ILE 106 7.807 12.468 4.856 750 HB ILE 106 HB ILE 106 8.073 11.784 2.440 751 HG12 ILE 106 1HG1 ILE 106 7.177 9.347 2.995 752 HG13 ILE 106 2HG1 ILE 106 8.311 9.672 1.725 753 HG21 ILE 106 1HG2 ILE 106 9.912 12.582 3.788 754 HG22 ILE 106 2HG2 ILE 106 10.193 10.968 4.456 755 HG23 ILE 106 3HG2 ILE 106 10.469 11.281 2.723 756 HD11 ILE 106 3HD1 ILE 106 8.903 7.663 3.005 757 HD12 ILE 106 1HD1 ILE 106 10.177 8.872 2.974 758 HD13 ILE 106 2HD1 ILE 106 9.180 8.668 4.440 759 H GLU 107 H GLU 107 5.330 9.895 4.486 760 HA GLU 107 HA GLU 107 3.511 12.084 3.699 761 HB2 GLU 107 1HB GLU 107 4.069 10.782 1.634 762 HB3 GLU 107 2HB GLU 107 3.405 9.336 2.388 763 HG2 GLU 107 1HG GLU 107 1.852 10.492 0.797 764 HG3 GLU 107 2HG GLU 107 1.187 10.330 2.418 765 H LYS 108 H LYS 108 1.412 11.826 4.385 766 HA LYS 108 HA LYS 108 0.874 9.944 6.582 767 HB2 LYS 108 1HB LYS 108 0.363 12.245 7.881 768 HB3 LYS 108 2HB LYS 108 1.920 11.441 7.988 769 HG2 LYS 108 1HG LYS 108 2.982 12.930 6.501 770 HG3 LYS 108 2HG LYS 108 1.473 13.592 5.890 771 HD2 LYS 108 1HD LYS 108 2.300 13.928 8.789 772 HD3 LYS 108 2HD LYS 108 2.925 14.989 7.534 773 HE2 LYS 108 1HE LYS 108 -0.033 14.619 8.183 774 HE3 LYS 108 2HE LYS 108 0.984 15.982 8.672 775 HZ1 LYS 108 3HZ LYS 108 1.365 16.218 6.135 776 HZ2 LYS 108 1HZ LYS 108 -0.090 16.719 6.775 777 HZ3 LYS 108 2HZ LYS 108 0.020 15.313 5.983 778 H LYS 109 H LYS 109 -0.928 9.218 5.390 779 HA LYS 109 HA LYS 109 -2.932 11.291 4.593 780 HB2 LYS 109 1HB LYS 109 -1.460 9.247 2.966 781 HB3 LYS 109 2HB LYS 109 -3.204 9.319 2.713 782 HG2 LYS 109 1HG LYS 109 -2.912 11.888 2.566 783 HG3 LYS 109 2HG LYS 109 -1.191 11.539 2.401 784 HD2 LYS 109 1HD LYS 109 -2.098 11.781 0.210 785 HD3 LYS 109 2HD LYS 109 -1.723 10.070 0.465 786 HE2 LYS 109 1HE LYS 109 -3.819 10.464 -0.789 787 HE3 LYS 109 2HE LYS 109 -4.041 9.491 0.663 788 HZ1 LYS 109 3HZ LYS 109 -5.416 11.721 -0.040 789 HZ2 LYS 109 1HZ LYS 109 -4.422 12.313 1.091 790 HZ3 LYS 109 2HZ LYS 109 -5.453 11.042 1.460 791 H SER 110 H SER 110 -4.876 10.333 3.893 792 HA SER 110 HA SER 110 -5.649 7.803 4.842 793 HB2 SER 110 1HB SER 110 -6.090 9.321 6.831 794 HB3 SER 110 2HB SER 110 -7.263 10.196 5.838 795 HG SER 110 HG SER 110 -8.599 8.553 5.939 796 H LEU 111 H LEU 111 -7.808 7.333 3.742 797 HA LEU 111 HA LEU 111 -8.845 9.300 1.818 798 HB2 LEU 111 1HB LEU 111 -8.194 6.385 1.189 799 HB3 LEU 111 2HB LEU 111 -9.079 7.474 0.135 800 HG LEU 111 HG LEU 111 -6.154 7.847 0.921 801 HD11 LEU 111 1HD1 LEU 111 -6.452 5.889 -0.355 802 HD12 LEU 111 2HD1 LEU 111 -5.799 7.150 -1.447 803 HD13 LEU 111 3HD1 LEU 111 -7.505 6.714 -1.540 804 HD21 LEU 111 3HD2 LEU 111 -6.094 9.465 -0.923 805 HD22 LEU 111 1HD2 LEU 111 -7.220 10.006 0.336 806 HD23 LEU 111 2HD2 LEU 111 -7.837 9.283 -1.167 807 H VAL 112 H VAL 112 -11.019 8.627 1.168 808 HA VAL 112 HA VAL 112 -12.373 6.752 3.012 809 HB VAL 112 HB VAL 112 -12.749 8.909 3.915 810 HG11 VAL 112 1HG1 VAL 112 -12.193 10.399 2.051 811 HG12 VAL 112 2HG1 VAL 112 -13.667 9.907 1.189 812 HG13 VAL 112 3HG1 VAL 112 -13.780 10.780 2.725 813 HG21 VAL 112 3HG2 VAL 112 -15.155 9.076 3.865 814 HG22 VAL 112 1HG2 VAL 112 -15.239 8.218 2.315 815 HG23 VAL 112 2HG2 VAL 112 -14.697 7.368 3.772 816 H PHE 113 H PHE 113 -13.559 5.258 1.987 817 HA PHE 113 HA PHE 113 -14.197 5.678 -0.886 818 HB2 PHE 113 1HB PHE 113 -13.506 3.093 0.539 819 HB3 PHE 113 2HB PHE 113 -14.115 3.229 -1.106 820 HD1 PHE 113 2HD PHE 113 -12.768 4.519 -2.843 821 HD2 PHE 113 1HD PHE 113 -11.152 3.424 1.009 822 HE1 PHE 113 2HE PHE 113 -10.483 4.789 -3.725 823 HE2 PHE 113 1HE PHE 113 -8.865 3.794 0.133 824 HZ PHE 113 HZ PHE 113 -8.504 4.426 -2.240 825 H ARG 114 H ARG 114 -16.308 4.922 -1.458 826 HA ARG 114 HA ARG 114 -18.058 4.183 0.781 827 HB2 ARG 114 1HB ARG 114 -18.611 6.648 -0.929 828 HB3 ARG 114 2HB ARG 114 -19.676 5.963 0.302 829 HG2 ARG 114 1HG ARG 114 -17.826 6.410 1.998 830 HG3 ARG 114 2HG ARG 114 -17.004 7.350 0.760 831 HD2 ARG 114 1HD ARG 114 -19.863 7.923 1.674 832 HD3 ARG 114 2HD ARG 114 -18.439 8.582 2.477 833 HE ARG 114 HE ARG 114 -17.947 9.960 0.740 834 HH11 ARG 114 1HH1 ARG 114 -20.730 7.934 -0.198 835 HH12 ARG 114 2HH1 ARG 114 -20.778 8.555 -1.806 836 HH21 ARG 114 1HH2 ARG 114 -18.431 11.166 -1.173 837 HH22 ARG 114 2HH2 ARG 114 -19.613 10.565 -2.292 838 H ASP 115 H ASP 115 -20.317 3.796 0.035 839 HA ASP 115 HA ASP 115 -20.331 1.864 -2.059 840 HB2 ASP 115 1HB ASP 115 -22.633 1.583 -1.410 841 HB3 ASP 115 2HB ASP 115 -21.733 1.876 0.073 842 H GLY 116 H GLY 116 -22.051 1.863 -3.667 843 HA2 GLY 116 1HA GLY 116 -23.623 3.664 -4.790 844 HA3 GLY 116 2HA GLY 116 -22.053 4.291 -5.342 845 H LYS 117 H LYS 117 -20.634 2.640 -6.431 846 HA LYS 117 HA LYS 117 -21.555 0.211 -7.496 847 HB2 LYS 117 1HB LYS 117 -22.252 2.712 -8.971 848 HB3 LYS 117 2HB LYS 117 -21.356 1.600 -9.961 849 HG2 LYS 117 1HG LYS 117 -23.958 0.935 -8.529 850 HG3 LYS 117 2HG LYS 117 -23.733 1.319 -10.225 851 HD2 LYS 117 1HD LYS 117 -22.149 -0.671 -10.394 852 HD3 LYS 117 2HD LYS 117 -22.650 -1.129 -8.755 853 HE2 LYS 117 1HE LYS 117 -25.000 -1.286 -9.505 854 HE3 LYS 117 2HE LYS 117 -24.512 -0.821 -11.144 855 HZ1 LYS 117 3HZ LYS 117 -24.670 -3.175 -11.031 856 HZ2 LYS 117 1HZ LYS 117 -23.782 -3.270 -9.677 857 HZ3 LYS 117 2HZ LYS 117 -23.064 -2.819 -11.125 858 H GLU 118 H GLU 118 -20.051 -0.529 -9.250 859 HA GLU 118 HA GLU 118 -17.332 -0.136 -8.942 860 HB2 GLU 118 1HB GLU 118 -19.175 -1.383 -10.916 861 HB3 GLU 118 2HB GLU 118 -17.739 -0.721 -11.686 862 HG2 GLU 118 1HG GLU 118 -16.318 -1.917 -10.054 863 HG3 GLU 118 2HG GLU 118 -17.757 -2.706 -9.381 864 H ILE 119 H ILE 119 -15.771 1.079 -9.875 865 HA ILE 119 HA ILE 119 -16.199 3.098 -11.813 866 HB ILE 119 HB ILE 119 -15.314 4.955 -10.336 867 HG12 ILE 119 1HG1 ILE 119 -16.028 4.867 -7.974 868 HG13 ILE 119 2HG1 ILE 119 -16.351 3.157 -8.144 869 HG21 ILE 119 1HG2 ILE 119 -18.130 4.153 -9.609 870 HG22 ILE 119 2HG2 ILE 119 -17.421 5.764 -9.766 871 HG23 ILE 119 3HG2 ILE 119 -17.664 4.786 -11.212 872 HD11 ILE 119 3HD1 ILE 119 -14.071 2.597 -8.325 873 HD12 ILE 119 1HD1 ILE 119 -13.592 4.288 -8.617 874 HD13 ILE 119 2HD1 ILE 119 -14.164 3.767 -7.011 875 H SER 120 H SER 120 -14.027 4.403 -11.604 876 HA SER 120 HA SER 120 -11.679 2.699 -10.984 877 HB2 SER 120 1HB SER 120 -10.593 3.350 -13.121 878 HB3 SER 120 2HB SER 120 -11.928 2.199 -13.298 879 HG SER 120 HG SER 120 -12.144 5.001 -13.649 880 H THR 121 H THR 121 -10.915 3.942 -9.342 881 HA THR 121 HA THR 121 -10.231 6.757 -9.932 882 HB THR 121 HB THR 121 -10.671 7.293 -7.532 883 HG1 THR 121 1HG THR 121 -10.888 5.100 -6.865 884 HG21 THR 121 3HG2 THR 121 -12.220 8.075 -9.274 885 HG22 THR 121 1HG2 THR 121 -13.086 7.680 -7.780 886 HG23 THR 121 2HG2 THR 121 -13.150 6.562 -9.160 887 H ASP 122 H ASP 122 -8.219 6.797 -10.110 888 HA ASP 122 HA ASP 122 -6.333 5.314 -8.452 889 HB2 ASP 122 1HB ASP 122 -5.995 7.905 -10.043 890 HB3 ASP 122 2HB ASP 122 -4.709 7.010 -9.257 891 H ASP 123 H ASP 123 -7.964 5.861 -6.631 892 HA ASP 123 HA ASP 123 -8.084 8.566 -5.591 893 HB2 ASP 123 1HB ASP 123 -9.718 6.594 -5.162 894 HB3 ASP 123 2HB ASP 123 -8.545 6.084 -3.941 895 H LEU 124 H LEU 124 -5.863 5.909 -5.115 896 HA LEU 124 HA LEU 124 -4.142 7.686 -3.473 897 HB2 LEU 124 1HB LEU 124 -4.874 5.338 -2.502 898 HB3 LEU 124 2HB LEU 124 -3.841 4.681 -3.727 899 HG LEU 124 HG LEU 124 -1.878 5.862 -2.795 900 HD11 LEU 124 1HD1 LEU 124 -2.919 7.820 -1.709 901 HD12 LEU 124 2HD1 LEU 124 -2.022 6.873 -0.528 902 HD13 LEU 124 3HD1 LEU 124 -3.786 6.753 -0.582 903 HD21 LEU 124 3HD2 LEU 124 -3.486 4.214 -0.782 904 HD22 LEU 124 1HD2 LEU 124 -1.734 4.499 -0.715 905 HD23 LEU 124 2HD2 LEU 124 -2.428 3.574 -2.055 906 H ASN 125 H ASN 125 -2.347 8.359 -4.594 907 HA ASN 125 HA ASN 125 -1.472 7.058 -7.080 908 HB2 ASN 125 1HB ASN 125 -1.733 9.255 -8.178 909 HB3 ASN 125 2HB ASN 125 -3.273 8.534 -7.741 910 HD21 ASN 125 1HD2 ASN 125 -0.837 10.802 -6.292 911 HD22 ASN 125 2HD2 ASN 125 -2.081 11.932 -5.671 912 H LEU 126 H LEU 126 -0.038 7.029 -4.685 913 HA LEU 126 HA LEU 126 1.613 9.471 -4.441 914 HB2 LEU 126 1HB LEU 126 1.542 6.875 -2.862 915 HB3 LEU 126 2HB LEU 126 2.508 8.274 -2.443 916 HG LEU 126 HG LEU 126 -0.517 8.160 -2.408 917 HD11 LEU 126 1HD1 LEU 126 0.568 6.869 -0.620 918 HD12 LEU 126 2HD1 LEU 126 -0.176 8.332 0.050 919 HD13 LEU 126 3HD1 LEU 126 1.580 8.263 -0.196 920 HD21 LEU 126 3HD2 LEU 126 -0.390 10.385 -1.336 921 HD22 LEU 126 1HD2 LEU 126 0.257 10.447 -2.969 922 HD23 LEU 126 2HD2 LEU 126 1.372 10.415 -1.591 923 H TYR 127 H TYR 127 3.934 9.423 -4.503 924 HA TYR 127 HA TYR 127 5.412 7.092 -5.043 925 HB2 TYR 127 1HB TYR 127 6.483 8.279 -7.180 926 HB3 TYR 127 2HB TYR 127 5.130 7.167 -7.227 927 HD1 TYR 127 1HD TYR 127 5.334 10.932 -6.665 928 HD2 TYR 127 2HD TYR 127 3.651 7.632 -8.885 929 HE1 TYR 127 1HE TYR 127 3.834 12.488 -7.851 930 HE2 TYR 127 2HE TYR 127 2.154 9.182 -10.078 931 HH TYR 127 HH TYR 127 1.353 11.340 -10.201 932 H TYR 128 H TYR 128 7.702 7.449 -4.937 933 HA TYR 128 HA TYR 128 8.773 10.046 -4.123 934 HB2 TYR 128 1HB TYR 128 8.499 7.574 -2.343 935 HB3 TYR 128 2HB TYR 128 9.873 8.637 -2.142 936 HD1 TYR 128 1HD TYR 128 9.146 11.289 -2.263 937 HD2 TYR 128 2HD TYR 128 6.811 7.997 -0.803 938 HE1 TYR 128 1HE TYR 128 7.829 12.848 -0.949 939 HE2 TYR 128 2HE TYR 128 5.423 9.555 0.537 940 HH TYR 128 HH TYR 128 6.224 13.107 0.689 941 H ASN 129 H ASN 129 11.126 9.999 -4.092 942 HA ASN 129 HA ASN 129 12.439 7.478 -4.348 943 HB2 ASN 129 1HB ASN 129 13.817 8.067 -6.266 944 HB3 ASN 129 2HB ASN 129 12.163 7.721 -6.670 945 HD21 ASN 129 1HD2 ASN 129 11.084 9.077 -7.952 946 HD22 ASN 129 2HD2 ASN 129 11.539 10.732 -8.297 Start of MODEL 2 1 H1 GLY 1 H GLY 1 41.080 -1.141 5.959 2 HA2 GLY 1 1HA GLY 1 39.994 0.999 6.265 3 HA3 GLY 1 2HA GLY 1 40.777 1.562 4.747 4 H ASP 2 H ASP 2 38.279 -0.421 6.172 5 HA ASP 2 HA ASP 2 37.575 -1.766 3.632 6 HB2 ASP 2 1HB ASP 2 38.233 -3.409 6.123 7 HB3 ASP 2 2HB ASP 2 38.160 -3.930 4.447 8 H ASP 3 H ASP 3 35.826 -0.019 4.234 9 HA ASP 3 HA ASP 3 34.471 -0.296 6.780 10 HB2 ASP 3 1HB ASP 3 36.175 1.947 5.581 11 HB3 ASP 3 2HB ASP 3 34.983 2.233 6.836 12 H ASP 4 H ASP 4 32.663 1.108 6.640 13 HA ASP 4 HA ASP 4 31.422 1.369 3.914 14 HB2 ASP 4 1HB ASP 4 30.970 -0.855 4.735 15 HB3 ASP 4 2HB ASP 4 30.411 -0.231 6.285 16 H GLU 5 H GLU 5 30.419 3.293 3.648 17 HA GLU 5 HA GLU 5 28.979 4.615 5.837 18 HB2 GLU 5 1HB GLU 5 30.284 6.649 5.686 19 HB3 GLU 5 2HB GLU 5 31.287 5.317 6.202 20 HG2 GLU 5 1HG GLU 5 32.768 5.701 4.567 21 HG3 GLU 5 2HG GLU 5 31.550 5.480 3.329 22 HA PRO 6 HA PRO 6 27.587 5.129 1.413 23 HB2 PRO 6 1HB PRO 6 25.007 4.132 1.530 24 HB3 PRO 6 2HB PRO 6 26.514 3.265 1.164 25 HG2 PRO 6 1HG PRO 6 25.033 3.440 3.802 26 HG3 PRO 6 2HG PRO 6 25.742 1.985 3.018 27 HD2 PRO 6 1HD PRO 6 27.021 3.379 5.018 28 HD3 PRO 6 2HD PRO 6 27.896 2.558 3.698 29 H GLY 7 H GLY 7 27.701 7.302 1.755 30 HA2 GLY 7 1HA GLY 7 25.444 8.654 2.932 31 HA3 GLY 7 2HA GLY 7 26.971 9.363 2.389 32 H GLY 8 H GLY 8 25.419 7.422 0.001 33 HA2 GLY 8 1HA GLY 8 24.170 9.846 -1.295 34 HA3 GLY 8 2HA GLY 8 25.220 8.742 -2.165 35 H LYS 9 H LYS 9 24.322 6.245 -1.424 36 HA LYS 9 HA LYS 9 21.685 6.213 -2.771 37 HB2 LYS 9 1HB LYS 9 23.797 4.090 -3.162 38 HB3 LYS 9 2HB LYS 9 22.459 4.579 -4.205 39 HG2 LYS 9 1HG LYS 9 23.670 6.787 -4.540 40 HG3 LYS 9 2HG LYS 9 24.993 6.094 -3.607 41 HD2 LYS 9 1HD LYS 9 25.122 4.248 -5.394 42 HD3 LYS 9 2HD LYS 9 24.107 5.344 -6.380 43 HE2 LYS 9 1HE LYS 9 25.744 7.210 -5.682 44 HE3 LYS 9 2HE LYS 9 26.780 5.954 -5.019 45 HZ1 LYS 9 3HZ LYS 9 26.024 6.254 -7.854 46 HZ2 LYS 9 1HZ LYS 9 27.006 5.045 -7.235 47 HZ3 LYS 9 2HZ LYS 9 27.467 6.617 -7.152 48 H GLY 10 H GLY 10 20.226 5.520 -1.256 49 HA2 GLY 10 1HA GLY 10 20.178 2.928 -0.284 50 HA3 GLY 10 2HA GLY 10 21.055 3.818 0.957 51 H ALA 11 H ALA 11 17.915 3.464 -0.744 52 HA ALA 11 HA ALA 11 16.678 4.352 1.754 53 HB1 ALA 11 1HB ALA 11 14.696 5.111 0.555 54 HB2 ALA 11 2HB ALA 11 16.095 6.024 -0.039 55 HB3 ALA 11 3HB ALA 11 15.431 4.691 -1.005 56 H MET 12 H MET 12 15.685 2.667 2.628 57 HA MET 12 HA MET 12 14.604 0.438 0.997 58 HB2 MET 12 1HB MET 12 14.225 1.098 3.971 59 HB3 MET 12 2HB MET 12 13.605 -0.301 3.100 60 HG2 MET 12 1HG MET 12 16.222 -0.582 2.520 61 HG3 MET 12 2HG MET 12 16.382 0.348 3.989 62 HE1 MET 12 3HE MET 12 13.538 -2.482 3.196 63 HE2 MET 12 1HE MET 12 15.017 -2.823 2.273 64 HE3 MET 12 2HE MET 12 14.525 -3.887 3.601 65 H TYR 13 H TYR 13 12.218 0.278 1.087 66 HA TYR 13 HA TYR 13 10.766 2.691 1.898 67 HB2 TYR 13 1HB TYR 13 10.419 1.261 -0.769 68 HB3 TYR 13 2HB TYR 13 9.446 2.591 -0.150 69 HD1 TYR 13 1HD TYR 13 10.989 4.719 0.644 70 HD2 TYR 13 2HD TYR 13 11.801 1.989 -2.597 71 HE1 TYR 13 1HE TYR 13 12.317 6.468 -0.507 72 HE2 TYR 13 2HE TYR 13 13.047 3.800 -3.805 73 HH TYR 13 HH TYR 13 13.126 6.574 -3.611 74 H GLU 14 H GLU 14 8.699 2.127 2.767 75 HA GLU 14 HA GLU 14 7.849 -0.683 2.779 76 HB2 GLU 14 1HB GLU 14 9.347 -0.636 4.670 77 HB3 GLU 14 2HB GLU 14 8.690 0.883 5.248 78 HG2 GLU 14 1HG GLU 14 6.585 -0.154 5.858 79 HG3 GLU 14 2HG GLU 14 7.014 -1.651 5.026 80 H VAL 15 H VAL 15 5.694 -0.637 2.436 81 HA VAL 15 HA VAL 15 4.205 1.908 2.827 82 HB VAL 15 HB VAL 15 4.305 1.196 0.540 83 HG11 VAL 15 1HG1 VAL 15 4.791 -1.232 0.767 84 HG12 VAL 15 2HG1 VAL 15 3.138 -1.499 1.349 85 HG13 VAL 15 3HG1 VAL 15 3.434 -0.935 -0.310 86 HG21 VAL 15 3HG2 VAL 15 2.007 1.092 -0.061 87 HG22 VAL 15 1HG2 VAL 15 1.548 0.421 1.509 88 HG23 VAL 15 2HG2 VAL 15 2.154 2.085 1.397 89 H THR 16 H THR 16 2.127 1.829 3.881 90 HA THR 16 HA THR 16 1.336 -0.791 4.973 91 HB THR 16 HB THR 16 0.363 0.473 6.915 92 HG1 THR 16 1HG THR 16 0.903 2.531 7.312 93 HG21 THR 16 3HG2 THR 16 2.417 0.725 8.220 94 HG22 THR 16 1HG2 THR 16 3.395 0.697 6.732 95 HG23 THR 16 2HG2 THR 16 2.461 -0.733 7.226 96 H ILE 17 H ILE 17 -0.846 -0.969 5.379 97 HA ILE 17 HA ILE 17 -2.587 1.080 4.350 98 HB ILE 17 HB ILE 17 -2.488 -0.588 2.564 99 HG12 ILE 17 1HG1 ILE 17 -4.889 -1.273 2.443 100 HG13 ILE 17 2HG1 ILE 17 -5.072 -0.987 4.173 101 HG21 ILE 17 1HG2 ILE 17 -3.177 -2.907 2.834 102 HG22 ILE 17 2HG2 ILE 17 -1.798 -2.569 3.876 103 HG23 ILE 17 3HG2 ILE 17 -3.426 -2.678 4.573 104 HD11 ILE 17 3HD1 ILE 17 -4.572 1.469 3.738 105 HD12 ILE 17 1HD1 ILE 17 -4.621 1.073 2.001 106 HD13 ILE 17 2HD1 ILE 17 -6.039 0.815 3.057 107 H GLU 18 H GLU 18 -4.257 1.325 5.791 108 HA GLU 18 HA GLU 18 -4.668 -0.561 8.057 109 HB2 GLU 18 1HB GLU 18 -4.177 2.411 7.960 110 HB3 GLU 18 2HB GLU 18 -5.183 1.784 9.244 111 HG2 GLU 18 1HG GLU 18 -2.545 0.402 8.843 112 HG3 GLU 18 2HG GLU 18 -2.411 2.067 9.237 113 H GLN 19 H GLN 19 -6.546 -1.438 7.289 114 HA GLN 19 HA GLN 19 -8.508 0.160 5.780 115 HB2 GLN 19 1HB GLN 19 -8.446 -2.791 6.613 116 HB3 GLN 19 2HB GLN 19 -9.659 -2.023 5.600 117 HG2 GLN 19 1HG GLN 19 -7.631 -1.326 4.096 118 HG3 GLN 19 2HG GLN 19 -6.757 -2.586 4.966 119 HE21 GLN 19 1HE2 GLN 19 -7.570 -4.851 4.752 120 HE22 GLN 19 2HE2 GLN 19 -8.316 -5.348 3.282 121 H SER 20 H SER 20 -9.786 1.501 7.080 122 HA SER 20 HA SER 20 -11.119 0.115 9.277 123 HB2 SER 20 1HB SER 20 -10.247 2.974 9.779 124 HB3 SER 20 2HB SER 20 -10.759 1.765 10.962 125 HG SER 20 HG SER 20 -8.770 0.990 11.044 126 H GLY 21 H GLY 21 -12.984 1.375 10.172 127 HA2 GLY 21 1HA GLY 21 -15.188 1.626 9.557 128 HA3 GLY 21 2HA GLY 21 -14.699 2.308 8.005 129 H ASP 22 H ASP 22 -16.465 0.577 7.320 130 HA ASP 22 HA ASP 22 -15.808 -2.199 7.893 131 HB2 ASP 22 1HB ASP 22 -18.130 -1.194 7.748 132 HB3 ASP 22 2HB ASP 22 -17.950 -1.124 6.003 133 H PHE 23 H PHE 23 -14.459 -3.514 6.621 134 HA PHE 23 HA PHE 23 -14.087 -2.706 3.770 135 HB2 PHE 23 1HB PHE 23 -11.877 -3.656 3.757 136 HB3 PHE 23 2HB PHE 23 -12.019 -2.322 4.818 137 HD1 PHE 23 1HD PHE 23 -11.461 -5.961 4.685 138 HD2 PHE 23 2HD PHE 23 -11.674 -2.489 7.232 139 HE1 PHE 23 1HE PHE 23 -10.394 -7.232 6.530 140 HE2 PHE 23 2HE PHE 23 -10.562 -3.734 9.045 141 HZ PHE 23 HZ PHE 23 -9.944 -6.132 8.715 142 H ARG 24 H ARG 24 -16.107 -4.582 5.201 143 HA ARG 24 HA ARG 24 -15.298 -7.193 4.307 144 HB2 ARG 24 1HB ARG 24 -17.896 -6.092 5.419 145 HB3 ARG 24 2HB ARG 24 -17.610 -7.814 5.115 146 HG2 ARG 24 1HG ARG 24 -15.895 -7.969 6.738 147 HG3 ARG 24 2HG ARG 24 -15.726 -6.222 6.882 148 HD2 ARG 24 1HD ARG 24 -17.860 -5.986 7.982 149 HD3 ARG 24 2HD ARG 24 -18.285 -7.657 7.604 150 HE ARG 24 HE ARG 24 -17.022 -8.442 9.283 151 HH11 ARG 24 1HH1 ARG 24 -16.020 -5.096 8.830 152 HH12 ARG 24 2HH1 ARG 24 -15.004 -5.044 10.232 153 HH21 ARG 24 1HH2 ARG 24 -15.852 -8.376 11.161 154 HH22 ARG 24 2HH2 ARG 24 -14.985 -6.969 11.718 155 H SER 25 H SER 25 -16.896 -4.660 2.550 156 HA SER 25 HA SER 25 -18.046 -6.541 0.591 157 HB2 SER 25 1HB SER 25 -19.638 -4.507 0.336 158 HB3 SER 25 2HB SER 25 -19.764 -5.546 1.762 159 HG SER 25 HG SER 25 -19.693 -3.123 1.982 160 H PHE 26 H PHE 26 -15.200 -5.589 0.163 161 HA PHE 26 HA PHE 26 -15.577 -3.545 -1.965 162 HB2 PHE 26 1HB PHE 26 -13.545 -3.432 0.311 163 HB3 PHE 26 2HB PHE 26 -13.509 -2.440 -1.127 164 HD1 PHE 26 1HD PHE 26 -15.616 -3.240 1.883 165 HD2 PHE 26 2HD PHE 26 -14.780 -0.470 -1.302 166 HE1 PHE 26 1HE PHE 26 -17.354 -1.707 2.760 167 HE2 PHE 26 2HE PHE 26 -16.476 1.101 -0.361 168 HZ PHE 26 HZ PHE 26 -17.839 0.414 1.598 169 H ILE 27 H ILE 27 -13.539 -3.397 -3.354 170 HA ILE 27 HA ILE 27 -12.334 -6.068 -3.649 171 HB ILE 27 HB ILE 27 -13.082 -4.022 -5.801 172 HG12 ILE 27 1HG1 ILE 27 -14.463 -6.352 -6.446 173 HG13 ILE 27 2HG1 ILE 27 -14.592 -6.347 -4.697 174 HG21 ILE 27 1HG2 ILE 27 -11.087 -5.334 -6.396 175 HG22 ILE 27 2HG2 ILE 27 -11.965 -6.851 -6.075 176 HG23 ILE 27 3HG2 ILE 27 -12.455 -5.770 -7.413 177 HD11 ILE 27 3HD1 ILE 27 -16.479 -5.194 -5.817 178 HD12 ILE 27 1HD1 ILE 27 -15.568 -4.046 -4.807 179 HD13 ILE 27 2HD1 ILE 27 -15.346 -4.061 -6.576 180 H LYS 28 H LYS 28 -10.419 -5.609 -2.526 181 HA LYS 28 HA LYS 28 -9.118 -2.991 -2.822 182 HB2 LYS 28 1HB LYS 28 -7.951 -5.514 -1.586 183 HB3 LYS 28 2HB LYS 28 -7.364 -3.860 -1.494 184 HG2 LYS 28 1HG LYS 28 -8.171 -3.954 0.532 185 HG3 LYS 28 2HG LYS 28 -9.608 -3.340 -0.250 186 HD2 LYS 28 1HD LYS 28 -9.299 -6.330 0.034 187 HD3 LYS 28 2HD LYS 28 -9.588 -5.391 1.499 188 HE2 LYS 28 1HE LYS 28 -11.679 -4.649 0.865 189 HE3 LYS 28 2HE LYS 28 -11.373 -4.914 -0.866 190 HZ1 LYS 28 3HZ LYS 28 -11.453 -7.227 -0.547 191 HZ2 LYS 28 1HZ LYS 28 -12.827 -6.595 0.016 192 HZ3 LYS 28 2HZ LYS 28 -11.678 -7.088 1.102 193 H SER 29 H SER 29 -7.240 -2.569 -3.933 194 HA SER 29 HA SER 29 -5.748 -4.658 -5.360 195 HB2 SER 29 1HB SER 29 -7.382 -2.419 -6.562 196 HB3 SER 29 2HB SER 29 -5.736 -2.586 -7.158 197 HG SER 29 HG SER 29 -7.703 -4.661 -7.163 198 H VAL 30 H VAL 30 -3.627 -4.247 -4.764 199 HA VAL 30 HA VAL 30 -2.781 -1.439 -4.888 200 HB VAL 30 HB VAL 30 -1.604 -3.354 -2.871 201 HG11 VAL 30 1HG1 VAL 30 -0.458 -1.258 -2.063 202 HG12 VAL 30 2HG1 VAL 30 0.098 -1.900 -3.615 203 HG13 VAL 30 3HG1 VAL 30 -0.975 -0.489 -3.575 204 HG21 VAL 30 3HG2 VAL 30 -3.409 -0.953 -2.382 205 HG22 VAL 30 1HG2 VAL 30 -3.828 -2.634 -2.071 206 HG23 VAL 30 2HG2 VAL 30 -2.553 -1.866 -1.126 207 H VAL 31 H VAL 31 -1.311 -1.281 -6.472 208 HA VAL 31 HA VAL 31 0.174 -3.646 -7.502 209 HB VAL 31 HB VAL 31 0.144 -0.723 -8.413 210 HG11 VAL 31 1HG1 VAL 31 1.278 -1.337 -10.302 211 HG12 VAL 31 2HG1 VAL 31 1.977 -2.500 -9.181 212 HG13 VAL 31 3HG1 VAL 31 0.690 -3.018 -10.286 213 HG21 VAL 31 3HG2 VAL 31 -1.644 -2.961 -9.400 214 HG22 VAL 31 1HG2 VAL 31 -2.152 -1.450 -8.614 215 HG23 VAL 31 2HG2 VAL 31 -1.413 -1.401 -10.201 216 H VAL 32 H VAL 32 2.385 -3.871 -6.651 217 HA VAL 32 HA VAL 32 3.698 -1.339 -6.044 218 HB VAL 32 HB VAL 32 2.890 -2.048 -3.900 219 HG11 VAL 32 1HG1 VAL 32 2.919 -4.479 -4.261 220 HG12 VAL 32 2HG1 VAL 32 4.698 -4.452 -4.201 221 HG13 VAL 32 3HG1 VAL 32 3.741 -4.005 -2.765 222 HG21 VAL 32 3HG2 VAL 32 5.925 -2.260 -4.022 223 HG22 VAL 32 1HG2 VAL 32 4.999 -0.745 -4.048 224 HG23 VAL 32 2HG2 VAL 32 4.932 -1.796 -2.632 225 H VAL 33 H VAL 33 5.952 -1.350 -6.240 226 HA VAL 33 HA VAL 33 7.169 -3.492 -7.878 227 HB VAL 33 HB VAL 33 7.055 -0.496 -8.410 228 HG11 VAL 33 1HG1 VAL 33 8.539 -2.683 -9.924 229 HG12 VAL 33 2HG1 VAL 33 8.244 -1.061 -10.590 230 HG13 VAL 33 3HG1 VAL 33 9.224 -1.235 -9.142 231 HG21 VAL 33 3HG2 VAL 33 5.984 -2.508 -10.385 232 HG22 VAL 33 1HG2 VAL 33 4.947 -1.763 -9.157 233 HG23 VAL 33 2HG2 VAL 33 5.780 -0.760 -10.339 234 H ALA 34 H ALA 34 9.628 -3.266 -7.606 235 HA ALA 34 HA ALA 34 10.443 -0.904 -6.133 236 HB1 ALA 34 1HB ALA 34 11.567 -3.576 -5.219 237 HB2 ALA 34 2HB ALA 34 11.944 -1.966 -4.600 238 HB3 ALA 34 3HB ALA 34 10.328 -2.644 -4.324 239 H ASN 35 H ASN 35 12.061 -0.046 -7.234 240 HA ASN 35 HA ASN 35 13.415 -1.513 -9.420 241 HB2 ASN 35 1HB ASN 35 12.752 0.857 -9.681 242 HB3 ASN 35 2HB ASN 35 13.783 1.303 -8.313 243 HD21 ASN 35 1HD2 ASN 35 14.065 2.545 -10.799 244 HD22 ASN 35 2HD2 ASN 35 15.567 2.012 -11.531 245 H GLY 36 H GLY 36 15.026 -2.926 -8.807 246 HA2 GLY 36 1HA GLY 36 17.353 -2.782 -8.631 247 HA3 GLY 36 2HA GLY 36 17.225 -1.691 -7.261 248 H THR 37 H THR 37 15.001 -4.016 -6.448 249 HA THR 37 HA THR 37 16.798 -6.063 -5.495 250 HB THR 37 HB THR 37 17.249 -4.060 -4.034 251 HG1 THR 37 1HG THR 37 17.784 -6.043 -3.353 252 HG21 THR 37 3HG2 THR 37 14.853 -3.303 -3.931 253 HG22 THR 37 1HG2 THR 37 15.669 -3.411 -2.373 254 HG23 THR 37 2HG2 THR 37 14.527 -4.674 -2.848 255 H GLN 38 H GLN 38 15.224 -7.108 -3.448 256 HA GLN 38 HA GLN 38 12.820 -7.986 -4.974 257 HB2 GLN 38 1HB GLN 38 14.826 -9.391 -3.321 258 HB3 GLN 38 2HB GLN 38 13.179 -9.772 -2.853 259 HG2 GLN 38 1HG GLN 38 12.671 -10.355 -5.245 260 HG3 GLN 38 2HG GLN 38 14.335 -10.121 -5.651 261 HE21 GLN 38 1HE2 GLN 38 12.525 -12.685 -5.467 262 HE22 GLN 38 2HE2 GLN 38 13.475 -13.753 -4.484 263 H LEU 39 H LEU 39 11.134 -8.914 -3.206 264 HA LEU 39 HA LEU 39 10.274 -6.540 -1.638 265 HB2 LEU 39 1HB LEU 39 8.990 -8.438 -3.592 266 HB3 LEU 39 2HB LEU 39 7.996 -7.674 -2.384 267 HG LEU 39 HG LEU 39 8.070 -6.602 -4.661 268 HD11 LEU 39 1HD1 LEU 39 8.080 -4.291 -3.836 269 HD12 LEU 39 2HD1 LEU 39 8.773 -4.882 -2.292 270 HD13 LEU 39 3HD1 LEU 39 7.151 -5.411 -2.822 271 HD21 LEU 39 3HD2 LEU 39 10.706 -5.392 -3.757 272 HD22 LEU 39 1HD2 LEU 39 9.816 -5.033 -5.229 273 HD23 LEU 39 2HD2 LEU 39 10.559 -6.633 -5.031 274 H LYS 40 H LYS 40 8.726 -7.197 0.170 275 HA LYS 40 HA LYS 40 9.378 -9.890 1.278 276 HB2 LYS 40 1HB LYS 40 10.977 -8.078 2.046 277 HB3 LYS 40 2HB LYS 40 9.595 -7.229 2.752 278 HG2 LYS 40 1HG LYS 40 9.156 -9.346 4.127 279 HG3 LYS 40 2HG LYS 40 10.694 -9.978 3.496 280 HD2 LYS 40 1HD LYS 40 11.842 -7.924 4.444 281 HD3 LYS 40 2HD LYS 40 10.271 -7.417 5.100 282 HE2 LYS 40 1HE LYS 40 10.322 -9.903 6.108 283 HE3 LYS 40 2HE LYS 40 12.068 -9.705 5.930 284 HZ1 LYS 40 3HZ LYS 40 11.317 -9.000 8.095 285 HZ2 LYS 40 1HZ LYS 40 10.201 -7.988 7.440 286 HZ3 LYS 40 2HZ LYS 40 11.773 -7.612 7.287 287 H ASP 41 H ASP 41 7.606 -10.813 2.072 288 HA ASP 41 HA ASP 41 5.104 -9.286 2.258 289 HB2 ASP 41 1HB ASP 41 5.321 -11.770 1.459 290 HB3 ASP 41 2HB ASP 41 5.352 -12.145 3.181 291 H GLY 42 H GLY 42 4.666 -8.104 4.060 292 HA2 GLY 42 1HA GLY 42 6.203 -8.517 6.512 293 HA3 GLY 42 2HA GLY 42 5.087 -7.212 6.181 294 H ALA 43 H ALA 43 3.505 -10.186 5.408 295 HA ALA 43 HA ALA 43 2.108 -10.490 7.937 296 HB1 ALA 43 1HB ALA 43 1.543 -12.722 7.008 297 HB2 ALA 43 2HB ALA 43 1.162 -11.419 5.875 298 HB3 ALA 43 3HB ALA 43 2.599 -12.415 5.614 299 H THR 44 H THR 44 4.636 -12.456 6.329 300 HA THR 44 HA THR 44 5.368 -13.559 8.972 301 HB THR 44 HB THR 44 5.518 -15.691 7.379 302 HG1 THR 44 1HG THR 44 3.644 -15.505 5.940 303 HG21 THR 44 3HG2 THR 44 2.840 -14.480 8.238 304 HG22 THR 44 1HG2 THR 44 3.958 -15.314 9.329 305 HG23 THR 44 2HG2 THR 44 3.196 -16.198 8.000 306 H GLY 45 H GLY 45 6.667 -12.157 6.061 307 HA2 GLY 45 1HA GLY 45 8.782 -11.380 5.919 308 HA3 GLY 45 2HA GLY 45 9.365 -12.537 7.139 309 H GLU 46 H GLU 46 7.553 -12.877 4.068 310 HA GLU 46 HA GLU 46 9.442 -14.991 3.202 311 HB2 GLU 46 1HB GLU 46 6.783 -14.414 1.872 312 HB3 GLU 46 2HB GLU 46 7.725 -15.911 1.924 313 HG2 GLU 46 1HG GLU 46 7.240 -15.804 4.526 314 HG3 GLU 46 2HG GLU 46 5.991 -14.645 4.050 315 H SER 47 H SER 47 10.754 -14.611 1.382 316 HA SER 47 HA SER 47 10.847 -11.898 0.340 317 HB2 SER 47 1HB SER 47 12.698 -12.993 -1.089 318 HB3 SER 47 2HB SER 47 12.945 -12.830 0.653 319 HG SER 47 HG SER 47 13.477 -14.858 0.332 320 H LEU 48 H LEU 48 9.999 -11.201 -1.492 321 HA LEU 48 HA LEU 48 8.603 -13.073 -3.337 322 HB2 LEU 48 1HB LEU 48 7.844 -10.224 -2.650 323 HB3 LEU 48 2HB LEU 48 6.923 -11.376 -3.619 324 HG LEU 48 HG LEU 48 7.419 -11.557 -0.616 325 HD11 LEU 48 1HD1 LEU 48 5.985 -9.707 -1.243 326 HD12 LEU 48 2HD1 LEU 48 5.004 -10.989 -0.525 327 HD13 LEU 48 3HD1 LEU 48 4.991 -10.767 -2.273 328 HD21 LEU 48 3HD2 LEU 48 5.751 -13.361 -0.636 329 HD22 LEU 48 1HD2 LEU 48 7.141 -13.814 -1.628 330 HD23 LEU 48 2HD2 LEU 48 5.661 -13.263 -2.432 331 H ALA 49 H ALA 49 8.167 -11.792 -5.451 332 HA ALA 49 HA ALA 49 10.795 -10.785 -6.456 333 HB1 ALA 49 1HB ALA 49 10.315 -13.239 -6.837 334 HB2 ALA 49 2HB ALA 49 8.866 -12.785 -7.734 335 HB3 ALA 49 3HB ALA 49 10.462 -12.314 -8.345 336 H SER 50 H SER 50 10.318 -8.718 -7.003 337 HA SER 50 HA SER 50 7.716 -7.752 -7.520 338 HB2 SER 50 1HB SER 50 8.793 -6.053 -6.768 339 HB3 SER 50 2HB SER 50 10.386 -6.582 -7.289 340 HG SER 50 HG SER 50 9.841 -5.547 -9.354 341 HA PRO 51 HA PRO 51 6.884 -5.813 -8.520 342 HB2 PRO 51 1HB PRO 51 4.884 -5.057 -10.126 343 HB3 PRO 51 2HB PRO 51 6.582 -4.523 -10.400 344 HG2 PRO 51 1HG PRO 51 5.142 -6.804 -11.747 345 HG3 PRO 51 2HG PRO 51 6.024 -5.449 -12.529 346 HD2 PRO 51 1HD PRO 51 7.222 -7.865 -12.041 347 HD3 PRO 51 2HD PRO 51 8.118 -6.337 -11.941 348 H VAL 52 H VAL 52 4.475 -5.900 -7.704 349 HA VAL 52 HA VAL 52 3.319 -8.577 -7.931 350 HB VAL 52 HB VAL 52 5.073 -8.744 -6.326 351 HG11 VAL 52 1HG1 VAL 52 5.089 -7.562 -4.171 352 HG12 VAL 52 2HG1 VAL 52 5.237 -6.429 -5.523 353 HG13 VAL 52 3HG1 VAL 52 3.677 -6.629 -4.689 354 HG21 VAL 52 3HG2 VAL 52 3.854 -9.663 -4.400 355 HG22 VAL 52 1HG2 VAL 52 2.382 -8.822 -4.907 356 HG23 VAL 52 2HG2 VAL 52 3.073 -10.104 -5.926 357 H ILE 53 H ILE 53 1.212 -8.710 -7.214 358 HA ILE 53 HA ILE 53 -0.179 -6.110 -6.875 359 HB ILE 53 HB ILE 53 -1.063 -8.652 -8.307 360 HG12 ILE 53 1HG1 ILE 53 0.539 -7.693 -9.785 361 HG13 ILE 53 2HG1 ILE 53 -1.043 -7.226 -10.383 362 HG21 ILE 53 1HG2 ILE 53 -2.874 -7.246 -7.217 363 HG22 ILE 53 2HG2 ILE 53 -2.436 -5.954 -8.340 364 HG23 ILE 53 3HG2 ILE 53 -3.035 -7.504 -8.951 365 HD11 ILE 53 3HD1 ILE 53 0.317 -5.315 -10.627 366 HD12 ILE 53 1HD1 ILE 53 -0.701 -4.956 -9.226 367 HD13 ILE 53 2HD1 ILE 53 0.986 -5.452 -9.014 368 H LEU 54 H LEU 54 -0.829 -5.965 -4.920 369 HA LEU 54 HA LEU 54 -1.573 -8.302 -3.284 370 HB2 LEU 54 1HB LEU 54 -1.771 -5.355 -2.704 371 HB3 LEU 54 2HB LEU 54 -2.274 -6.635 -1.632 372 HG LEU 54 HG LEU 54 -0.242 -5.683 -0.853 373 HD11 LEU 54 1HD1 LEU 54 -0.616 -8.055 -0.457 374 HD12 LEU 54 2HD1 LEU 54 1.100 -7.706 -0.615 375 HD13 LEU 54 3HD1 LEU 54 0.229 -8.479 -1.965 376 HD21 LEU 54 3HD2 LEU 54 1.844 -5.635 -1.959 377 HD22 LEU 54 1HD2 LEU 54 0.677 -4.922 -3.074 378 HD23 LEU 54 2HD2 LEU 54 1.255 -6.588 -3.337 379 H SER 55 H SER 55 -3.283 -9.173 -4.229 380 HA SER 55 HA SER 55 -5.501 -7.477 -5.264 381 HB2 SER 55 1HB SER 55 -4.903 -10.441 -5.576 382 HB3 SER 55 2HB SER 55 -6.371 -9.637 -6.174 383 HG SER 55 HG SER 55 -4.810 -9.722 -7.817 384 H ASP 56 H ASP 56 -7.659 -8.867 -4.714 385 HA ASP 56 HA ASP 56 -8.194 -7.955 -2.183 386 HB2 ASP 56 1HB ASP 56 -9.746 -8.492 -4.176 387 HB3 ASP 56 2HB ASP 56 -9.883 -10.119 -3.461 388 H GLU 57 H GLU 57 -7.061 -11.135 -2.995 389 HA GLU 57 HA GLU 57 -7.779 -12.570 -0.595 390 HB2 GLU 57 1HB GLU 57 -5.553 -12.930 -2.678 391 HB3 GLU 57 2HB GLU 57 -5.869 -14.049 -1.355 392 HG2 GLU 57 1HG GLU 57 -8.261 -14.276 -2.292 393 HG3 GLU 57 2HG GLU 57 -7.667 -13.421 -3.724 394 H GLU 58 H GLU 58 -4.951 -10.652 -1.665 395 HA GLU 58 HA GLU 58 -3.357 -11.288 0.677 396 HB2 GLU 58 1HB GLU 58 -2.809 -8.942 -1.114 397 HB3 GLU 58 2HB GLU 58 -1.678 -10.048 -0.344 398 HG2 GLU 58 1HG GLU 58 -3.346 -10.491 -2.851 399 HG3 GLU 58 2HG GLU 58 -1.612 -10.263 -2.745 400 H LEU 59 H LEU 59 -5.829 -9.105 -0.049 401 HA LEU 59 HA LEU 59 -5.150 -7.237 2.189 402 HB2 LEU 59 1HB LEU 59 -6.552 -6.872 -0.457 403 HB3 LEU 59 2HB LEU 59 -6.703 -5.677 0.835 404 HG LEU 59 HG LEU 59 -3.935 -6.565 0.015 405 HD11 LEU 59 1HD1 LEU 59 -5.168 -5.935 -2.096 406 HD12 LEU 59 2HD1 LEU 59 -3.771 -4.925 -1.703 407 HD13 LEU 59 3HD1 LEU 59 -5.369 -4.304 -1.398 408 HD21 LEU 59 3HD2 LEU 59 -3.324 -4.324 0.735 409 HD22 LEU 59 1HD2 LEU 59 -4.307 -5.080 2.003 410 HD23 LEU 59 2HD2 LEU 59 -5.033 -3.869 0.938 411 H ALA 60 H ALA 60 -6.679 -9.879 2.149 412 HA ALA 60 HA ALA 60 -9.362 -9.272 2.979 413 HB1 ALA 60 1HB ALA 60 -8.604 -11.436 1.971 414 HB2 ALA 60 2HB ALA 60 -7.757 -11.791 3.492 415 HB3 ALA 60 3HB ALA 60 -9.522 -11.611 3.478 416 H VAL 61 H VAL 61 -6.939 -8.029 4.461 417 HA VAL 61 HA VAL 61 -7.401 -8.943 7.249 418 HB VAL 61 HB VAL 61 -4.823 -8.419 7.346 419 HG11 VAL 61 1HG1 VAL 61 -4.207 -10.693 6.807 420 HG12 VAL 61 2HG1 VAL 61 -5.721 -10.670 7.711 421 HG13 VAL 61 3HG1 VAL 61 -5.754 -10.957 5.963 422 HG21 VAL 61 3HG2 VAL 61 -3.546 -8.717 5.374 423 HG22 VAL 61 1HG2 VAL 61 -4.914 -9.327 4.441 424 HG23 VAL 61 2HG2 VAL 61 -4.875 -7.620 4.895 425 H GLU 62 H GLU 62 -6.659 -7.388 8.825 426 HA GLU 62 HA GLU 62 -7.826 -4.813 8.379 427 HB2 GLU 62 1HB GLU 62 -6.964 -4.336 10.682 428 HB3 GLU 62 2HB GLU 62 -7.896 -5.835 10.555 429 HG2 GLU 62 1HG GLU 62 -5.870 -7.184 10.604 430 HG3 GLU 62 2HG GLU 62 -4.875 -5.744 10.482 431 H LYS 63 H LYS 63 -4.467 -5.871 8.044 432 HA LYS 63 HA LYS 63 -3.523 -3.117 7.488 433 HB2 LYS 63 1HB LYS 63 -3.908 -3.542 10.043 434 HB3 LYS 63 2HB LYS 63 -2.520 -4.602 9.933 435 HG2 LYS 63 1HG LYS 63 -2.598 -1.671 9.231 436 HG3 LYS 63 2HG LYS 63 -2.092 -2.359 10.774 437 HD2 LYS 63 1HD LYS 63 -0.166 -3.451 9.697 438 HD3 LYS 63 2HD LYS 63 -0.634 -2.777 8.135 439 HE2 LYS 63 1HE LYS 63 1.182 -1.496 9.231 440 HE3 LYS 63 2HE LYS 63 -0.256 -0.522 8.867 441 HZ1 LYS 63 3HZ LYS 63 0.313 -1.665 11.519 442 HZ2 LYS 63 1HZ LYS 63 -0.879 -0.576 11.139 443 HZ3 LYS 63 2HZ LYS 63 0.707 -0.129 11.071 444 H VAL 64 H VAL 64 -1.963 -3.427 5.954 445 HA VAL 64 HA VAL 64 -0.501 -6.009 5.977 446 HB VAL 64 HB VAL 64 -1.417 -4.829 3.347 447 HG11 VAL 64 1HG1 VAL 64 -1.096 -7.018 2.518 448 HG12 VAL 64 2HG1 VAL 64 0.271 -6.796 3.632 449 HG13 VAL 64 3HG1 VAL 64 -1.133 -7.738 4.129 450 HG21 VAL 64 3HG2 VAL 64 -3.555 -5.008 4.403 451 HG22 VAL 64 1HG2 VAL 64 -3.339 -6.508 3.481 452 HG23 VAL 64 2HG2 VAL 64 -3.062 -6.490 5.235 453 H THR 65 H THR 65 1.402 -5.110 6.745 454 HA THR 65 HA THR 65 2.553 -2.745 5.453 455 HB THR 65 HB THR 65 3.774 -4.666 7.473 456 HG1 THR 65 1HG THR 65 2.070 -3.986 8.488 457 HG21 THR 65 3HG2 THR 65 4.387 -1.790 6.629 458 HG22 THR 65 1HG2 THR 65 5.442 -3.204 6.501 459 HG23 THR 65 2HG2 THR 65 5.046 -2.538 8.089 460 H LEU 66 H LEU 66 4.038 -2.877 3.741 461 HA LEU 66 HA LEU 66 5.293 -5.511 3.137 462 HB2 LEU 66 1HB LEU 66 3.921 -3.691 1.115 463 HB3 LEU 66 2HB LEU 66 5.084 -4.914 0.707 464 HG LEU 66 HG LEU 66 3.013 -5.761 0.159 465 HD11 LEU 66 1HD1 LEU 66 2.862 -7.836 1.444 466 HD12 LEU 66 2HD1 LEU 66 3.808 -7.133 2.756 467 HD13 LEU 66 3HD1 LEU 66 4.561 -7.401 1.165 468 HD21 LEU 66 3HD2 LEU 66 1.724 -4.277 1.740 469 HD22 LEU 66 1HD2 LEU 66 1.985 -5.517 2.976 470 HD23 LEU 66 2HD2 LEU 66 1.097 -5.925 1.494 471 H SER 67 H SER 67 7.358 -5.292 2.194 472 HA SER 67 HA SER 67 8.500 -2.592 1.946 473 HB2 SER 67 1HB SER 67 8.626 -3.250 4.394 474 HB3 SER 67 2HB SER 67 9.613 -4.639 3.900 475 HG SER 67 HG SER 67 10.279 -1.929 3.296 476 H THR 68 H THR 68 10.903 -2.799 1.308 477 HA THR 68 HA THR 68 11.237 -4.923 -0.666 478 HB THR 68 HB THR 68 13.363 -3.674 -1.077 479 HG1 THR 68 1HG THR 68 13.942 -2.069 0.111 480 HG21 THR 68 3HG2 THR 68 10.827 -1.949 -1.074 481 HG22 THR 68 1HG2 THR 68 11.220 -3.196 -2.277 482 HG23 THR 68 2HG2 THR 68 12.223 -1.741 -2.125 483 H THR 69 H THR 69 13.287 -6.227 -0.640 484 HA THR 69 HA THR 69 14.127 -6.989 2.092 485 HB THR 69 HB THR 69 15.380 -8.760 0.898 486 HG1 THR 69 1HG THR 69 14.606 -9.043 -1.327 487 HG21 THR 69 3HG2 THR 69 12.452 -8.589 0.112 488 HG22 THR 69 1HG2 THR 69 13.056 -9.177 1.666 489 HG23 THR 69 2HG2 THR 69 13.417 -10.081 0.186 490 H GLY 70 H GLY 70 14.955 -4.528 -0.032 491 HA2 GLY 70 1HA GLY 70 17.377 -4.039 1.423 492 HA3 GLY 70 2HA GLY 70 17.702 -4.633 -0.212 493 H LYS 71 H LYS 71 18.769 -2.659 -0.340 494 HA LYS 71 HA LYS 71 17.832 -0.042 -0.503 495 HB2 LYS 71 1HB LYS 71 20.207 -1.246 -0.724 496 HB3 LYS 71 2HB LYS 71 19.772 -1.384 -2.413 497 HG2 LYS 71 1HG LYS 71 20.449 1.030 -0.852 498 HG3 LYS 71 2HG LYS 71 21.196 0.379 -2.296 499 HD2 LYS 71 1HD LYS 71 18.890 0.945 -3.457 500 HD3 LYS 71 2HD LYS 71 18.646 1.986 -2.045 501 HE2 LYS 71 1HE LYS 71 19.670 3.399 -3.586 502 HE3 LYS 71 2HE LYS 71 21.018 2.866 -2.563 503 HZ1 LYS 71 3HZ LYS 71 21.028 2.742 -5.230 504 HZ2 LYS 71 1HZ LYS 71 20.543 1.200 -4.870 505 HZ3 LYS 71 2HZ LYS 71 21.965 1.773 -4.305 506 H ALA 72 H ALA 72 16.251 0.828 -1.816 507 HA ALA 72 HA ALA 72 15.890 -0.357 -4.500 508 HB1 ALA 72 1HB ALA 72 13.440 0.081 -4.274 509 HB2 ALA 72 2HB ALA 72 14.048 -1.127 -3.130 510 HB3 ALA 72 3HB ALA 72 13.716 0.530 -2.570 511 H ILE 73 H ILE 73 14.956 1.195 -6.036 512 HA ILE 73 HA ILE 73 15.519 4.040 -5.363 513 HB ILE 73 HB ILE 73 15.517 3.095 -8.198 514 HG12 ILE 73 1HG1 ILE 73 16.817 1.259 -7.430 515 HG13 ILE 73 2HG1 ILE 73 17.826 2.414 -8.210 516 HG21 ILE 73 1HG2 ILE 73 17.353 4.743 -8.379 517 HG22 ILE 73 2HG2 ILE 73 15.926 5.444 -7.614 518 HG23 ILE 73 3HG2 ILE 73 17.301 4.993 -6.615 519 HD11 ILE 73 3HD1 ILE 73 17.949 1.428 -5.459 520 HD12 ILE 73 1HD1 ILE 73 19.216 2.055 -6.505 521 HD13 ILE 73 2HD1 ILE 73 18.186 3.185 -5.591 522 H GLU 74 H GLU 74 12.861 2.007 -5.835 523 HA GLU 74 HA GLU 74 11.215 4.260 -6.356 524 HB2 GLU 74 1HB GLU 74 10.998 1.903 -8.302 525 HB3 GLU 74 2HB GLU 74 9.861 3.254 -8.099 526 HG2 GLU 74 1HG GLU 74 11.747 4.796 -8.635 527 HG3 GLU 74 2HG GLU 74 12.645 3.393 -9.248 528 H PHE 75 H PHE 75 8.975 3.746 -5.947 529 HA PHE 75 HA PHE 75 8.185 1.104 -5.051 530 HB2 PHE 75 1HB PHE 75 9.518 2.361 -3.164 531 HB3 PHE 75 2HB PHE 75 8.084 3.332 -2.982 532 HD1 PHE 75 1HD PHE 75 8.884 -0.315 -3.498 533 HD2 PHE 75 2HD PHE 75 6.966 2.669 -1.024 534 HE1 PHE 75 1HE PHE 75 8.350 -2.051 -1.802 535 HE2 PHE 75 2HE PHE 75 6.488 0.973 0.628 536 HZ PHE 75 HZ PHE 75 7.151 -1.418 0.285 537 H ALA 76 H ALA 76 6.941 1.771 -7.006 538 HA ALA 76 HA ALA 76 4.977 3.879 -6.843 539 HB1 ALA 76 1HB ALA 76 5.127 1.383 -8.596 540 HB2 ALA 76 2HB ALA 76 3.959 2.710 -8.820 541 HB3 ALA 76 3HB ALA 76 5.694 3.009 -8.994 542 H VAL 77 H VAL 77 2.769 3.798 -6.291 543 HA VAL 77 HA VAL 77 1.577 1.310 -5.286 544 HB VAL 77 HB VAL 77 1.927 3.880 -3.694 545 HG11 VAL 77 1HG1 VAL 77 0.153 1.492 -3.026 546 HG12 VAL 77 2HG1 VAL 77 0.477 2.884 -1.973 547 HG13 VAL 77 3HG1 VAL 77 -0.413 3.112 -3.480 548 HG21 VAL 77 3HG2 VAL 77 3.788 2.263 -3.444 549 HG22 VAL 77 1HG2 VAL 77 2.836 2.366 -1.957 550 HG23 VAL 77 2HG2 VAL 77 2.634 0.978 -3.051 551 H SER 78 H SER 78 -0.211 1.153 -6.560 552 HA SER 78 HA SER 78 -1.924 3.551 -6.895 553 HB2 SER 78 1HB SER 78 -1.406 1.414 -9.004 554 HB3 SER 78 2HB SER 78 -2.519 2.792 -9.160 555 HG SER 78 HG SER 78 -0.740 4.171 -9.175 556 H GLY 79 H GLY 79 -4.283 2.924 -7.052 557 HA2 GLY 79 1HA GLY 79 -5.448 0.487 -6.998 558 HA3 GLY 79 2HA GLY 79 -4.808 0.639 -5.352 559 H GLY 80 H GLY 80 -7.301 0.430 -5.056 560 HA2 GLY 80 1HA GLY 80 -8.258 2.752 -3.887 561 HA3 GLY 80 2HA GLY 80 -9.015 2.613 -5.499 562 H VAL 81 H VAL 81 -10.738 2.516 -3.447 563 HA VAL 81 HA VAL 81 -11.827 -0.150 -3.732 564 HB VAL 81 HB VAL 81 -12.522 -0.044 -1.216 565 HG11 VAL 81 1HG1 VAL 81 -11.229 -1.852 -2.257 566 HG12 VAL 81 2HG1 VAL 81 -9.727 -0.956 -1.903 567 HG13 VAL 81 3HG1 VAL 81 -10.772 -1.516 -0.572 568 HG21 VAL 81 3HG2 VAL 81 -11.419 2.112 -0.652 569 HG22 VAL 81 1HG2 VAL 81 -10.855 0.755 0.332 570 HG23 VAL 81 2HG2 VAL 81 -9.833 1.362 -0.978 571 H VAL 82 H VAL 82 -13.929 0.023 -4.146 572 HA VAL 82 HA VAL 82 -15.589 1.840 -2.562 573 HB VAL 82 HB VAL 82 -17.122 2.096 -4.644 574 HG11 VAL 82 1HG1 VAL 82 -16.081 3.919 -3.411 575 HG12 VAL 82 2HG1 VAL 82 -14.620 3.785 -4.410 576 HG13 VAL 82 3HG1 VAL 82 -16.180 4.260 -5.130 577 HG21 VAL 82 3HG2 VAL 82 -16.194 2.047 -6.793 578 HG22 VAL 82 1HG2 VAL 82 -14.524 2.000 -6.198 579 HG23 VAL 82 2HG2 VAL 82 -15.577 0.585 -6.060 580 H ASP 83 H ASP 83 -17.804 1.132 -2.441 581 HA ASP 83 HA ASP 83 -18.079 -1.490 -1.607 582 HB2 ASP 83 1HB ASP 83 -19.324 0.503 -0.858 583 HB3 ASP 83 2HB ASP 83 -20.069 0.648 -2.445 584 H GLY 84 H GLY 84 -18.451 -3.338 -2.737 585 HA2 GLY 84 1HA GLY 84 -18.454 -3.197 -5.651 586 HA3 GLY 84 2HA GLY 84 -18.391 -4.642 -4.645 587 H GLU 85 H GLU 85 -21.062 -2.979 -3.443 588 HA GLU 85 HA GLU 85 -22.852 -4.573 -5.185 589 HB2 GLU 85 1HB GLU 85 -23.813 -5.513 -3.009 590 HB3 GLU 85 2HB GLU 85 -22.304 -6.124 -3.623 591 HG2 GLU 85 1HG GLU 85 -21.082 -4.677 -1.909 592 HG3 GLU 85 2HG GLU 85 -22.668 -4.341 -1.200 593 H ASP 86 H ASP 86 -25.136 -4.393 -4.452 594 HA ASP 86 HA ASP 86 -25.953 -1.644 -3.760 595 HB2 ASP 86 1HB ASP 86 -27.388 -1.587 -5.672 596 HB3 ASP 86 2HB ASP 86 -25.758 -1.892 -6.233 597 H GLY 87 H GLY 87 -25.842 -3.930 -2.164 598 HA2 GLY 87 1HA GLY 87 -28.703 -4.511 -1.596 599 HA3 GLY 87 2HA GLY 87 -27.677 -5.874 -2.063 600 H VAL 88 H VAL 88 -25.506 -3.958 -0.369 601 HA VAL 88 HA VAL 88 -26.364 -5.069 2.252 602 HB VAL 88 HB VAL 88 -23.554 -5.220 1.135 603 HG11 VAL 88 1HG1 VAL 88 -23.698 -5.110 3.606 604 HG12 VAL 88 2HG1 VAL 88 -24.854 -6.468 3.605 605 HG13 VAL 88 3HG1 VAL 88 -23.177 -6.713 3.071 606 HG21 VAL 88 3HG2 VAL 88 -25.690 -7.394 1.326 607 HG22 VAL 88 1HG2 VAL 88 -24.912 -6.801 -0.156 608 HG23 VAL 88 2HG2 VAL 88 -23.972 -7.702 1.018 609 H VAL 89 H VAL 89 -27.157 -2.999 2.641 610 HA VAL 89 HA VAL 89 -25.674 -0.574 2.506 611 HB VAL 89 HB VAL 89 -28.012 -1.452 4.255 612 HG11 VAL 89 1HG1 VAL 89 -27.089 1.380 3.654 613 HG12 VAL 89 2HG1 VAL 89 -28.536 0.918 4.565 614 HG13 VAL 89 3HG1 VAL 89 -26.942 0.564 5.226 615 HG21 VAL 89 3HG2 VAL 89 -27.933 0.095 1.630 616 HG22 VAL 89 1HG2 VAL 89 -28.542 -1.554 1.844 617 HG23 VAL 89 2HG2 VAL 89 -29.388 -0.203 2.599 618 H ASN 90 H ASN 90 -23.639 -0.664 3.318 619 HA ASN 90 HA ASN 90 -23.154 -1.583 6.090 620 HB2 ASN 90 1HB ASN 90 -20.794 -1.865 5.452 621 HB3 ASN 90 2HB ASN 90 -21.881 -2.909 4.546 622 HD21 ASN 90 1HD2 ASN 90 -22.357 -2.382 2.382 623 HD22 ASN 90 2HD2 ASN 90 -21.353 -1.345 1.392 624 H GLU 91 H GLU 91 -21.293 -0.332 7.151 625 HA GLU 91 HA GLU 91 -21.671 2.573 6.819 626 HB2 GLU 91 1HB GLU 91 -20.297 0.791 8.837 627 HB3 GLU 91 2HB GLU 91 -19.595 2.372 8.552 628 HG2 GLU 91 1HG GLU 91 -22.043 3.309 8.808 629 HG3 GLU 91 2HG GLU 91 -22.322 1.823 9.703 630 HA PRO 92 HA PRO 92 -18.364 2.715 4.111 631 HB2 PRO 92 1HB PRO 92 -17.621 5.335 4.152 632 HB3 PRO 92 2HB PRO 92 -19.282 4.839 3.702 633 HG2 PRO 92 1HG PRO 92 -18.287 5.758 6.430 634 HG3 PRO 92 2HG PRO 92 -19.677 6.395 5.489 635 HD2 PRO 92 1HD PRO 92 -20.003 4.471 7.387 636 HD3 PRO 92 2HD PRO 92 -20.957 4.464 5.873 637 H MET 93 H MET 93 -15.920 3.921 3.804 638 HA MET 93 HA MET 93 -14.357 2.886 6.074 639 HB2 MET 93 1HB MET 93 -13.078 1.512 4.658 640 HB3 MET 93 2HB MET 93 -14.738 1.083 4.382 641 HG2 MET 93 1HG MET 93 -14.723 2.472 2.297 642 HG3 MET 93 2HG MET 93 -13.033 2.870 2.601 643 HE1 MET 93 3HE MET 93 -12.793 -0.601 3.762 644 HE2 MET 93 1HE MET 93 -11.707 -1.067 2.437 645 HE3 MET 93 2HE MET 93 -11.424 0.441 3.350 646 H GLN 94 H GLN 94 -12.065 3.224 5.761 647 HA GLN 94 HA GLN 94 -11.192 5.393 3.989 648 HB2 GLN 94 1HB GLN 94 -10.875 5.285 7.047 649 HB3 GLN 94 2HB GLN 94 -9.855 6.280 5.994 650 HG2 GLN 94 1HG GLN 94 -11.827 7.451 5.139 651 HG3 GLN 94 2HG GLN 94 -12.903 6.506 6.182 652 HE21 GLN 94 1HE2 GLN 94 -10.848 9.319 5.989 653 HE22 GLN 94 2HE2 GLN 94 -10.830 9.660 7.721 654 H TRP 95 H TRP 95 -9.082 5.256 3.580 655 HA TRP 95 HA TRP 95 -7.551 2.821 4.391 656 HB2 TRP 95 1HB TRP 95 -7.969 4.239 1.745 657 HB3 TRP 95 2HB TRP 95 -6.377 3.632 2.112 658 HD1 TRP 95 HD TRP 95 -9.191 1.384 3.309 659 HE1 TRP 95 1HE TRP 95 -9.066 -0.821 1.973 660 HE3 TRP 95 3HE TRP 95 -5.824 2.787 -0.324 661 HZ2 TRP 95 2HZ TRP 95 -7.764 -1.789 -0.380 662 HZ3 TRP 95 3HZ TRP 95 -5.184 1.189 -2.081 663 HH2 TRP 95 HH TRP 95 -6.134 -1.093 -2.135 664 H VAL 96 H VAL 96 -6.066 3.547 5.906 665 HA VAL 96 HA VAL 96 -4.837 6.238 5.465 666 HB VAL 96 HB VAL 96 -4.623 4.410 7.875 667 HG11 VAL 96 1HG1 VAL 96 -3.518 7.195 7.357 668 HG12 VAL 96 2HG1 VAL 96 -3.424 6.306 8.899 669 HG13 VAL 96 3HG1 VAL 96 -2.565 5.700 7.484 670 HG21 VAL 96 3HG2 VAL 96 -5.877 6.004 9.112 671 HG22 VAL 96 1HG2 VAL 96 -5.980 7.122 7.738 672 HG23 VAL 96 2HG2 VAL 96 -6.843 5.573 7.704 673 H VAL 97 H VAL 97 -2.859 6.238 4.435 674 HA VAL 97 HA VAL 97 -1.575 3.654 3.868 675 HB VAL 97 HB VAL 97 -1.622 4.538 1.468 676 HG11 VAL 97 1HG1 VAL 97 -4.209 3.580 2.711 677 HG12 VAL 97 2HG1 VAL 97 -3.749 3.420 1.002 678 HG13 VAL 97 3HG1 VAL 97 -2.830 2.562 2.241 679 HG21 VAL 97 3HG2 VAL 97 -2.604 6.812 2.040 680 HG22 VAL 97 1HG2 VAL 97 -3.404 5.926 0.733 681 HG23 VAL 97 2HG2 VAL 97 -4.142 5.983 2.348 682 H THR 98 H THR 98 0.203 4.102 5.023 683 HA THR 98 HA THR 98 1.525 6.717 4.763 684 HB THR 98 HB THR 98 2.290 4.399 6.566 685 HG1 THR 98 1HG THR 98 0.605 4.728 7.763 686 HG21 THR 98 3HG2 THR 98 2.423 7.394 7.043 687 HG22 THR 98 1HG2 THR 98 3.806 6.360 6.601 688 HG23 THR 98 2HG2 THR 98 2.974 6.116 8.136 689 H VAL 99 H VAL 99 3.977 6.604 4.485 690 HA VAL 99 HA VAL 99 4.991 4.103 3.407 691 HB VAL 99 HB VAL 99 5.743 6.623 1.918 692 HG11 VAL 99 1HG1 VAL 99 6.703 4.972 0.346 693 HG12 VAL 99 2HG1 VAL 99 7.469 4.922 1.934 694 HG13 VAL 99 3HG1 VAL 99 6.296 3.666 1.473 695 HG21 VAL 99 3HG2 VAL 99 3.372 6.043 1.355 696 HG22 VAL 99 1HG2 VAL 99 4.470 5.728 0.008 697 HG23 VAL 99 2HG2 VAL 99 3.892 4.375 0.999 698 H TYR 100 H TYR 100 6.686 3.634 4.544 699 HA TYR 100 HA TYR 100 8.170 5.663 6.087 700 HB2 TYR 100 1HB TYR 100 8.034 2.635 6.367 701 HB3 TYR 100 2HB TYR 100 9.022 3.699 7.352 702 HD1 TYR 100 2HD TYR 100 7.971 5.181 9.062 703 HD2 TYR 100 1HD TYR 100 5.613 2.471 6.667 704 HE1 TYR 100 2HE TYR 100 6.038 5.512 10.594 705 HE2 TYR 100 1HE TYR 100 3.680 2.812 8.190 706 HH TYR 100 HH TYR 100 3.745 5.115 10.898 707 H LYS 101 H LYS 101 10.444 5.455 5.970 708 HA LYS 101 HA LYS 101 11.543 4.248 3.508 709 HB2 LYS 101 1HB LYS 101 11.456 6.851 3.972 710 HB3 LYS 101 2HB LYS 101 12.823 6.548 5.041 711 HG2 LYS 101 1HG LYS 101 14.170 5.799 3.191 712 HG3 LYS 101 2HG LYS 101 12.740 5.601 2.181 713 HD2 LYS 101 1HD LYS 101 12.421 7.934 1.961 714 HD3 LYS 101 2HD LYS 101 13.584 8.310 3.265 715 HE2 LYS 101 1HE LYS 101 15.307 7.201 1.659 716 HE3 LYS 101 2HE LYS 101 14.064 7.396 0.415 717 HZ1 LYS 101 3HZ LYS 101 15.461 9.231 0.346 718 HZ2 LYS 101 1HZ LYS 101 15.394 9.518 1.977 719 HZ3 LYS 101 2HZ LYS 101 14.059 9.780 1.003 720 H ASN 102 H ASN 102 14.155 4.489 4.459 721 HA ASN 102 HA ASN 102 14.571 2.209 6.168 722 HB2 ASN 102 1HB ASN 102 16.878 2.585 5.997 723 HB3 ASN 102 2HB ASN 102 16.130 2.729 4.415 724 HD21 ASN 102 1HD2 ASN 102 15.699 5.096 3.673 725 HD22 ASN 102 2HD2 ASN 102 16.977 6.212 4.009 726 H GLY 103 H GLY 103 13.257 2.868 7.871 727 HA2 GLY 103 1HA GLY 103 13.388 3.034 10.214 728 HA3 GLY 103 2HA GLY 103 14.883 3.953 10.063 729 H LYS 104 H LYS 104 12.135 5.231 8.256 730 HA LYS 104 HA LYS 104 11.334 7.072 10.384 731 HB2 LYS 104 1HB LYS 104 11.971 9.037 9.367 732 HB3 LYS 104 2HB LYS 104 13.337 7.958 9.653 733 HG2 LYS 104 1HG LYS 104 12.963 7.238 7.121 734 HG3 LYS 104 2HG LYS 104 12.068 8.792 7.025 735 HD2 LYS 104 1HD LYS 104 14.015 9.857 8.160 736 HD3 LYS 104 2HD LYS 104 14.875 8.304 8.076 737 HE2 LYS 104 1HE LYS 104 14.785 8.335 5.607 738 HE3 LYS 104 2HE LYS 104 13.741 9.772 5.632 739 HZ1 LYS 104 3HZ LYS 104 16.577 9.607 6.357 740 HZ2 LYS 104 1HZ LYS 104 15.655 10.968 6.642 741 HZ3 LYS 104 2HZ LYS 104 15.919 10.421 5.103 742 H GLU 105 H GLU 105 9.556 8.639 9.408 743 HA GLU 105 HA GLU 105 7.846 7.200 7.440 744 HB2 GLU 105 1HB GLU 105 7.073 7.894 9.820 745 HB3 GLU 105 2HB GLU 105 7.105 9.553 9.203 746 HG2 GLU 105 1HG GLU 105 5.619 8.605 7.268 747 HG3 GLU 105 2HG GLU 105 5.404 7.199 8.299 748 H ILE 106 H ILE 106 7.472 8.197 5.370 749 HA ILE 106 HA ILE 106 8.444 10.994 5.022 750 HB ILE 106 HB ILE 106 9.313 10.455 2.824 751 HG12 ILE 106 1HG1 ILE 106 9.901 7.854 2.557 752 HG13 ILE 106 2HG1 ILE 106 8.397 7.634 3.421 753 HG21 ILE 106 1HG2 ILE 106 10.616 8.772 4.968 754 HG22 ILE 106 2HG2 ILE 106 11.366 9.490 3.510 755 HG23 ILE 106 3HG2 ILE 106 10.761 10.539 4.788 756 HD11 ILE 106 3HD1 ILE 106 8.111 7.564 0.980 757 HD12 ILE 106 1HD1 ILE 106 7.266 8.987 1.615 758 HD13 ILE 106 2HD1 ILE 106 8.838 9.176 0.820 759 H GLU 107 H GLU 107 5.829 8.786 4.527 760 HA GLU 107 HA GLU 107 4.385 10.917 3.012 761 HB2 GLU 107 1HB GLU 107 4.951 8.963 1.550 762 HB3 GLU 107 2HB GLU 107 4.256 7.908 2.756 763 HG2 GLU 107 1HG GLU 107 2.761 8.241 0.839 764 HG3 GLU 107 2HG GLU 107 2.031 8.634 2.390 765 H LYS 108 H LYS 108 2.069 10.952 3.689 766 HA LYS 108 HA LYS 108 1.159 9.161 5.732 767 HB2 LYS 108 1HB LYS 108 2.719 10.842 6.992 768 HB3 LYS 108 2HB LYS 108 1.435 12.020 6.756 769 HG2 LYS 108 1HG LYS 108 -0.103 10.208 7.797 770 HG3 LYS 108 2HG LYS 108 1.400 9.349 8.202 771 HD2 LYS 108 1HD LYS 108 2.085 11.614 9.326 772 HD3 LYS 108 2HD LYS 108 0.359 11.995 9.238 773 HE2 LYS 108 1HE LYS 108 1.738 9.710 10.702 774 HE3 LYS 108 2HE LYS 108 0.928 11.097 11.422 775 HZ1 LYS 108 3HZ LYS 108 -0.235 8.729 10.211 776 HZ2 LYS 108 1HZ LYS 108 -1.142 10.125 10.232 777 HZ3 LYS 108 2HZ LYS 108 -0.570 9.475 11.634 778 H LYS 109 H LYS 109 -0.344 9.022 3.863 779 HA LYS 109 HA LYS 109 -2.350 11.209 3.996 780 HB2 LYS 109 1HB LYS 109 -2.777 11.117 1.631 781 HB3 LYS 109 2HB LYS 109 -1.134 11.573 1.992 782 HG2 LYS 109 1HG LYS 109 -0.618 10.163 0.311 783 HG3 LYS 109 2HG LYS 109 -0.669 8.959 1.586 784 HD2 LYS 109 1HD LYS 109 -1.947 7.902 0.077 785 HD3 LYS 109 2HD LYS 109 -3.256 8.795 0.847 786 HE2 LYS 109 1HE LYS 109 -1.781 9.551 -1.730 787 HE3 LYS 109 2HE LYS 109 -3.360 8.762 -1.639 788 HZ1 LYS 109 3HZ LYS 109 -2.727 11.535 -0.943 789 HZ2 LYS 109 1HZ LYS 109 -4.142 10.817 -0.457 790 HZ3 LYS 109 2HZ LYS 109 -3.815 10.906 -2.025 791 H SER 110 H SER 110 -4.517 10.476 3.090 792 HA SER 110 HA SER 110 -5.136 7.696 3.526 793 HB2 SER 110 1HB SER 110 -4.992 8.564 5.842 794 HB3 SER 110 2HB SER 110 -5.986 9.950 5.404 795 HG SER 110 HG SER 110 -7.006 7.328 5.152 796 H LEU 111 H LEU 111 -7.358 7.275 2.847 797 HA LEU 111 HA LEU 111 -8.659 9.464 1.444 798 HB2 LEU 111 1HB LEU 111 -8.742 6.669 0.392 799 HB3 LEU 111 2HB LEU 111 -9.180 8.185 -0.392 800 HG LEU 111 HG LEU 111 -6.721 8.831 -0.462 801 HD11 LEU 111 1HD1 LEU 111 -5.432 6.392 -0.384 802 HD12 LEU 111 2HD1 LEU 111 -6.674 6.172 0.874 803 HD13 LEU 111 3HD1 LEU 111 -5.525 7.525 0.986 804 HD21 LEU 111 3HD2 LEU 111 -7.588 6.221 -1.710 805 HD22 LEU 111 1HD2 LEU 111 -6.260 7.259 -2.300 806 HD23 LEU 111 2HD2 LEU 111 -7.941 7.842 -2.374 807 H VAL 112 H VAL 112 -10.745 8.003 0.678 808 HA VAL 112 HA VAL 112 -12.318 7.050 2.917 809 HB VAL 112 HB VAL 112 -11.634 9.276 3.587 810 HG11 VAL 112 1HG1 VAL 112 -12.981 10.486 1.176 811 HG12 VAL 112 2HG1 VAL 112 -12.362 11.349 2.588 812 HG13 VAL 112 3HG1 VAL 112 -11.249 10.473 1.538 813 HG21 VAL 112 3HG2 VAL 112 -13.743 10.230 4.212 814 HG22 VAL 112 1HG2 VAL 112 -14.594 9.278 2.971 815 HG23 VAL 112 2HG2 VAL 112 -13.793 8.483 4.351 816 H PHE 113 H PHE 113 -13.943 5.860 1.913 817 HA PHE 113 HA PHE 113 -15.398 7.095 -0.274 818 HB2 PHE 113 1HB PHE 113 -13.543 4.877 -0.819 819 HB3 PHE 113 2HB PHE 113 -15.181 4.428 -1.200 820 HD1 PHE 113 2HD PHE 113 -16.534 6.672 -2.360 821 HD2 PHE 113 1HD PHE 113 -12.417 5.458 -2.811 822 HE1 PHE 113 2HE PHE 113 -16.426 7.851 -4.503 823 HE2 PHE 113 1HE PHE 113 -12.258 6.768 -4.882 824 HZ PHE 113 HZ PHE 113 -14.246 7.926 -5.782 825 H ARG 114 H ARG 114 -17.350 5.513 -0.872 826 HA ARG 114 HA ARG 114 -18.436 4.247 1.509 827 HB2 ARG 114 1HB ARG 114 -19.954 6.589 0.254 828 HB3 ARG 114 2HB ARG 114 -20.340 5.692 1.718 829 HG2 ARG 114 1HG ARG 114 -18.014 6.680 2.540 830 HG3 ARG 114 2HG ARG 114 -18.274 7.839 1.271 831 HD2 ARG 114 1HD ARG 114 -20.287 7.228 3.482 832 HD3 ARG 114 2HD ARG 114 -18.988 8.419 3.673 833 HE ARG 114 HE ARG 114 -20.205 9.200 1.366 834 HH11 ARG 114 1HH1 ARG 114 -21.198 8.780 4.807 835 HH12 ARG 114 2HH1 ARG 114 -22.519 9.876 4.681 836 HH21 ARG 114 1HH2 ARG 114 -22.098 10.633 1.253 837 HH22 ARG 114 2HH2 ARG 114 -22.975 10.958 2.736 838 H ASP 115 H ASP 115 -20.647 3.495 0.982 839 HA ASP 115 HA ASP 115 -21.161 2.064 -1.325 840 HB2 ASP 115 1HB ASP 115 -22.585 1.580 0.387 841 HB3 ASP 115 2HB ASP 115 -22.704 3.246 0.916 842 H GLY 116 H GLY 116 -22.098 2.422 -3.284 843 HA2 GLY 116 1HA GLY 116 -23.731 3.374 -4.537 844 HA3 GLY 116 2HA GLY 116 -23.535 4.920 -3.735 845 H LYS 117 H LYS 117 -20.508 3.656 -4.922 846 HA LYS 117 HA LYS 117 -20.813 5.184 -7.430 847 HB2 LYS 117 1HB LYS 117 -19.442 6.192 -5.046 848 HB3 LYS 117 2HB LYS 117 -18.293 6.047 -6.367 849 HG2 LYS 117 1HG LYS 117 -20.977 7.442 -6.628 850 HG3 LYS 117 2HG LYS 117 -19.454 8.261 -6.253 851 HD2 LYS 117 1HD LYS 117 -18.500 7.814 -8.354 852 HD3 LYS 117 2HD LYS 117 -19.647 6.518 -8.718 853 HE2 LYS 117 1HE LYS 117 -21.495 8.209 -8.739 854 HE3 LYS 117 2HE LYS 117 -20.274 9.492 -8.610 855 HZ1 LYS 117 3HZ LYS 117 -19.315 8.709 -10.663 856 HZ2 LYS 117 1HZ LYS 117 -20.920 8.957 -10.919 857 HZ3 LYS 117 2HZ LYS 117 -20.327 7.427 -10.727 858 H GLU 118 H GLU 118 -20.650 3.246 -8.576 859 HA GLU 118 HA GLU 118 -18.345 1.597 -8.529 860 HB2 GLU 118 1HB GLU 118 -19.030 1.061 -10.920 861 HB3 GLU 118 2HB GLU 118 -20.215 0.729 -9.661 862 HG2 GLU 118 1HG GLU 118 -21.588 2.565 -10.269 863 HG3 GLU 118 2HG GLU 118 -20.339 3.327 -11.241 864 H ILE 119 H ILE 119 -16.351 2.469 -8.547 865 HA ILE 119 HA ILE 119 -15.327 3.912 -10.881 866 HB ILE 119 HB ILE 119 -14.312 5.632 -9.518 867 HG12 ILE 119 1HG1 ILE 119 -15.603 5.864 -7.141 868 HG13 ILE 119 2HG1 ILE 119 -15.495 4.126 -7.255 869 HG21 ILE 119 1HG2 ILE 119 -16.159 7.074 -9.166 870 HG22 ILE 119 2HG2 ILE 119 -16.494 6.081 -10.587 871 HG23 ILE 119 3HG2 ILE 119 -17.284 5.705 -9.038 872 HD11 ILE 119 3HD1 ILE 119 -13.550 4.884 -6.097 873 HD12 ILE 119 1HD1 ILE 119 -13.025 4.333 -7.678 874 HD13 ILE 119 2HD1 ILE 119 -13.171 6.071 -7.371 875 H SER 120 H SER 120 -12.727 4.017 -10.439 876 HA SER 120 HA SER 120 -11.669 2.430 -8.422 877 HB2 SER 120 1HB SER 120 -12.483 0.799 -10.709 878 HB3 SER 120 2HB SER 120 -10.737 0.745 -10.584 879 HG SER 120 HG SER 120 -11.649 -0.869 -9.419 880 H THR 121 H THR 121 -11.178 4.719 -10.364 881 HA THR 121 HA THR 121 -8.218 4.409 -10.656 882 HB THR 121 HB THR 121 -8.492 5.363 -13.006 883 HG1 THR 121 1HG THR 121 -10.585 5.978 -13.032 884 HG21 THR 121 3HG2 THR 121 -8.802 3.201 -14.027 885 HG22 THR 121 1HG2 THR 121 -9.639 2.573 -12.594 886 HG23 THR 121 2HG2 THR 121 -7.913 2.985 -12.517 887 H ASP 122 H ASP 122 -9.795 5.881 -8.728 888 HA ASP 122 HA ASP 122 -8.552 8.505 -9.069 889 HB2 ASP 122 1HB ASP 122 -10.818 8.549 -10.253 890 HB3 ASP 122 2HB ASP 122 -11.583 8.325 -8.690 891 H ASP 123 H ASP 123 -7.598 6.836 -7.442 892 HA ASP 123 HA ASP 123 -8.579 7.482 -4.715 893 HB2 ASP 123 1HB ASP 123 -8.552 4.786 -5.932 894 HB3 ASP 123 2HB ASP 123 -7.661 4.914 -4.420 895 H LEU 124 H LEU 124 -5.974 5.220 -5.819 896 HA LEU 124 HA LEU 124 -4.021 7.098 -4.596 897 HB2 LEU 124 1HB LEU 124 -4.464 4.188 -4.372 898 HB3 LEU 124 2HB LEU 124 -2.803 4.576 -4.750 899 HG LEU 124 HG LEU 124 -4.325 5.841 -2.439 900 HD11 LEU 124 1HD1 LEU 124 -4.019 3.394 -2.075 901 HD12 LEU 124 2HD1 LEU 124 -3.032 4.349 -0.973 902 HD13 LEU 124 3HD1 LEU 124 -2.283 3.578 -2.373 903 HD21 LEU 124 3HD2 LEU 124 -2.030 6.374 -1.630 904 HD22 LEU 124 1HD2 LEU 124 -2.418 7.211 -3.149 905 HD23 LEU 124 2HD2 LEU 124 -1.365 5.774 -3.161 906 H ASN 125 H ASN 125 -2.551 7.983 -5.772 907 HA ASN 125 HA ASN 125 -1.314 6.678 -8.111 908 HB2 ASN 125 1HB ASN 125 -2.805 8.165 -9.201 909 HB3 ASN 125 2HB ASN 125 -2.656 9.388 -7.949 910 HD21 ASN 125 1HD2 ASN 125 -0.335 7.736 -10.251 911 HD22 ASN 125 2HD2 ASN 125 0.348 9.278 -10.774 912 H LEU 126 H LEU 126 0.350 6.124 -6.510 913 HA LEU 126 HA LEU 126 2.028 8.438 -5.676 914 HB2 LEU 126 1HB LEU 126 0.999 6.154 -4.104 915 HB3 LEU 126 2HB LEU 126 2.758 6.281 -4.069 916 HG LEU 126 HG LEU 126 2.716 8.523 -3.220 917 HD11 LEU 126 1HD1 LEU 126 -0.322 8.337 -3.406 918 HD12 LEU 126 2HD1 LEU 126 0.755 9.528 -4.170 919 HD13 LEU 126 3HD1 LEU 126 0.560 9.540 -2.422 920 HD21 LEU 126 3HD2 LEU 126 2.627 6.664 -1.636 921 HD22 LEU 126 1HD2 LEU 126 0.847 6.629 -1.720 922 HD23 LEU 126 2HD2 LEU 126 1.683 8.035 -1.025 923 H TYR 127 H TYR 127 4.016 8.413 -6.507 924 HA TYR 127 HA TYR 127 5.155 5.918 -7.600 925 HB2 TYR 127 1HB TYR 127 3.727 7.590 -9.255 926 HB3 TYR 127 2HB TYR 127 5.353 8.223 -9.457 927 HD1 TYR 127 1HD TYR 127 7.085 5.873 -9.351 928 HD2 TYR 127 2HD TYR 127 3.177 6.328 -11.155 929 HE1 TYR 127 1HE TYR 127 7.525 3.985 -10.802 930 HE2 TYR 127 2HE TYR 127 3.628 4.404 -12.631 931 HH TYR 127 HH TYR 127 6.713 2.556 -12.314 932 H TYR 128 H TYR 128 6.325 6.265 -5.566 933 HA TYR 128 HA TYR 128 8.140 8.535 -5.401 934 HB2 TYR 128 1HB TYR 128 7.747 6.017 -3.786 935 HB3 TYR 128 2HB TYR 128 9.148 7.090 -3.576 936 HD1 TYR 128 1HD TYR 128 8.698 9.631 -3.362 937 HD2 TYR 128 2HD TYR 128 5.992 6.461 -2.196 938 HE1 TYR 128 1HE TYR 128 7.629 11.150 -1.746 939 HE2 TYR 128 2HE TYR 128 4.836 8.012 -0.656 940 HH TYR 128 HH TYR 128 4.561 10.530 -0.194 941 H ASN 129 H ASN 129 10.421 8.385 -5.552 942 HA ASN 129 HA ASN 129 11.744 6.129 -6.673 943 HB2 ASN 129 1HB ASN 129 12.454 7.047 -8.721 944 HB3 ASN 129 2HB ASN 129 10.686 7.065 -8.709 945 HD21 ASN 129 1HD2 ASN 129 12.242 8.594 -10.493 946 HD22 ASN 129 2HD2 ASN 129 12.150 10.307 -9.996 Start of MODEL 3 1 H1 GLY 1 H GLY 1 29.830 -13.155 -14.531 2 HA2 GLY 1 1HA GLY 1 32.777 -12.959 -14.715 3 HA3 GLY 1 2HA GLY 1 31.861 -14.273 -15.512 4 H ASP 2 H ASP 2 32.550 -10.900 -15.463 5 HA ASP 2 HA ASP 2 31.867 -9.012 -16.601 6 HB2 ASP 2 1HB ASP 2 30.968 -9.686 -18.697 7 HB3 ASP 2 2HB ASP 2 29.773 -10.755 -17.949 8 H ASP 3 H ASP 3 31.136 -7.871 -14.763 9 HA ASP 3 HA ASP 3 29.403 -9.220 -12.890 10 HB2 ASP 3 1HB ASP 3 32.378 -8.621 -12.478 11 HB3 ASP 3 2HB ASP 3 31.231 -8.958 -11.167 12 H ASP 4 H ASP 4 28.960 -7.715 -11.260 13 HA ASP 4 HA ASP 4 28.851 -4.869 -12.158 14 HB2 ASP 4 1HB ASP 4 27.125 -6.469 -13.213 15 HB3 ASP 4 2HB ASP 4 26.472 -6.694 -11.600 16 H GLU 5 H GLU 5 27.737 -3.532 -10.409 17 HA GLU 5 HA GLU 5 27.352 -4.610 -7.849 18 HB2 GLU 5 1HB GLU 5 29.816 -4.655 -7.662 19 HB3 GLU 5 2HB GLU 5 29.853 -2.891 -7.881 20 HG2 GLU 5 1HG GLU 5 28.121 -2.811 -5.912 21 HG3 GLU 5 2HG GLU 5 28.434 -4.523 -5.707 22 HA PRO 6 HA PRO 6 25.298 -0.666 -8.946 23 HB2 PRO 6 1HB PRO 6 22.835 -1.241 -7.996 24 HB3 PRO 6 2HB PRO 6 23.475 -1.910 -9.540 25 HG2 PRO 6 1HG PRO 6 23.509 -3.289 -6.842 26 HG3 PRO 6 2HG PRO 6 22.813 -3.906 -8.385 27 HD2 PRO 6 1HD PRO 6 25.328 -4.503 -7.570 28 HD3 PRO 6 2HD PRO 6 24.967 -4.238 -9.305 29 H GLY 7 H GLY 7 24.855 1.080 -7.496 30 HA2 GLY 7 1HA GLY 7 24.561 1.059 -4.763 31 HA3 GLY 7 2HA GLY 7 26.278 0.785 -4.963 32 H GLY 8 H GLY 8 23.806 3.010 -6.220 33 HA2 GLY 8 1HA GLY 8 25.623 5.338 -6.022 34 HA3 GLY 8 2HA GLY 8 23.931 5.333 -6.543 35 H LYS 9 H LYS 9 22.282 5.632 -4.983 36 HA LYS 9 HA LYS 9 22.707 5.526 -2.166 37 HB2 LYS 9 1HB LYS 9 23.950 7.638 -2.941 38 HB3 LYS 9 2HB LYS 9 22.397 8.295 -3.445 39 HG2 LYS 9 1HG LYS 9 21.614 8.409 -1.175 40 HG3 LYS 9 2HG LYS 9 22.919 7.345 -0.593 41 HD2 LYS 9 1HD LYS 9 24.608 9.026 -1.134 42 HD3 LYS 9 2HD LYS 9 23.367 10.096 -1.823 43 HE2 LYS 9 1HE LYS 9 22.334 10.439 0.316 44 HE3 LYS 9 2HE LYS 9 23.318 9.171 1.074 45 HZ1 LYS 9 3HZ LYS 9 24.597 11.556 -0.113 46 HZ2 LYS 9 1HZ LYS 9 25.203 10.485 0.955 47 HZ3 LYS 9 2HZ LYS 9 24.026 11.543 1.423 48 H GLY 10 H GLY 10 20.652 5.981 -1.147 49 HA2 GLY 10 1HA GLY 10 18.255 6.745 -2.534 50 HA3 GLY 10 2HA GLY 10 18.329 4.998 -2.259 51 H ALA 11 H ALA 11 16.690 4.909 -0.547 52 HA ALA 11 HA ALA 11 17.534 5.980 2.048 53 HB1 ALA 11 1HB ALA 11 14.785 6.646 0.905 54 HB2 ALA 11 2HB ALA 11 15.421 7.151 2.478 55 HB3 ALA 11 3HB ALA 11 16.124 7.807 0.985 56 H MET 12 H MET 12 15.776 5.325 3.688 57 HA MET 12 HA MET 12 14.571 2.652 3.230 58 HB2 MET 12 1HB MET 12 14.898 4.428 5.704 59 HB3 MET 12 2HB MET 12 13.925 2.971 5.668 60 HG2 MET 12 1HG MET 12 16.468 2.287 4.610 61 HG3 MET 12 2HG MET 12 16.739 3.239 6.047 62 HE1 MET 12 3HE MET 12 13.614 0.674 5.451 63 HE2 MET 12 1HE MET 12 15.001 0.024 4.548 64 HE3 MET 12 2HE MET 12 14.413 -0.808 6.001 65 H TYR 13 H TYR 13 12.336 2.459 3.492 66 HA TYR 13 HA TYR 13 10.628 4.561 4.023 67 HB2 TYR 13 1HB TYR 13 9.437 3.993 1.706 68 HB3 TYR 13 2HB TYR 13 10.392 5.411 2.077 69 HD1 TYR 13 2HD TYR 13 12.424 2.336 1.320 70 HD2 TYR 13 1HD TYR 13 10.352 5.729 -0.364 71 HE1 TYR 13 2HE TYR 13 14.139 2.555 -0.378 72 HE2 TYR 13 1HE TYR 13 11.925 5.656 -2.341 73 HH TYR 13 HH TYR 13 14.248 5.244 -2.653 74 H GLU 14 H GLU 14 8.835 3.858 4.834 75 HA GLU 14 HA GLU 14 7.897 1.087 4.480 76 HB2 GLU 14 1HB GLU 14 8.904 1.263 6.742 77 HB3 GLU 14 2HB GLU 14 8.003 2.724 7.064 78 HG2 GLU 14 1HG GLU 14 5.900 1.564 7.112 79 HG3 GLU 14 2HG GLU 14 6.615 0.086 6.471 80 H VAL 15 H VAL 15 5.706 1.089 4.035 81 HA VAL 15 HA VAL 15 4.220 3.640 4.306 82 HB VAL 15 HB VAL 15 4.503 2.973 1.915 83 HG11 VAL 15 1HG1 VAL 15 4.588 0.506 2.153 84 HG12 VAL 15 2HG1 VAL 15 2.908 0.480 2.693 85 HG13 VAL 15 3HG1 VAL 15 3.292 0.991 1.051 86 HG21 VAL 15 3HG2 VAL 15 1.617 2.708 2.828 87 HG22 VAL 15 1HG2 VAL 15 2.498 4.236 2.632 88 HG23 VAL 15 2HG2 VAL 15 2.206 3.197 1.229 89 H THR 16 H THR 16 2.163 3.391 5.333 90 HA THR 16 HA THR 16 1.449 0.634 6.090 91 HB THR 16 HB THR 16 0.451 1.614 8.175 92 HG1 THR 16 1HG THR 16 0.386 3.745 7.748 93 HG21 THR 16 3HG2 THR 16 3.480 1.919 8.006 94 HG22 THR 16 1HG2 THR 16 2.580 0.420 8.313 95 HG23 THR 16 2HG2 THR 16 2.524 1.733 9.493 96 H ILE 17 H ILE 17 -0.775 0.321 6.285 97 HA ILE 17 HA ILE 17 -2.576 2.354 5.212 98 HB ILE 17 HB ILE 17 -2.182 0.762 3.409 99 HG12 ILE 17 1HG1 ILE 17 -4.468 -0.313 3.164 100 HG13 ILE 17 2HG1 ILE 17 -4.791 0.112 4.848 101 HG21 ILE 17 1HG2 ILE 17 -1.325 -1.147 4.684 102 HG22 ILE 17 2HG2 ILE 17 -2.979 -1.519 5.233 103 HG23 ILE 17 3HG2 ILE 17 -2.558 -1.606 3.515 104 HD11 ILE 17 3HD1 ILE 17 -4.379 1.980 2.516 105 HD12 ILE 17 1HD1 ILE 17 -5.863 1.680 3.456 106 HD13 ILE 17 2HD1 ILE 17 -4.493 2.529 4.213 107 H GLU 18 H GLU 18 -4.274 2.634 6.575 108 HA GLU 18 HA GLU 18 -5.055 0.403 8.341 109 HB2 GLU 18 1HB GLU 18 -5.327 3.397 8.743 110 HB3 GLU 18 2HB GLU 18 -6.369 2.239 9.541 111 HG2 GLU 18 1HG GLU 18 -3.848 1.212 10.114 112 HG3 GLU 18 2HG GLU 18 -3.490 2.926 10.023 113 H GLN 19 H GLN 19 -7.142 -0.279 7.950 114 HA GLN 19 HA GLN 19 -8.627 0.942 5.674 115 HB2 GLN 19 1HB GLN 19 -8.434 -2.012 6.447 116 HB3 GLN 19 2HB GLN 19 -9.279 -1.311 5.057 117 HG2 GLN 19 1HG GLN 19 -7.021 -0.479 4.243 118 HG3 GLN 19 2HG GLN 19 -6.269 -1.384 5.576 119 HE21 GLN 19 1HE2 GLN 19 -8.441 -3.563 5.000 120 HE22 GLN 19 2HE2 GLN 19 -7.745 -4.453 3.691 121 H SER 20 H SER 20 -10.567 1.751 6.478 122 HA SER 20 HA SER 20 -11.820 0.349 8.753 123 HB2 SER 20 1HB SER 20 -11.285 3.339 8.775 124 HB3 SER 20 2HB SER 20 -11.919 2.355 10.102 125 HG SER 20 HG SER 20 -9.878 1.335 10.234 126 H GLY 21 H GLY 21 -13.917 1.418 9.300 127 HA2 GLY 21 1HA GLY 21 -16.050 2.261 8.577 128 HA3 GLY 21 2HA GLY 21 -15.473 2.268 6.896 129 H ASP 22 H ASP 22 -15.404 0.284 5.735 130 HA ASP 22 HA ASP 22 -15.462 -2.243 7.189 131 HB2 ASP 22 1HB ASP 22 -17.852 -1.623 6.544 132 HB3 ASP 22 2HB ASP 22 -17.335 -1.682 4.853 133 H PHE 23 H PHE 23 -14.879 -3.979 5.458 134 HA PHE 23 HA PHE 23 -13.896 -3.013 2.898 135 HB2 PHE 23 1HB PHE 23 -11.546 -3.962 3.263 136 HB3 PHE 23 2HB PHE 23 -11.920 -2.423 3.966 137 HD1 PHE 23 1HD PHE 23 -11.378 -6.021 4.815 138 HD2 PHE 23 2HD PHE 23 -12.042 -2.046 6.323 139 HE1 PHE 23 1HE PHE 23 -10.634 -6.739 7.080 140 HE2 PHE 23 2HE PHE 23 -11.235 -2.752 8.561 141 HZ PHE 23 HZ PHE 23 -10.502 -5.094 8.932 142 H ARG 24 H ARG 24 -15.637 -5.222 4.424 143 HA ARG 24 HA ARG 24 -14.490 -7.739 4.027 144 HB2 ARG 24 1HB ARG 24 -17.391 -6.831 4.101 145 HB3 ARG 24 2HB ARG 24 -16.937 -8.520 4.026 146 HG2 ARG 24 1HG ARG 24 -15.933 -8.525 6.127 147 HG3 ARG 24 2HG ARG 24 -15.770 -6.764 6.185 148 HD2 ARG 24 1HD ARG 24 -18.262 -6.553 6.221 149 HD3 ARG 24 2HD ARG 24 -18.385 -8.327 6.295 150 HE ARG 24 HE ARG 24 -16.629 -7.438 8.309 151 HH11 ARG 24 1HH1 ARG 24 -20.067 -6.946 7.561 152 HH12 ARG 24 2HH1 ARG 24 -20.576 -7.022 9.215 153 HH21 ARG 24 1HH2 ARG 24 -17.277 -7.238 10.431 154 HH22 ARG 24 2HH2 ARG 24 -18.945 -7.452 10.910 155 H SER 25 H SER 25 -16.502 -5.837 1.774 156 HA SER 25 HA SER 25 -15.866 -7.799 -0.381 157 HB2 SER 25 1HB SER 25 -18.478 -6.295 -0.232 158 HB3 SER 25 2HB SER 25 -18.045 -7.692 -1.227 159 HG SER 25 HG SER 25 -18.824 -7.483 1.406 160 H PHE 26 H PHE 26 -14.085 -5.941 -0.193 161 HA PHE 26 HA PHE 26 -14.788 -3.742 -2.091 162 HB2 PHE 26 1HB PHE 26 -13.392 -3.590 0.582 163 HB3 PHE 26 2HB PHE 26 -12.975 -2.463 -0.682 164 HD1 PHE 26 2HD PHE 26 -15.791 -3.660 1.406 165 HD2 PHE 26 1HD PHE 26 -14.439 -0.714 -1.431 166 HE1 PHE 26 2HE PHE 26 -17.900 -2.414 1.700 167 HE2 PHE 26 1HE PHE 26 -16.566 0.535 -1.139 168 HZ PHE 26 HZ PHE 26 -18.341 -0.394 0.431 169 H ILE 27 H ILE 27 -13.832 -4.319 -3.859 170 HA ILE 27 HA ILE 27 -11.829 -6.350 -3.962 171 HB ILE 27 HB ILE 27 -12.911 -4.610 -6.215 172 HG12 ILE 27 1HG1 ILE 27 -13.913 -7.369 -5.376 173 HG13 ILE 27 2HG1 ILE 27 -14.692 -5.878 -4.860 174 HG21 ILE 27 1HG2 ILE 27 -12.201 -6.511 -7.648 175 HG22 ILE 27 2HG2 ILE 27 -10.823 -5.847 -6.794 176 HG23 ILE 27 3HG2 ILE 27 -11.565 -7.361 -6.231 177 HD11 ILE 27 3HD1 ILE 27 -15.901 -6.739 -6.697 178 HD12 ILE 27 1HD1 ILE 27 -15.092 -5.255 -7.205 179 HD13 ILE 27 2HD1 ILE 27 -14.460 -6.842 -7.713 180 H LYS 28 H LYS 28 -10.052 -5.598 -2.899 181 HA LYS 28 HA LYS 28 -8.735 -3.087 -3.779 182 HB2 LYS 28 1HB LYS 28 -7.681 -3.231 -1.514 183 HB3 LYS 28 2HB LYS 28 -9.400 -2.923 -1.548 184 HG2 LYS 28 1HG LYS 28 -9.466 -5.630 -1.201 185 HG3 LYS 28 2HG LYS 28 -7.900 -5.287 -0.531 186 HD2 LYS 28 1HD LYS 28 -8.865 -3.750 1.110 187 HD3 LYS 28 2HD LYS 28 -10.457 -3.863 0.353 188 HE2 LYS 28 1HE LYS 28 -8.979 -6.287 1.433 189 HE3 LYS 28 2HE LYS 28 -10.014 -5.293 2.469 190 HZ1 LYS 28 3HZ LYS 28 -11.898 -5.915 1.187 191 HZ2 LYS 28 1HZ LYS 28 -11.052 -7.306 1.402 192 HZ3 LYS 28 2HZ LYS 28 -10.976 -6.575 -0.022 193 H SER 29 H SER 29 -6.892 -3.186 -4.858 194 HA SER 29 HA SER 29 -4.924 -5.312 -4.166 195 HB2 SER 29 1HB SER 29 -5.812 -4.340 -6.896 196 HB3 SER 29 2HB SER 29 -4.145 -4.889 -6.639 197 HG SER 29 HG SER 29 -4.815 -6.827 -6.022 198 H VAL 30 H VAL 30 -2.689 -4.615 -4.527 199 HA VAL 30 HA VAL 30 -2.253 -1.703 -4.511 200 HB VAL 30 HB VAL 30 -1.324 -3.609 -2.320 201 HG11 VAL 30 1HG1 VAL 30 -0.300 -1.559 -1.289 202 HG12 VAL 30 2HG1 VAL 30 0.467 -2.024 -2.804 203 HG13 VAL 30 3HG1 VAL 30 -0.666 -0.662 -2.777 204 HG21 VAL 30 3HG2 VAL 30 -3.659 -2.781 -1.944 205 HG22 VAL 30 1HG2 VAL 30 -2.546 -2.076 -0.774 206 HG23 VAL 30 2HG2 VAL 30 -3.109 -1.118 -2.165 207 H VAL 31 H VAL 31 -0.454 -1.227 -5.612 208 HA VAL 31 HA VAL 31 1.306 -3.317 -6.726 209 HB VAL 31 HB VAL 31 1.313 -0.271 -7.049 210 HG11 VAL 31 1HG1 VAL 31 2.559 -0.713 -9.143 211 HG12 VAL 31 2HG1 VAL 31 3.422 -1.275 -7.710 212 HG13 VAL 31 3HG1 VAL 31 2.587 -2.446 -8.758 213 HG21 VAL 31 3HG2 VAL 31 -0.851 -1.049 -7.874 214 HG22 VAL 31 1HG2 VAL 31 0.179 -0.589 -9.220 215 HG23 VAL 31 2HG2 VAL 31 -0.058 -2.309 -8.843 216 H VAL 32 H VAL 32 3.395 -3.678 -5.769 217 HA VAL 32 HA VAL 32 4.559 -1.437 -4.242 218 HB VAL 32 HB VAL 32 4.564 -4.326 -3.290 219 HG11 VAL 32 1HG1 VAL 32 5.644 -1.880 -1.818 220 HG12 VAL 32 2HG1 VAL 32 5.763 -3.569 -1.346 221 HG13 VAL 32 3HG1 VAL 32 6.685 -2.987 -2.735 222 HG21 VAL 32 3HG2 VAL 32 2.409 -3.260 -2.752 223 HG22 VAL 32 1HG2 VAL 32 3.394 -3.399 -1.290 224 HG23 VAL 32 2HG2 VAL 32 3.250 -1.841 -2.135 225 H VAL 33 H VAL 33 6.580 -1.056 -4.933 226 HA VAL 33 HA VAL 33 8.122 -3.061 -6.448 227 HB VAL 33 HB VAL 33 7.563 -0.209 -7.383 228 HG11 VAL 33 1HG1 VAL 33 9.209 -2.412 -8.704 229 HG12 VAL 33 2HG1 VAL 33 8.878 -0.795 -9.363 230 HG13 VAL 33 3HG1 VAL 33 9.860 -0.970 -7.898 231 HG21 VAL 33 3HG2 VAL 33 6.671 -2.778 -8.733 232 HG22 VAL 33 1HG2 VAL 33 5.617 -1.664 -7.833 233 HG23 VAL 33 2HG2 VAL 33 6.433 -1.092 -9.279 234 H ALA 34 H ALA 34 10.068 -3.064 -5.424 235 HA ALA 34 HA ALA 34 11.172 -0.495 -4.537 236 HB1 ALA 34 1HB ALA 34 10.536 -1.606 -2.472 237 HB2 ALA 34 2HB ALA 34 11.317 -3.112 -2.989 238 HB3 ALA 34 3HB ALA 34 12.292 -1.656 -2.643 239 H ASN 35 H ASN 35 13.423 -0.475 -4.671 240 HA ASN 35 HA ASN 35 14.562 -2.256 -6.786 241 HB2 ASN 35 1HB ASN 35 13.995 0.034 -7.555 242 HB3 ASN 35 2HB ASN 35 14.966 0.710 -6.238 243 HD21 ASN 35 1HD2 ASN 35 15.404 1.310 -9.080 244 HD22 ASN 35 2HD2 ASN 35 17.022 0.654 -9.363 245 H GLY 36 H GLY 36 16.205 -3.499 -5.984 246 HA2 GLY 36 1HA GLY 36 18.442 -3.616 -5.574 247 HA3 GLY 36 2HA GLY 36 18.402 -2.107 -4.663 248 H THR 37 H THR 37 15.970 -3.803 -3.319 249 HA THR 37 HA THR 37 17.542 -5.438 -1.438 250 HB THR 37 HB THR 37 17.531 -3.134 -0.617 251 HG1 THR 37 1HG THR 37 16.611 -3.635 1.427 252 HG21 THR 37 3HG2 THR 37 15.488 -2.067 0.154 253 HG22 THR 37 1HG2 THR 37 14.518 -3.443 -0.432 254 HG23 THR 37 2HG2 THR 37 15.386 -2.404 -1.573 255 H GLN 38 H GLN 38 15.240 -5.913 0.294 256 HA GLN 38 HA GLN 38 13.227 -7.064 -1.566 257 HB2 GLN 38 1HB GLN 38 14.930 -8.495 0.441 258 HB3 GLN 38 2HB GLN 38 13.253 -9.008 0.295 259 HG2 GLN 38 1HG GLN 38 13.514 -9.706 -1.930 260 HG3 GLN 38 2HG GLN 38 14.840 -8.595 -2.234 261 HE21 GLN 38 1HE2 GLN 38 14.067 -11.788 -0.911 262 HE22 GLN 38 2HE2 GLN 38 15.730 -12.320 -0.799 263 H LEU 39 H LEU 39 11.344 -7.893 0.051 264 HA LEU 39 HA LEU 39 10.538 -5.380 1.462 265 HB2 LEU 39 1HB LEU 39 9.340 -6.902 -0.746 266 HB3 LEU 39 2HB LEU 39 8.242 -6.845 0.600 267 HG LEU 39 HG LEU 39 8.106 -5.079 -1.261 268 HD11 LEU 39 1HD1 LEU 39 7.335 -3.344 0.379 269 HD12 LEU 39 2HD1 LEU 39 7.967 -4.371 1.682 270 HD13 LEU 39 3HD1 LEU 39 6.684 -4.963 0.616 271 HD21 LEU 39 3HD2 LEU 39 9.348 -3.143 -1.189 272 HD22 LEU 39 1HD2 LEU 39 10.541 -4.443 -1.100 273 HD23 LEU 39 2HD2 LEU 39 10.079 -3.543 0.383 274 H LYS 40 H LYS 40 8.858 -5.749 3.076 275 HA LYS 40 HA LYS 40 8.999 -8.435 4.383 276 HB2 LYS 40 1HB LYS 40 10.598 -6.908 5.358 277 HB3 LYS 40 2HB LYS 40 9.339 -5.694 5.667 278 HG2 LYS 40 1HG LYS 40 8.211 -7.383 7.177 279 HG3 LYS 40 2HG LYS 40 9.568 -8.491 6.863 280 HD2 LYS 40 1HD LYS 40 11.127 -6.697 7.757 281 HD3 LYS 40 2HD LYS 40 9.685 -5.751 8.204 282 HE2 LYS 40 1HE LYS 40 8.889 -7.741 9.535 283 HE3 LYS 40 2HE LYS 40 10.422 -8.555 9.163 284 HZ1 LYS 40 3HZ LYS 40 10.159 -6.013 10.670 285 HZ2 LYS 40 1HZ LYS 40 11.571 -6.790 10.339 286 HZ3 LYS 40 2HZ LYS 40 10.481 -7.506 11.307 287 H ASP 41 H ASP 41 7.021 -9.213 4.462 288 HA ASP 41 HA ASP 41 4.613 -7.574 4.219 289 HB2 ASP 41 1HB ASP 41 4.814 -10.000 3.445 290 HB3 ASP 41 2HB ASP 41 4.653 -10.458 5.141 291 H GLY 42 H GLY 42 3.560 -6.566 5.890 292 HA2 GLY 42 1HA GLY 42 4.600 -6.481 8.511 293 HA3 GLY 42 2HA GLY 42 3.055 -5.835 7.962 294 H ALA 43 H ALA 43 2.259 -8.733 7.095 295 HA ALA 43 HA ALA 43 0.767 -9.344 9.425 296 HB1 ALA 43 1HB ALA 43 1.538 -11.061 7.026 297 HB2 ALA 43 2HB ALA 43 0.411 -11.580 8.292 298 HB3 ALA 43 3HB ALA 43 0.022 -10.175 7.299 299 H THR 44 H THR 44 3.690 -10.947 8.124 300 HA THR 44 HA THR 44 4.145 -12.309 10.723 301 HB THR 44 HB THR 44 4.836 -14.140 8.881 302 HG1 THR 44 1HG THR 44 2.794 -13.624 7.337 303 HG21 THR 44 3HG2 THR 44 2.600 -15.102 9.061 304 HG22 THR 44 1HG2 THR 44 1.940 -13.548 9.624 305 HG23 THR 44 2HG2 THR 44 3.112 -14.443 10.618 306 H GLY 45 H GLY 45 5.602 -10.228 8.400 307 HA2 GLY 45 1HA GLY 45 7.704 -9.427 8.379 308 HA3 GLY 45 2HA GLY 45 8.258 -10.659 9.529 309 H GLU 46 H GLU 46 6.435 -11.861 6.840 310 HA GLU 46 HA GLU 46 8.424 -13.536 5.789 311 HB2 GLU 46 1HB GLU 46 5.816 -12.418 4.682 312 HB3 GLU 46 2HB GLU 46 6.757 -13.653 3.846 313 HG2 GLU 46 1HG GLU 46 5.875 -14.048 6.732 314 HG3 GLU 46 2HG GLU 46 4.796 -14.408 5.385 315 H SER 47 H SER 47 10.113 -13.131 4.432 316 HA SER 47 HA SER 47 10.488 -10.362 3.617 317 HB2 SER 47 1HB SER 47 12.570 -12.145 2.677 318 HB3 SER 47 2HB SER 47 12.658 -10.766 3.772 319 HG SER 47 HG SER 47 12.316 -13.498 4.256 320 H LEU 48 H LEU 48 9.420 -9.806 1.820 321 HA LEU 48 HA LEU 48 8.676 -11.837 -0.215 322 HB2 LEU 48 1HB LEU 48 7.965 -8.894 -0.194 323 HB3 LEU 48 2HB LEU 48 7.236 -10.170 -1.161 324 HG LEU 48 HG LEU 48 6.970 -9.802 1.848 325 HD11 LEU 48 1HD1 LEU 48 4.590 -9.368 1.262 326 HD12 LEU 48 2HD1 LEU 48 4.985 -9.530 -0.455 327 HD13 LEU 48 3HD1 LEU 48 5.682 -8.198 0.507 328 HD21 LEU 48 3HD2 LEU 48 5.320 -11.678 1.696 329 HD22 LEU 48 1HD2 LEU 48 6.971 -12.201 1.374 330 HD23 LEU 48 2HD2 LEU 48 5.846 -11.975 0.020 331 H ALA 49 H ALA 49 8.931 -11.176 -2.570 332 HA ALA 49 HA ALA 49 11.584 -9.957 -3.095 333 HB1 ALA 49 1HB ALA 49 11.714 -12.384 -3.358 334 HB2 ALA 49 2HB ALA 49 10.284 -12.375 -4.411 335 HB3 ALA 49 3HB ALA 49 11.786 -11.583 -4.935 336 H SER 50 H SER 50 11.212 -8.119 -3.973 337 HA SER 50 HA SER 50 8.690 -7.320 -5.147 338 HB2 SER 50 1HB SER 50 11.353 -5.920 -4.604 339 HB3 SER 50 2HB SER 50 9.887 -5.104 -5.143 340 HG SER 50 HG SER 50 8.851 -5.592 -3.343 341 HA PRO 51 HA PRO 51 8.052 -5.491 -6.587 342 HB2 PRO 51 1HB PRO 51 6.620 -5.387 -8.886 343 HB3 PRO 51 2HB PRO 51 8.165 -4.497 -8.698 344 HG2 PRO 51 1HG PRO 51 7.747 -7.198 -9.993 345 HG3 PRO 51 2HG PRO 51 8.601 -5.778 -10.677 346 HD2 PRO 51 1HD PRO 51 9.928 -7.795 -9.401 347 HD3 PRO 51 2HD PRO 51 10.452 -6.093 -9.269 348 H VAL 52 H VAL 52 5.657 -5.944 -6.270 349 HA VAL 52 HA VAL 52 4.583 -8.405 -7.260 350 HB VAL 52 HB VAL 52 5.934 -8.932 -5.095 351 HG11 VAL 52 1HG1 VAL 52 4.978 -6.965 -3.836 352 HG12 VAL 52 2HG1 VAL 52 3.469 -7.892 -3.686 353 HG13 VAL 52 3HG1 VAL 52 4.959 -8.536 -2.985 354 HG21 VAL 52 3HG2 VAL 52 4.336 -10.479 -6.107 355 HG22 VAL 52 1HG2 VAL 52 4.212 -10.554 -4.342 356 HG23 VAL 52 2HG2 VAL 52 2.977 -9.677 -5.261 357 H ILE 53 H ILE 53 2.334 -8.543 -6.909 358 HA ILE 53 HA ILE 53 1.008 -6.031 -6.104 359 HB ILE 53 HB ILE 53 0.014 -8.099 -8.058 360 HG12 ILE 53 1HG1 ILE 53 1.935 -7.216 -9.151 361 HG13 ILE 53 2HG1 ILE 53 0.493 -6.554 -9.874 362 HG21 ILE 53 1HG2 ILE 53 -1.766 -6.790 -7.030 363 HG22 ILE 53 2HG2 ILE 53 -0.946 -5.273 -7.428 364 HG23 ILE 53 3HG2 ILE 53 -1.598 -6.301 -8.715 365 HD11 ILE 53 3HD1 ILE 53 0.835 -4.405 -8.747 366 HD12 ILE 53 1HD1 ILE 53 2.290 -5.048 -7.951 367 HD13 ILE 53 2HD1 ILE 53 2.262 -4.874 -9.697 368 H LEU 54 H LEU 54 0.068 -6.298 -4.194 369 HA LEU 54 HA LEU 54 -0.837 -8.917 -3.182 370 HB2 LEU 54 1HB LEU 54 -1.428 -6.078 -2.224 371 HB3 LEU 54 2HB LEU 54 -2.068 -7.532 -1.487 372 HG LEU 54 HG LEU 54 0.754 -6.505 -1.450 373 HD11 LEU 54 1HD1 LEU 54 0.461 -6.683 0.967 374 HD12 LEU 54 2HD1 LEU 54 -1.111 -7.469 0.752 375 HD13 LEU 54 3HD1 LEU 54 -0.899 -5.777 0.269 376 HD21 LEU 54 3HD2 LEU 54 1.094 -8.876 -1.943 377 HD22 LEU 54 1HD2 LEU 54 -0.061 -9.329 -0.670 378 HD23 LEU 54 2HD2 LEU 54 1.473 -8.571 -0.247 379 H SER 55 H SER 55 -2.920 -9.616 -3.139 380 HA SER 55 HA SER 55 -4.924 -8.135 -4.755 381 HB2 SER 55 1HB SER 55 -4.987 -11.071 -4.077 382 HB3 SER 55 2HB SER 55 -5.920 -10.217 -5.308 383 HG SER 55 HG SER 55 -3.962 -11.524 -5.878 384 H ASP 56 H ASP 56 -7.154 -8.801 -3.990 385 HA ASP 56 HA ASP 56 -7.777 -7.669 -1.543 386 HB2 ASP 56 1HB ASP 56 -9.335 -7.726 -3.306 387 HB3 ASP 56 2HB ASP 56 -9.165 -9.469 -3.539 388 H GLU 57 H GLU 57 -6.788 -10.916 -2.189 389 HA GLU 57 HA GLU 57 -7.877 -12.286 0.088 390 HB2 GLU 57 1HB GLU 57 -5.748 -12.724 -2.048 391 HB3 GLU 57 2HB GLU 57 -5.757 -13.777 -0.642 392 HG2 GLU 57 1HG GLU 57 -8.162 -13.327 -2.458 393 HG3 GLU 57 2HG GLU 57 -7.066 -14.710 -2.550 394 H GLU 58 H GLU 58 -5.099 -10.204 -0.424 395 HA GLU 58 HA GLU 58 -3.700 -11.164 1.994 396 HB2 GLU 58 1HB GLU 58 -2.901 -9.209 -0.199 397 HB3 GLU 58 2HB GLU 58 -1.843 -9.832 1.064 398 HG2 GLU 58 1HG GLU 58 -3.197 -11.501 -1.122 399 HG3 GLU 58 2HG GLU 58 -1.513 -10.993 -1.115 400 H LEU 59 H LEU 59 -5.602 -8.599 0.774 401 HA LEU 59 HA LEU 59 -4.841 -6.607 2.832 402 HB2 LEU 59 1HB LEU 59 -6.372 -6.567 0.230 403 HB3 LEU 59 2HB LEU 59 -6.339 -5.153 1.291 404 HG LEU 59 HG LEU 59 -3.707 -6.386 0.459 405 HD11 LEU 59 1HD1 LEU 59 -4.984 -6.211 -1.645 406 HD12 LEU 59 2HD1 LEU 59 -3.645 -5.066 -1.587 407 HD13 LEU 59 3HD1 LEU 59 -5.320 -4.507 -1.310 408 HD21 LEU 59 3HD2 LEU 59 -3.961 -4.395 2.092 409 HD22 LEU 59 1HD2 LEU 59 -4.465 -3.448 0.703 410 HD23 LEU 59 2HD2 LEU 59 -2.850 -4.178 0.727 411 H ALA 60 H ALA 60 -6.623 -9.159 3.170 412 HA ALA 60 HA ALA 60 -9.315 -8.270 3.574 413 HB1 ALA 60 1HB ALA 60 -9.649 -10.534 4.409 414 HB2 ALA 60 2HB ALA 60 -8.599 -10.598 2.984 415 HB3 ALA 60 3HB ALA 60 -7.901 -10.758 4.615 416 H VAL 61 H VAL 61 -7.081 -6.913 5.250 417 HA VAL 61 HA VAL 61 -7.959 -7.528 8.028 418 HB VAL 61 HB VAL 61 -5.527 -7.195 8.589 419 HG11 VAL 61 1HG1 VAL 61 -6.471 -9.486 8.343 420 HG12 VAL 61 2HG1 VAL 61 -5.942 -9.496 6.645 421 HG13 VAL 61 3HG1 VAL 61 -4.740 -9.353 7.946 422 HG21 VAL 61 3HG2 VAL 61 -5.027 -7.500 5.596 423 HG22 VAL 61 1HG2 VAL 61 -4.887 -5.977 6.508 424 HG23 VAL 61 2HG2 VAL 61 -3.842 -7.357 6.898 425 H GLU 62 H GLU 62 -7.148 -5.840 9.572 426 HA GLU 62 HA GLU 62 -8.109 -3.232 8.744 427 HB2 GLU 62 1HB GLU 62 -8.026 -2.733 11.040 428 HB3 GLU 62 2HB GLU 62 -8.396 -4.457 10.970 429 HG2 GLU 62 1HG GLU 62 -5.845 -4.822 11.219 430 HG3 GLU 62 2HG GLU 62 -5.767 -3.109 11.640 431 H LYS 63 H LYS 63 -4.973 -4.690 8.804 432 HA LYS 63 HA LYS 63 -3.560 -2.147 8.259 433 HB2 LYS 63 1HB LYS 63 -3.611 -3.557 10.825 434 HB3 LYS 63 2HB LYS 63 -2.000 -3.677 10.182 435 HG2 LYS 63 1HG LYS 63 -3.397 -1.003 10.148 436 HG3 LYS 63 2HG LYS 63 -2.776 -1.601 11.688 437 HD2 LYS 63 1HD LYS 63 -0.825 -1.873 9.546 438 HD3 LYS 63 2HD LYS 63 -1.354 -0.188 9.704 439 HE2 LYS 63 1HE LYS 63 -0.435 -1.752 12.127 440 HE3 LYS 63 2HE LYS 63 0.752 -1.169 10.967 441 HZ1 LYS 63 3HZ LYS 63 -0.055 1.089 11.317 442 HZ2 LYS 63 1HZ LYS 63 0.489 0.395 12.704 443 HZ3 LYS 63 2HZ LYS 63 -1.115 0.567 12.453 444 H VAL 64 H VAL 64 -1.919 -2.393 6.796 445 HA VAL 64 HA VAL 64 -0.671 -5.042 6.539 446 HB VAL 64 HB VAL 64 -1.549 -3.665 3.984 447 HG11 VAL 64 1HG1 VAL 64 0.460 -5.251 4.011 448 HG12 VAL 64 2HG1 VAL 64 -0.633 -6.518 4.529 449 HG13 VAL 64 3HG1 VAL 64 -0.874 -5.742 2.953 450 HG21 VAL 64 3HG2 VAL 64 -3.614 -4.444 5.043 451 HG22 VAL 64 1HG2 VAL 64 -3.154 -5.548 3.733 452 HG23 VAL 64 2HG2 VAL 64 -2.820 -6.011 5.387 453 H THR 65 H THR 65 1.070 -4.038 7.608 454 HA THR 65 HA THR 65 2.327 -1.592 6.665 455 HB THR 65 HB THR 65 3.128 -3.776 8.644 456 HG1 THR 65 1HG THR 65 1.905 -2.769 10.000 457 HG21 THR 65 3HG2 THR 65 5.123 -2.503 8.124 458 HG22 THR 65 1HG2 THR 65 4.533 -2.018 9.720 459 HG23 THR 65 2HG2 THR 65 4.269 -0.967 8.316 460 H LEU 66 H LEU 66 4.007 -1.377 5.129 461 HA LEU 66 HA LEU 66 5.514 -3.840 4.426 462 HB2 LEU 66 1HB LEU 66 4.247 -1.936 2.429 463 HB3 LEU 66 2HB LEU 66 5.627 -2.924 2.053 464 HG LEU 66 HG LEU 66 3.821 -4.025 1.117 465 HD11 LEU 66 1HD1 LEU 66 5.401 -5.549 2.324 466 HD12 LEU 66 2HD1 LEU 66 3.767 -6.209 2.123 467 HD13 LEU 66 3HD1 LEU 66 4.274 -5.550 3.684 468 HD21 LEU 66 3HD2 LEU 66 1.764 -4.613 2.169 469 HD22 LEU 66 1HD2 LEU 66 2.044 -2.887 2.514 470 HD23 LEU 66 2HD2 LEU 66 2.350 -4.103 3.750 471 H SER 67 H SER 67 7.583 -3.525 4.402 472 HA SER 67 HA SER 67 8.777 -0.890 3.926 473 HB2 SER 67 1HB SER 67 8.403 -1.251 6.446 474 HB3 SER 67 2HB SER 67 9.563 -2.578 6.336 475 HG SER 67 HG SER 67 10.140 0.096 5.493 476 H THR 68 H THR 68 11.253 -1.244 3.846 477 HA THR 68 HA THR 68 11.736 -3.630 2.186 478 HB THR 68 HB THR 68 13.902 -2.118 1.823 479 HG1 THR 68 1HG THR 68 11.881 -0.151 2.134 480 HG21 THR 68 3HG2 THR 68 12.270 -2.869 0.100 481 HG22 THR 68 1HG2 THR 68 12.849 -1.247 -0.178 482 HG23 THR 68 2HG2 THR 68 11.230 -1.474 0.502 483 H THR 69 H THR 69 13.617 -4.889 2.507 484 HA THR 69 HA THR 69 14.379 -5.176 5.289 485 HB THR 69 HB THR 69 15.536 -7.201 4.378 486 HG1 THR 69 1HG THR 69 15.552 -7.635 2.309 487 HG21 THR 69 3HG2 THR 69 12.679 -6.946 3.337 488 HG22 THR 69 1HG2 THR 69 13.115 -7.302 5.015 489 HG23 THR 69 2HG2 THR 69 13.542 -8.443 3.731 490 H GLY 70 H GLY 70 15.381 -2.882 3.334 491 HA2 GLY 70 1HA GLY 70 17.608 -2.158 4.779 492 HA3 GLY 70 2HA GLY 70 18.241 -3.006 3.348 493 H LYS 71 H LYS 71 19.065 -0.587 3.034 494 HA LYS 71 HA LYS 71 17.232 1.438 2.179 495 HB2 LYS 71 1HB LYS 71 19.816 1.564 2.623 496 HB3 LYS 71 2HB LYS 71 19.972 0.903 0.990 497 HG2 LYS 71 1HG LYS 71 18.331 3.004 0.456 498 HG3 LYS 71 2HG LYS 71 19.088 3.606 1.926 499 HD2 LYS 71 1HD LYS 71 20.529 4.385 0.293 500 HD3 LYS 71 2HD LYS 71 21.339 2.882 0.727 501 HE2 LYS 71 1HE LYS 71 19.298 3.105 -1.522 502 HE3 LYS 71 2HE LYS 71 21.002 3.415 -1.789 503 HZ1 LYS 71 3HZ LYS 71 21.580 1.228 -1.354 504 HZ2 LYS 71 1HZ LYS 71 20.343 1.134 -2.355 505 HZ3 LYS 71 2HZ LYS 71 20.090 0.786 -0.781 506 H ALA 72 H ALA 72 16.370 1.910 0.153 507 HA ALA 72 HA ALA 72 16.884 0.015 -2.044 508 HB1 ALA 72 1HB ALA 72 14.454 0.027 -0.716 509 HB2 ALA 72 2HB ALA 72 14.161 1.159 -2.052 510 HB3 ALA 72 3HB ALA 72 14.678 -0.477 -2.398 511 H ILE 73 H ILE 73 15.981 1.125 -4.115 512 HA ILE 73 HA ILE 73 16.735 4.010 -4.060 513 HB ILE 73 HB ILE 73 16.762 2.443 -6.594 514 HG12 ILE 73 1HG1 ILE 73 17.924 0.812 -5.253 515 HG13 ILE 73 2HG1 ILE 73 19.004 1.613 -6.343 516 HG21 ILE 73 1HG2 ILE 73 17.261 4.831 -6.584 517 HG22 ILE 73 2HG2 ILE 73 18.569 4.595 -5.430 518 HG23 ILE 73 3HG2 ILE 73 18.692 3.908 -7.073 519 HD11 ILE 73 3HD1 ILE 73 19.946 2.965 -4.505 520 HD12 ILE 73 1HD1 ILE 73 18.823 2.220 -3.364 521 HD13 ILE 73 2HD1 ILE 73 20.022 1.222 -4.143 522 H GLU 74 H GLU 74 13.986 2.029 -4.394 523 HA GLU 74 HA GLU 74 12.464 4.308 -5.233 524 HB2 GLU 74 1HB GLU 74 12.467 1.762 -6.902 525 HB3 GLU 74 2HB GLU 74 11.015 2.756 -6.731 526 HG2 GLU 74 1HG GLU 74 12.444 4.762 -7.370 527 HG3 GLU 74 2HG GLU 74 13.698 3.616 -7.846 528 H PHE 75 H PHE 75 10.290 4.126 -4.493 529 HA PHE 75 HA PHE 75 9.314 1.572 -3.570 530 HB2 PHE 75 1HB PHE 75 10.293 2.841 -1.552 531 HB3 PHE 75 2HB PHE 75 8.950 3.954 -1.717 532 HD1 PHE 75 1HD PHE 75 9.307 0.187 -1.900 533 HD2 PHE 75 2HD PHE 75 7.452 3.526 0.147 534 HE1 PHE 75 1HE PHE 75 8.164 -1.363 -0.379 535 HE2 PHE 75 2HE PHE 75 6.407 1.963 1.683 536 HZ PHE 75 HZ PHE 75 6.710 -0.488 1.444 537 H ALA 76 H ALA 76 7.793 1.520 -5.141 538 HA ALA 76 HA ALA 76 6.041 3.928 -5.532 539 HB1 ALA 76 1HB ALA 76 6.405 1.690 -7.562 540 HB2 ALA 76 2HB ALA 76 5.753 3.324 -7.799 541 HB3 ALA 76 3HB ALA 76 7.494 3.084 -7.531 542 H VAL 77 H VAL 77 4.104 3.769 -4.839 543 HA VAL 77 HA VAL 77 2.847 1.195 -4.369 544 HB VAL 77 HB VAL 77 2.151 2.615 -2.129 545 HG11 VAL 77 1HG1 VAL 77 4.307 0.526 -2.683 546 HG12 VAL 77 2HG1 VAL 77 3.874 1.000 -1.026 547 HG13 VAL 77 3HG1 VAL 77 2.656 0.291 -2.105 548 HG21 VAL 77 3HG2 VAL 77 4.122 3.357 -0.967 549 HG22 VAL 77 1HG2 VAL 77 5.177 2.937 -2.329 550 HG23 VAL 77 2HG2 VAL 77 4.036 4.276 -2.467 551 H SER 78 H SER 78 0.853 1.076 -5.044 552 HA SER 78 HA SER 78 -0.618 3.546 -5.689 553 HB2 SER 78 1HB SER 78 1.062 2.765 -7.556 554 HB3 SER 78 2HB SER 78 -0.089 1.433 -7.780 555 HG SER 78 HG SER 78 -0.558 3.034 -9.167 556 H GLY 79 H GLY 79 -2.868 3.100 -6.000 557 HA2 GLY 79 1HA GLY 79 -4.003 0.661 -6.681 558 HA3 GLY 79 2HA GLY 79 -3.940 0.662 -4.908 559 H GLY 80 H GLY 80 -6.375 0.532 -5.629 560 HA2 GLY 80 1HA GLY 80 -7.476 2.891 -4.518 561 HA3 GLY 80 2HA GLY 80 -8.010 2.654 -6.202 562 H VAL 81 H VAL 81 -10.052 2.327 -4.414 563 HA VAL 81 HA VAL 81 -10.725 -0.331 -5.078 564 HB VAL 81 HB VAL 81 -9.653 -0.871 -2.952 565 HG11 VAL 81 1HG1 VAL 81 -9.782 1.290 -1.778 566 HG12 VAL 81 2HG1 VAL 81 -11.534 1.070 -1.580 567 HG13 VAL 81 3HG1 VAL 81 -10.391 -0.051 -0.803 568 HG21 VAL 81 3HG2 VAL 81 -11.704 -2.031 -3.697 569 HG22 VAL 81 1HG2 VAL 81 -11.320 -2.139 -1.982 570 HG23 VAL 81 2HG2 VAL 81 -12.606 -1.049 -2.531 571 H VAL 82 H VAL 82 -13.043 -0.557 -4.919 572 HA VAL 82 HA VAL 82 -14.614 1.652 -3.884 573 HB VAL 82 HB VAL 82 -16.075 1.230 -6.115 574 HG11 VAL 82 1HG1 VAL 82 -15.415 3.383 -5.219 575 HG12 VAL 82 2HG1 VAL 82 -13.803 3.229 -5.956 576 HG13 VAL 82 3HG1 VAL 82 -15.259 3.334 -6.974 577 HG21 VAL 82 3HG2 VAL 82 -14.274 -0.274 -7.124 578 HG22 VAL 82 1HG2 VAL 82 -14.845 1.057 -8.118 579 HG23 VAL 82 2HG2 VAL 82 -13.273 1.170 -7.293 580 H ASP 83 H ASP 83 -17.023 0.877 -4.134 581 HA ASP 83 HA ASP 83 -17.495 -1.712 -3.026 582 HB2 ASP 83 1HB ASP 83 -18.906 0.725 -3.425 583 HB3 ASP 83 2HB ASP 83 -19.637 -0.370 -4.586 584 H GLY 84 H GLY 84 -17.865 -3.539 -4.252 585 HA2 GLY 84 1HA GLY 84 -17.692 -3.320 -7.249 586 HA3 GLY 84 2HA GLY 84 -17.195 -4.735 -6.315 587 H GLU 85 H GLU 85 -19.827 -3.652 -4.650 588 HA GLU 85 HA GLU 85 -21.538 -5.635 -6.076 589 HB2 GLU 85 1HB GLU 85 -21.528 -4.672 -3.183 590 HB3 GLU 85 2HB GLU 85 -22.805 -5.660 -3.883 591 HG2 GLU 85 1HG GLU 85 -19.870 -6.454 -3.663 592 HG3 GLU 85 2HG GLU 85 -21.130 -6.998 -2.595 593 H ASP 86 H ASP 86 -23.794 -5.058 -6.162 594 HA ASP 86 HA ASP 86 -24.709 -2.365 -5.597 595 HB2 ASP 86 1HB ASP 86 -23.610 -1.937 -7.762 596 HB3 ASP 86 2HB ASP 86 -24.475 -3.293 -8.487 597 H GLY 87 H GLY 87 -25.666 -4.126 -4.262 598 HA2 GLY 87 1HA GLY 87 -28.213 -5.033 -4.833 599 HA3 GLY 87 2HA GLY 87 -27.186 -6.242 -5.599 600 H VAL 88 H VAL 88 -25.195 -5.677 -3.120 601 HA VAL 88 HA VAL 88 -26.878 -6.836 -0.986 602 HB VAL 88 HB VAL 88 -25.535 -8.655 -1.667 603 HG11 VAL 88 1HG1 VAL 88 -23.119 -6.846 -1.358 604 HG12 VAL 88 2HG1 VAL 88 -23.064 -8.609 -1.613 605 HG13 VAL 88 3HG1 VAL 88 -23.741 -7.565 -2.862 606 HG21 VAL 88 3HG2 VAL 88 -24.287 -7.452 0.845 607 HG22 VAL 88 1HG2 VAL 88 -25.844 -8.313 0.781 608 HG23 VAL 88 2HG2 VAL 88 -24.339 -9.161 0.394 609 H VAL 89 H VAL 89 -26.777 -5.805 0.914 610 HA VAL 89 HA VAL 89 -25.749 -3.137 0.973 611 HB VAL 89 HB VAL 89 -27.803 -3.682 2.061 612 HG11 VAL 89 1HG1 VAL 89 -26.383 -5.597 3.936 613 HG12 VAL 89 2HG1 VAL 89 -28.091 -5.115 3.959 614 HG13 VAL 89 3HG1 VAL 89 -27.478 -6.069 2.619 615 HG21 VAL 89 3HG2 VAL 89 -25.747 -3.136 4.231 616 HG22 VAL 89 1HG2 VAL 89 -26.390 -1.930 3.092 617 HG23 VAL 89 2HG2 VAL 89 -27.477 -2.727 4.238 618 H ASN 90 H ASN 90 -23.673 -2.570 1.378 619 HA ASN 90 HA ASN 90 -22.138 -4.006 3.448 620 HB2 ASN 90 1HB ASN 90 -21.304 -3.770 0.550 621 HB3 ASN 90 2HB ASN 90 -20.108 -3.437 1.775 622 HD21 ASN 90 1HD2 ASN 90 -22.689 -6.007 1.730 623 HD22 ASN 90 2HD2 ASN 90 -21.541 -7.325 1.857 624 H GLU 91 H GLU 91 -20.904 -2.514 4.617 625 HA GLU 91 HA GLU 91 -21.730 0.268 4.303 626 HB2 GLU 91 1HB GLU 91 -20.086 -1.287 6.313 627 HB3 GLU 91 2HB GLU 91 -19.834 0.451 6.189 628 HG2 GLU 91 1HG GLU 91 -22.602 0.312 6.278 629 HG3 GLU 91 2HG GLU 91 -22.133 -1.043 7.299 630 HA PRO 92 HA PRO 92 -18.141 1.390 1.975 631 HB2 PRO 92 1HB PRO 92 -18.160 4.083 2.134 632 HB3 PRO 92 2HB PRO 92 -19.558 3.204 1.440 633 HG2 PRO 92 1HG PRO 92 -19.260 4.224 4.278 634 HG3 PRO 92 2HG PRO 92 -20.623 4.500 3.147 635 HD2 PRO 92 1HD PRO 92 -20.602 2.488 5.026 636 HD3 PRO 92 2HD PRO 92 -21.416 2.315 3.440 637 H MET 93 H MET 93 -16.134 3.339 2.281 638 HA MET 93 HA MET 93 -14.839 2.450 4.753 639 HB2 MET 93 1HB MET 93 -13.294 1.089 3.723 640 HB3 MET 93 2HB MET 93 -14.832 0.581 3.027 641 HG2 MET 93 1HG MET 93 -14.323 1.735 0.938 642 HG3 MET 93 2HG MET 93 -12.835 2.397 1.622 643 HE1 MET 93 3HE MET 93 -10.529 -0.732 2.047 644 HE2 MET 93 1HE MET 93 -10.784 0.994 2.411 645 HE3 MET 93 2HE MET 93 -11.675 -0.253 3.311 646 H GLN 94 H GLN 94 -12.452 2.933 4.614 647 HA GLN 94 HA GLN 94 -11.667 5.219 2.942 648 HB2 GLN 94 1HB GLN 94 -11.419 5.137 5.991 649 HB3 GLN 94 2HB GLN 94 -10.593 6.298 4.948 650 HG2 GLN 94 1HG GLN 94 -12.757 7.195 4.182 651 HG3 GLN 94 2HG GLN 94 -13.614 5.996 5.155 652 HE21 GLN 94 1HE2 GLN 94 -14.635 7.217 6.686 653 HE22 GLN 94 2HE2 GLN 94 -13.812 8.219 7.864 654 H TRP 95 H TRP 95 -9.397 5.320 2.753 655 HA TRP 95 HA TRP 95 -7.722 3.172 3.996 656 HB2 TRP 95 1HB TRP 95 -7.545 4.568 1.285 657 HB3 TRP 95 2HB TRP 95 -6.137 3.884 2.060 658 HD1 TRP 95 HD TRP 95 -8.543 1.346 2.820 659 HE1 TRP 95 1HE TRP 95 -8.361 -0.606 1.116 660 HE3 TRP 95 3HE TRP 95 -5.787 3.605 -0.860 661 HZ2 TRP 95 2HZ TRP 95 -7.391 -1.042 -1.526 662 HZ3 TRP 95 3HZ TRP 95 -5.179 2.346 -2.916 663 HH2 TRP 95 HH TRP 95 -5.968 0.011 -3.238 664 H VAL 96 H VAL 96 -6.497 4.184 5.649 665 HA VAL 96 HA VAL 96 -5.517 6.904 4.932 666 HB VAL 96 HB VAL 96 -7.057 7.259 6.650 667 HG11 VAL 96 1HG1 VAL 96 -6.969 4.983 7.777 668 HG12 VAL 96 2HG1 VAL 96 -5.461 5.538 8.562 669 HG13 VAL 96 3HG1 VAL 96 -6.990 6.380 8.850 670 HG21 VAL 96 3HG2 VAL 96 -5.632 8.537 8.104 671 HG22 VAL 96 1HG2 VAL 96 -4.244 7.474 7.789 672 HG23 VAL 96 2HG2 VAL 96 -4.867 8.524 6.512 673 H VAL 97 H VAL 97 -3.569 6.758 4.194 674 HA VAL 97 HA VAL 97 -1.878 4.539 5.115 675 HB VAL 97 HB VAL 97 -0.679 4.897 3.001 676 HG11 VAL 97 1HG1 VAL 97 -2.307 3.160 3.084 677 HG12 VAL 97 2HG1 VAL 97 -3.625 4.285 2.672 678 HG13 VAL 97 3HG1 VAL 97 -2.350 3.909 1.495 679 HG21 VAL 97 3HG2 VAL 97 -1.170 7.223 2.522 680 HG22 VAL 97 1HG2 VAL 97 -1.673 6.207 1.165 681 HG23 VAL 97 2HG2 VAL 97 -2.885 6.858 2.295 682 H THR 98 H THR 98 0.505 5.210 5.019 683 HA THR 98 HA THR 98 1.033 7.996 5.631 684 HB THR 98 HB THR 98 1.531 5.882 7.765 685 HG1 THR 98 1HG THR 98 -0.745 7.342 7.218 686 HG21 THR 98 3HG2 THR 98 2.910 7.867 7.974 687 HG22 THR 98 1HG2 THR 98 1.682 7.840 9.263 688 HG23 THR 98 2HG2 THR 98 1.482 8.918 7.892 689 H VAL 99 H VAL 99 3.303 8.356 5.423 690 HA VAL 99 HA VAL 99 4.905 5.951 4.613 691 HB VAL 99 HB VAL 99 5.151 8.708 3.396 692 HG11 VAL 99 1HG1 VAL 99 6.608 7.552 1.762 693 HG12 VAL 99 2HG1 VAL 99 7.271 7.453 3.393 694 HG13 VAL 99 3HG1 VAL 99 6.455 6.042 2.689 695 HG21 VAL 99 3HG2 VAL 99 4.215 7.627 1.356 696 HG22 VAL 99 1HG2 VAL 99 3.914 6.145 2.283 697 HG23 VAL 99 2HG2 VAL 99 3.035 7.646 2.654 698 H TYR 100 H TYR 100 6.749 5.659 5.634 699 HA TYR 100 HA TYR 100 7.798 7.762 7.443 700 HB2 TYR 100 1HB TYR 100 7.735 4.751 7.825 701 HB3 TYR 100 2HB TYR 100 8.578 5.891 8.858 702 HD1 TYR 100 2HD TYR 100 5.227 4.686 7.762 703 HD2 TYR 100 1HD TYR 100 7.394 7.235 10.489 704 HE1 TYR 100 2HE TYR 100 3.143 5.071 9.058 705 HE2 TYR 100 1HE TYR 100 5.272 7.617 11.781 706 HH TYR 100 HH TYR 100 2.846 7.702 11.172 707 H LYS 101 H LYS 101 9.719 8.412 6.800 708 HA LYS 101 HA LYS 101 11.338 7.048 4.773 709 HB2 LYS 101 1HB LYS 101 10.764 9.663 5.171 710 HB3 LYS 101 2HB LYS 101 12.069 9.551 6.331 711 HG2 LYS 101 1HG LYS 101 13.281 10.189 4.503 712 HG3 LYS 101 2HG LYS 101 13.311 8.440 4.212 713 HD2 LYS 101 1HD LYS 101 11.540 8.612 2.570 714 HD3 LYS 101 2HD LYS 101 11.261 10.323 3.002 715 HE2 LYS 101 1HE LYS 101 13.549 10.901 2.240 716 HE3 LYS 101 2HE LYS 101 13.808 9.210 1.778 717 HZ1 LYS 101 3HZ LYS 101 13.231 10.423 -0.136 718 HZ2 LYS 101 1HZ LYS 101 11.871 11.063 0.497 719 HZ3 LYS 101 2HZ LYS 101 12.042 9.415 0.182 720 H ASN 102 H ASN 102 13.852 7.716 5.813 721 HA ASN 102 HA ASN 102 14.590 5.650 7.610 722 HB2 ASN 102 1HB ASN 102 16.461 7.993 7.364 723 HB3 ASN 102 2HB ASN 102 16.751 6.285 7.382 724 HD21 ASN 102 1HD2 ASN 102 15.441 8.951 5.316 725 HD22 ASN 102 2HD2 ASN 102 16.087 8.282 3.831 726 H GLY 103 H GLY 103 12.980 6.153 9.263 727 HA2 GLY 103 1HA GLY 103 12.699 6.547 11.559 728 HA3 GLY 103 2HA GLY 103 14.250 7.386 11.579 729 H LYS 104 H LYS 104 11.383 8.248 9.570 730 HA LYS 104 HA LYS 104 10.293 9.936 11.542 731 HB2 LYS 104 1HB LYS 104 12.190 11.251 9.781 732 HB3 LYS 104 2HB LYS 104 10.575 11.770 9.296 733 HG2 LYS 104 1HG LYS 104 11.606 11.859 12.159 734 HG3 LYS 104 2HG LYS 104 11.637 13.233 11.028 735 HD2 LYS 104 1HD LYS 104 9.161 13.022 10.762 736 HD3 LYS 104 2HD LYS 104 9.168 11.749 11.994 737 HE2 LYS 104 1HE LYS 104 9.971 13.290 13.689 738 HE3 LYS 104 2HE LYS 104 10.054 14.595 12.478 739 HZ1 LYS 104 3HZ LYS 104 7.955 14.530 13.837 740 HZ2 LYS 104 1HZ LYS 104 7.578 13.124 13.127 741 HZ3 LYS 104 2HZ LYS 104 7.740 14.485 12.193 742 H GLU 105 H GLU 105 8.164 10.728 10.848 743 HA GLU 105 HA GLU 105 6.868 9.252 8.637 744 HB2 GLU 105 1HB GLU 105 5.868 9.695 11.008 745 HB3 GLU 105 2HB GLU 105 5.699 11.369 10.480 746 HG2 GLU 105 1HG GLU 105 4.364 10.520 8.493 747 HG3 GLU 105 2HG GLU 105 4.487 8.901 9.168 748 H ILE 106 H ILE 106 6.351 10.333 6.695 749 HA ILE 106 HA ILE 106 6.990 13.246 6.541 750 HB ILE 106 HB ILE 106 7.889 12.830 4.308 751 HG12 ILE 106 1HG1 ILE 106 8.325 9.896 4.798 752 HG13 ILE 106 2HG1 ILE 106 6.706 10.361 4.302 753 HG21 ILE 106 1HG2 ILE 106 9.397 11.283 6.455 754 HG22 ILE 106 2HG2 ILE 106 10.079 12.042 4.995 755 HG23 ILE 106 3HG2 ILE 106 9.363 13.044 6.268 756 HD11 ILE 106 3HD1 ILE 106 7.490 11.439 2.307 757 HD12 ILE 106 1HD1 ILE 106 9.185 11.182 2.769 758 HD13 ILE 106 2HD1 ILE 106 8.144 9.790 2.380 759 H GLU 107 H GLU 107 4.579 10.781 5.881 760 HA GLU 107 HA GLU 107 3.007 12.749 4.375 761 HB2 GLU 107 1HB GLU 107 4.538 11.217 2.815 762 HB3 GLU 107 2HB GLU 107 3.344 9.978 3.196 763 HG2 GLU 107 1HG GLU 107 2.870 12.643 1.844 764 HG3 GLU 107 2HG GLU 107 2.774 11.011 1.122 765 H LYS 108 H LYS 108 0.711 12.240 4.615 766 HA LYS 108 HA LYS 108 0.041 9.882 6.106 767 HB2 LYS 108 1HB LYS 108 0.923 11.754 7.686 768 HB3 LYS 108 2HB LYS 108 -0.561 12.624 7.312 769 HG2 LYS 108 1HG LYS 108 -1.882 10.784 8.371 770 HG3 LYS 108 2HG LYS 108 -0.374 9.887 8.618 771 HD2 LYS 108 1HD LYS 108 0.431 12.019 9.892 772 HD3 LYS 108 2HD LYS 108 -1.267 12.461 9.968 773 HE2 LYS 108 1HE LYS 108 -0.539 9.648 10.765 774 HE3 LYS 108 2HE LYS 108 0.099 10.926 11.795 775 HZ1 LYS 108 3HZ LYS 108 -2.118 11.715 12.169 776 HZ2 LYS 108 1HZ LYS 108 -2.027 10.131 12.566 777 HZ3 LYS 108 2HZ LYS 108 -2.766 10.556 11.169 778 H LYS 109 H LYS 109 -0.799 10.510 3.526 779 HA LYS 109 HA LYS 109 -3.288 12.014 3.620 780 HB2 LYS 109 1HB LYS 109 -3.528 11.558 1.251 781 HB3 LYS 109 2HB LYS 109 -1.903 12.079 1.633 782 HG2 LYS 109 1HG LYS 109 -1.138 10.337 0.465 783 HG3 LYS 109 2HG LYS 109 -1.659 9.322 1.793 784 HD2 LYS 109 1HD LYS 109 -2.844 8.197 0.295 785 HD3 LYS 109 2HD LYS 109 -4.002 9.521 0.318 786 HE2 LYS 109 1HE LYS 109 -1.631 9.143 -1.589 787 HE3 LYS 109 2HE LYS 109 -3.334 8.835 -1.970 788 HZ1 LYS 109 3HZ LYS 109 -3.709 11.248 -1.531 789 HZ2 LYS 109 1HZ LYS 109 -2.829 10.898 -2.843 790 HZ3 LYS 109 2HZ LYS 109 -2.064 11.453 -1.512 791 H SER 110 H SER 110 -5.474 11.345 3.365 792 HA SER 110 HA SER 110 -6.090 8.534 3.776 793 HB2 SER 110 1HB SER 110 -8.055 9.628 4.890 794 HB3 SER 110 2HB SER 110 -6.524 9.793 5.758 795 HG SER 110 HG SER 110 -8.117 11.660 4.405 796 H LEU 111 H LEU 111 -8.041 7.853 2.715 797 HA LEU 111 HA LEU 111 -8.993 9.544 0.465 798 HB2 LEU 111 1HB LEU 111 -8.657 6.562 0.251 799 HB3 LEU 111 2HB LEU 111 -8.949 7.759 -1.015 800 HG LEU 111 HG LEU 111 -6.314 7.376 0.408 801 HD11 LEU 111 1HD1 LEU 111 -6.994 5.441 -0.967 802 HD12 LEU 111 2HD1 LEU 111 -5.668 6.314 -1.767 803 HD13 LEU 111 3HD1 LEU 111 -7.338 6.502 -2.326 804 HD21 LEU 111 3HD2 LEU 111 -5.440 8.712 -1.536 805 HD22 LEU 111 1HD2 LEU 111 -6.481 9.654 -0.457 806 HD23 LEU 111 2HD2 LEU 111 -7.102 9.064 -1.999 807 H VAL 112 H VAL 112 -11.103 8.412 -0.449 808 HA VAL 112 HA VAL 112 -12.681 6.997 1.564 809 HB VAL 112 HB VAL 112 -13.729 9.587 0.325 810 HG11 VAL 112 1HG1 VAL 112 -14.694 7.863 2.638 811 HG12 VAL 112 2HG1 VAL 112 -15.418 9.417 2.160 812 HG13 VAL 112 3HG1 VAL 112 -15.471 8.046 1.054 813 HG21 VAL 112 3HG2 VAL 112 -12.520 9.322 3.095 814 HG22 VAL 112 1HG2 VAL 112 -11.922 10.335 1.771 815 HG23 VAL 112 2HG2 VAL 112 -13.473 10.712 2.511 816 H PHE 113 H PHE 113 -14.343 5.750 0.505 817 HA PHE 113 HA PHE 113 -15.392 6.816 -1.960 818 HB2 PHE 113 1HB PHE 113 -14.201 4.039 -1.843 819 HB3 PHE 113 2HB PHE 113 -15.705 4.278 -2.705 820 HD1 PHE 113 2HD PHE 113 -15.827 6.079 -4.556 821 HD2 PHE 113 1HD PHE 113 -12.148 4.612 -2.902 822 HE1 PHE 113 2HE PHE 113 -14.582 6.994 -6.508 823 HE2 PHE 113 1HE PHE 113 -10.889 5.634 -4.781 824 HZ PHE 113 HZ PHE 113 -12.101 6.834 -6.576 825 H ARG 114 H ARG 114 -17.621 6.420 -2.065 826 HA ARG 114 HA ARG 114 -18.817 4.644 -0.071 827 HB2 ARG 114 1HB ARG 114 -19.623 7.580 -0.323 828 HB3 ARG 114 2HB ARG 114 -20.522 6.324 0.548 829 HG2 ARG 114 1HG ARG 114 -18.827 6.125 2.220 830 HG3 ARG 114 2HG ARG 114 -17.686 7.061 1.253 831 HD2 ARG 114 1HD ARG 114 -19.164 9.051 1.515 832 HD3 ARG 114 2HD ARG 114 -20.270 8.087 2.492 833 HE ARG 114 HE ARG 114 -18.296 7.678 4.020 834 HH11 ARG 114 1HH1 ARG 114 -18.301 10.678 2.084 835 HH12 ARG 114 2HH1 ARG 114 -17.616 11.631 3.356 836 HH21 ARG 114 1HH2 ARG 114 -17.019 8.903 5.438 837 HH22 ARG 114 2HH2 ARG 114 -16.836 10.617 5.251 838 H ASP 115 H ASP 115 -19.565 3.389 -1.510 839 HA ASP 115 HA ASP 115 -20.839 2.482 -3.266 840 HB2 ASP 115 1HB ASP 115 -22.441 3.895 -1.766 841 HB3 ASP 115 2HB ASP 115 -22.466 5.052 -3.093 842 H GLY 116 H GLY 116 -21.957 3.151 -5.438 843 HA2 GLY 116 1HA GLY 116 -22.109 5.018 -6.990 844 HA3 GLY 116 2HA GLY 116 -20.321 5.104 -7.027 845 H LYS 117 H LYS 117 -19.435 2.700 -7.494 846 HA LYS 117 HA LYS 117 -20.767 0.644 -8.441 847 HB2 LYS 117 1HB LYS 117 -20.487 2.734 -10.550 848 HB3 LYS 117 2HB LYS 117 -19.730 1.237 -10.980 849 HG2 LYS 117 1HG LYS 117 -22.540 1.335 -9.810 850 HG3 LYS 117 2HG LYS 117 -22.272 1.568 -11.536 851 HD2 LYS 117 1HD LYS 117 -21.172 -0.900 -10.141 852 HD3 LYS 117 2HD LYS 117 -22.844 -0.861 -10.653 853 HE2 LYS 117 1HE LYS 117 -20.685 -0.107 -12.638 854 HE3 LYS 117 2HE LYS 117 -20.947 -1.809 -12.244 855 HZ1 LYS 117 3HZ LYS 117 -22.263 -1.133 -14.149 856 HZ2 LYS 117 1HZ LYS 117 -23.109 -0.055 -13.217 857 HZ3 LYS 117 2HZ LYS 117 -23.208 -1.651 -12.940 858 H GLU 118 H GLU 118 -19.251 -0.827 -9.612 859 HA GLU 118 HA GLU 118 -16.498 -0.844 -8.854 860 HB2 GLU 118 1HB GLU 118 -16.409 -2.523 -10.806 861 HB3 GLU 118 2HB GLU 118 -17.454 -2.968 -9.461 862 HG2 GLU 118 1HG GLU 118 -19.366 -2.763 -10.616 863 HG3 GLU 118 2HG GLU 118 -18.866 -1.375 -11.534 864 H ILE 119 H ILE 119 -14.741 -0.261 -9.992 865 HA ILE 119 HA ILE 119 -14.522 0.552 -12.631 866 HB ILE 119 HB ILE 119 -13.651 2.900 -12.069 867 HG12 ILE 119 1HG1 ILE 119 -15.237 4.040 -10.370 868 HG13 ILE 119 2HG1 ILE 119 -15.468 2.473 -9.683 869 HG21 ILE 119 1HG2 ILE 119 -15.716 2.269 -13.462 870 HG22 ILE 119 2HG2 ILE 119 -16.637 2.867 -12.067 871 HG23 ILE 119 3HG2 ILE 119 -15.480 3.923 -12.884 872 HD11 ILE 119 3HD1 ILE 119 -12.843 3.914 -10.022 873 HD12 ILE 119 1HD1 ILE 119 -13.678 3.674 -8.497 874 HD13 ILE 119 2HD1 ILE 119 -12.988 2.276 -9.358 875 H SER 120 H SER 120 -12.176 1.812 -12.435 876 HA SER 120 HA SER 120 -10.596 0.668 -10.250 877 HB2 SER 120 1HB SER 120 -8.542 0.752 -11.684 878 HB3 SER 120 2HB SER 120 -9.656 -0.575 -12.048 879 HG SER 120 HG SER 120 -10.232 0.341 -13.886 880 H THR 121 H THR 121 -8.936 2.233 -9.574 881 HA THR 121 HA THR 121 -9.155 4.961 -10.503 882 HB THR 121 HB THR 121 -11.167 4.747 -9.112 883 HG1 THR 121 1HG THR 121 -10.847 6.652 -8.548 884 HG21 THR 121 3HG2 THR 121 -9.448 4.287 -6.669 885 HG22 THR 121 1HG2 THR 121 -10.249 2.945 -7.525 886 HG23 THR 121 2HG2 THR 121 -11.217 4.232 -6.822 887 H ASP 122 H ASP 122 -7.454 6.230 -9.545 888 HA ASP 122 HA ASP 122 -5.159 4.505 -8.724 889 HB2 ASP 122 1HB ASP 122 -5.523 5.554 -11.144 890 HB3 ASP 122 2HB ASP 122 -4.906 7.004 -10.376 891 H ASP 123 H ASP 123 -7.069 5.773 -7.097 892 HA ASP 123 HA ASP 123 -6.631 8.368 -6.210 893 HB2 ASP 123 1HB ASP 123 -8.583 6.672 -5.896 894 HB3 ASP 123 2HB ASP 123 -7.685 6.083 -4.511 895 H LEU 124 H LEU 124 -5.131 5.345 -5.154 896 HA LEU 124 HA LEU 124 -3.311 6.777 -3.296 897 HB2 LEU 124 1HB LEU 124 -4.373 4.404 -2.819 898 HB3 LEU 124 2HB LEU 124 -3.197 3.881 -3.985 899 HG LEU 124 HG LEU 124 -2.356 5.433 -1.527 900 HD11 LEU 124 1HD1 LEU 124 -1.755 3.233 -0.546 901 HD12 LEU 124 2HD1 LEU 124 -2.546 2.402 -1.916 902 HD13 LEU 124 3HD1 LEU 124 -3.492 3.383 -0.780 903 HD21 LEU 124 3HD2 LEU 124 -0.633 5.291 -3.321 904 HD22 LEU 124 1HD2 LEU 124 -0.854 3.535 -3.384 905 HD23 LEU 124 2HD2 LEU 124 -0.176 4.293 -1.946 906 H ASN 125 H ASN 125 -1.746 7.692 -4.441 907 HA ASN 125 HA ASN 125 -0.153 6.151 -6.252 908 HB2 ASN 125 1HB ASN 125 0.149 8.006 -7.672 909 HB3 ASN 125 2HB ASN 125 -1.540 7.527 -7.756 910 HD21 ASN 125 1HD2 ASN 125 0.623 10.172 -7.454 911 HD22 ASN 125 2HD2 ASN 125 -0.543 11.354 -6.905 912 H LEU 126 H LEU 126 1.667 6.037 -5.071 913 HA LEU 126 HA LEU 126 2.729 8.380 -3.614 914 HB2 LEU 126 1HB LEU 126 2.283 5.557 -2.559 915 HB3 LEU 126 2HB LEU 126 3.395 6.708 -1.820 916 HG LEU 126 HG LEU 126 0.361 6.953 -1.985 917 HD11 LEU 126 1HD1 LEU 126 0.520 6.623 0.473 918 HD12 LEU 126 2HD1 LEU 126 2.273 6.438 0.332 919 HD13 LEU 126 3HD1 LEU 126 1.208 5.238 -0.404 920 HD21 LEU 126 3HD2 LEU 126 2.362 8.800 -0.618 921 HD22 LEU 126 1HD2 LEU 126 0.588 8.879 -0.478 922 HD23 LEU 126 2HD2 LEU 126 1.361 9.180 -2.040 923 H TYR 127 H TYR 127 4.689 8.651 -4.573 924 HA TYR 127 HA TYR 127 6.286 6.235 -5.232 925 HB2 TYR 127 1HB TYR 127 5.331 6.812 -7.338 926 HB3 TYR 127 2HB TYR 127 5.611 8.530 -7.092 927 HD1 TYR 127 1HD TYR 127 7.313 5.274 -7.652 928 HD2 TYR 127 2HD TYR 127 7.703 9.549 -7.637 929 HE1 TYR 127 1HE TYR 127 9.558 5.066 -8.708 930 HE2 TYR 127 2HE TYR 127 9.921 9.366 -8.684 931 HH TYR 127 HH TYR 127 11.102 7.860 -10.096 932 H TYR 128 H TYR 128 8.271 6.380 -4.462 933 HA TYR 128 HA TYR 128 9.544 8.976 -3.953 934 HB2 TYR 128 1HB TYR 128 9.118 6.782 -1.884 935 HB3 TYR 128 2HB TYR 128 10.259 8.107 -1.685 936 HD1 TYR 128 1HD TYR 128 9.369 10.524 -1.721 937 HD2 TYR 128 2HD TYR 128 6.811 7.069 -1.313 938 HE1 TYR 128 1HE TYR 128 7.576 11.967 -0.822 939 HE2 TYR 128 2HE TYR 128 5.002 8.521 -0.422 940 HH TYR 128 HH TYR 128 5.389 12.058 -0.032 941 H ASN 129 H ASN 129 11.904 8.590 -3.474 942 HA ASN 129 HA ASN 129 13.017 6.112 -4.578 943 HB2 ASN 129 1HB ASN 129 14.119 7.126 -6.368 944 HB3 ASN 129 2HB ASN 129 12.433 7.596 -6.521 945 HD21 ASN 129 1HD2 ASN 129 14.671 8.841 -7.679 946 HD22 ASN 129 2HD2 ASN 129 14.814 10.505 -7.120 Start of MODEL 4 1 H1 GLY 1 H GLY 1 37.634 2.921 11.687 2 HA2 GLY 1 1HA GLY 1 35.144 1.353 11.319 3 HA3 GLY 1 2HA GLY 1 36.574 0.787 12.226 4 H ASP 2 H ASP 2 33.542 1.859 12.705 5 HA ASP 2 HA ASP 2 32.397 3.647 13.232 6 HB2 ASP 2 1HB ASP 2 33.772 4.115 15.340 7 HB3 ASP 2 2HB ASP 2 34.831 5.085 14.336 8 H ASP 3 H ASP 3 32.046 3.813 11.086 9 HA ASP 3 HA ASP 3 33.861 5.036 9.161 10 HB2 ASP 3 1HB ASP 3 33.164 2.072 9.171 11 HB3 ASP 3 2HB ASP 3 33.440 2.946 7.665 12 H ASP 4 H ASP 4 32.097 6.434 8.399 13 HA ASP 4 HA ASP 4 30.011 5.033 7.001 14 HB2 ASP 4 1HB ASP 4 29.343 6.466 9.555 15 HB3 ASP 4 2HB ASP 4 28.314 6.800 8.172 16 H GLU 5 H GLU 5 29.804 6.081 5.140 17 HA GLU 5 HA GLU 5 29.887 8.963 4.879 18 HB2 GLU 5 1HB GLU 5 32.256 8.547 4.757 19 HB3 GLU 5 2HB GLU 5 32.007 7.208 3.625 20 HG2 GLU 5 1HG GLU 5 32.868 9.206 2.507 21 HG3 GLU 5 2HG GLU 5 31.333 8.721 1.838 22 HA PRO 6 HA PRO 6 27.028 6.656 2.097 23 HB2 PRO 6 1HB PRO 6 24.722 7.939 2.616 24 HB3 PRO 6 2HB PRO 6 25.432 6.829 3.839 25 HG2 PRO 6 1HG PRO 6 25.760 9.856 3.677 26 HG3 PRO 6 2HG PRO 6 25.196 8.888 5.064 27 HD2 PRO 6 1HD PRO 6 27.820 9.650 4.741 28 HD3 PRO 6 2HD PRO 6 27.374 8.091 5.517 29 H GLY 7 H GLY 7 25.566 7.632 0.293 30 HA2 GLY 7 1HA GLY 7 25.766 10.474 -0.176 31 HA3 GLY 7 2HA GLY 7 26.540 9.491 -1.437 32 H GLY 8 H GLY 8 25.110 9.339 -3.102 33 HA2 GLY 8 1HA GLY 8 22.243 9.033 -2.531 34 HA3 GLY 8 2HA GLY 8 22.996 9.644 -4.025 35 H LYS 9 H LYS 9 24.049 6.614 -2.413 36 HA LYS 9 HA LYS 9 22.602 5.137 -4.537 37 HB2 LYS 9 1HB LYS 9 24.163 3.410 -4.371 38 HB3 LYS 9 2HB LYS 9 24.874 4.894 -4.984 39 HG2 LYS 9 1HG LYS 9 25.990 5.218 -2.761 40 HG3 LYS 9 2HG LYS 9 25.363 3.635 -2.251 41 HD2 LYS 9 1HD LYS 9 26.538 2.673 -4.349 42 HD3 LYS 9 2HD LYS 9 27.308 4.258 -4.476 43 HE2 LYS 9 1HE LYS 9 28.892 3.106 -3.243 44 HE3 LYS 9 2HE LYS 9 27.964 3.915 -1.977 45 HZ1 LYS 9 3HZ LYS 9 27.792 1.075 -2.815 46 HZ2 LYS 9 1HZ LYS 9 26.676 1.764 -1.824 47 HZ3 LYS 9 2HZ LYS 9 28.218 1.672 -1.333 48 H GLY 10 H GLY 10 20.768 4.987 -3.482 49 HA2 GLY 10 1HA GLY 10 19.684 2.973 -3.013 50 HA3 GLY 10 2HA GLY 10 20.782 2.643 -1.659 51 H ALA 11 H ALA 11 17.734 3.058 -2.324 52 HA ALA 11 HA ALA 11 17.230 3.970 0.438 53 HB1 ALA 11 1HB ALA 11 15.009 4.767 -0.298 54 HB2 ALA 11 2HB ALA 11 16.305 5.677 -1.115 55 HB3 ALA 11 3HB ALA 11 15.420 4.397 -1.979 56 H MET 12 H MET 12 16.751 2.199 1.514 57 HA MET 12 HA MET 12 14.859 0.181 0.441 58 HB2 MET 12 1HB MET 12 15.675 0.747 3.351 59 HB3 MET 12 2HB MET 12 14.691 -0.606 2.743 60 HG2 MET 12 1HG MET 12 16.611 -1.010 1.159 61 HG3 MET 12 2HG MET 12 17.559 -0.002 2.191 62 HE1 MET 12 3HE MET 12 14.887 -2.811 3.484 63 HE2 MET 12 1HE MET 12 15.418 -3.068 1.812 64 HE3 MET 12 2HE MET 12 15.940 -4.199 3.079 65 H TYR 13 H TYR 13 12.884 0.035 1.890 66 HA TYR 13 HA TYR 13 11.624 2.394 2.855 67 HB2 TYR 13 1HB TYR 13 9.906 2.337 0.953 68 HB3 TYR 13 2HB TYR 13 11.432 3.141 0.645 69 HD1 TYR 13 1HD TYR 13 9.960 -0.306 0.344 70 HD2 TYR 13 2HD TYR 13 12.315 2.808 -1.511 71 HE1 TYR 13 1HE TYR 13 9.997 -1.585 -1.755 72 HE2 TYR 13 2HE TYR 13 12.425 1.479 -3.597 73 HH TYR 13 HH TYR 13 11.228 -0.323 -4.704 74 H GLU 14 H GLU 14 9.155 1.961 3.054 75 HA GLU 14 HA GLU 14 8.356 -0.790 3.255 76 HB2 GLU 14 1HB GLU 14 9.682 -0.821 5.237 77 HB3 GLU 14 2HB GLU 14 9.086 0.755 5.755 78 HG2 GLU 14 1HG GLU 14 6.805 -0.288 6.075 79 HG3 GLU 14 2HG GLU 14 7.483 -1.839 5.634 80 H VAL 15 H VAL 15 6.346 -0.188 2.284 81 HA VAL 15 HA VAL 15 4.711 2.087 3.299 82 HB VAL 15 HB VAL 15 4.837 1.451 0.883 83 HG11 VAL 15 1HG1 VAL 15 3.302 -1.055 1.734 84 HG12 VAL 15 2HG1 VAL 15 3.502 -0.506 0.067 85 HG13 VAL 15 3HG1 VAL 15 4.919 -1.000 1.008 86 HG21 VAL 15 3HG2 VAL 15 2.010 1.101 1.919 87 HG22 VAL 15 1HG2 VAL 15 2.847 2.665 1.799 88 HG23 VAL 15 2HG2 VAL 15 2.536 1.701 0.343 89 H THR 16 H THR 16 2.626 1.729 4.121 90 HA THR 16 HA THR 16 1.995 -0.928 5.229 91 HB THR 16 HB THR 16 0.984 0.521 7.192 92 HG1 THR 16 1HG THR 16 2.996 2.197 6.127 93 HG21 THR 16 3HG2 THR 16 2.769 -1.126 7.537 94 HG22 THR 16 1HG2 THR 16 3.028 0.317 8.530 95 HG23 THR 16 2HG2 THR 16 3.996 0.073 7.059 96 H ILE 17 H ILE 17 -0.219 -1.280 5.482 97 HA ILE 17 HA ILE 17 -1.966 0.779 4.346 98 HB ILE 17 HB ILE 17 -1.598 -0.581 2.504 99 HG12 ILE 17 1HG1 ILE 17 -3.844 -1.725 2.138 100 HG13 ILE 17 2HG1 ILE 17 -4.158 -1.614 3.854 101 HG21 ILE 17 1HG2 ILE 17 -0.529 -2.549 3.437 102 HG22 ILE 17 2HG2 ILE 17 -2.114 -3.103 4.053 103 HG23 ILE 17 3HG2 ILE 17 -1.819 -2.978 2.320 104 HD11 ILE 17 3HD1 ILE 17 -5.315 0.157 2.953 105 HD12 ILE 17 1HD1 ILE 17 -3.897 0.968 3.554 106 HD13 ILE 17 2HD1 ILE 17 -4.001 0.607 1.825 107 H GLU 18 H GLU 18 -2.915 1.345 6.226 108 HA GLU 18 HA GLU 18 -3.965 -0.726 8.090 109 HB2 GLU 18 1HB GLU 18 -4.576 2.247 7.953 110 HB3 GLU 18 2HB GLU 18 -5.060 1.120 9.210 111 HG2 GLU 18 1HG GLU 18 -2.656 0.772 9.805 112 HG3 GLU 18 2HG GLU 18 -2.208 1.969 8.579 113 H GLN 19 H GLN 19 -6.169 -1.277 8.090 114 HA GLN 19 HA GLN 19 -7.933 0.148 6.185 115 HB2 GLN 19 1HB GLN 19 -8.170 -2.791 6.983 116 HB3 GLN 19 2HB GLN 19 -9.243 -1.861 5.937 117 HG2 GLN 19 1HG GLN 19 -7.121 -1.435 4.479 118 HG3 GLN 19 2HG GLN 19 -6.402 -2.763 5.380 119 HE21 GLN 19 1HE2 GLN 19 -7.399 -4.933 5.154 120 HE22 GLN 19 2HE2 GLN 19 -8.088 -5.375 3.649 121 H SER 20 H SER 20 -9.962 0.706 7.155 122 HA SER 20 HA SER 20 -10.430 -0.071 9.952 123 HB2 SER 20 1HB SER 20 -11.140 2.739 9.444 124 HB3 SER 20 2HB SER 20 -10.348 2.020 10.847 125 HG SER 20 HG SER 20 -8.363 2.256 9.798 126 H GLY 21 H GLY 21 -12.795 0.434 10.521 127 HA2 GLY 21 1HA GLY 21 -14.974 0.131 10.047 128 HA3 GLY 21 2HA GLY 21 -14.724 0.972 8.511 129 H ASP 22 H ASP 22 -16.100 -0.508 7.368 130 HA ASP 22 HA ASP 22 -15.769 -3.374 7.667 131 HB2 ASP 22 1HB ASP 22 -17.983 -2.148 7.436 132 HB3 ASP 22 2HB ASP 22 -17.619 -1.932 5.730 133 H PHE 23 H PHE 23 -13.556 -3.386 6.912 134 HA PHE 23 HA PHE 23 -13.024 -2.662 4.192 135 HB2 PHE 23 1HB PHE 23 -10.790 -3.499 4.588 136 HB3 PHE 23 2HB PHE 23 -11.367 -2.442 5.858 137 HD1 PHE 23 1HD PHE 23 -10.834 -6.092 5.052 138 HD2 PHE 23 2HD PHE 23 -11.207 -3.063 8.115 139 HE1 PHE 23 1HE PHE 23 -10.150 -7.725 6.754 140 HE2 PHE 23 2HE PHE 23 -10.442 -4.689 9.807 141 HZ PHE 23 HZ PHE 23 -9.929 -7.050 9.128 142 H ARG 24 H ARG 24 -15.122 -5.040 4.721 143 HA ARG 24 HA ARG 24 -13.585 -7.172 3.348 144 HB2 ARG 24 1HB ARG 24 -16.145 -7.356 4.960 145 HB3 ARG 24 2HB ARG 24 -15.151 -8.695 4.359 146 HG2 ARG 24 1HG ARG 24 -13.218 -7.713 5.736 147 HG3 ARG 24 2HG ARG 24 -14.421 -6.658 6.508 148 HD2 ARG 24 1HD ARG 24 -15.706 -8.689 7.185 149 HD3 ARG 24 2HD ARG 24 -14.475 -9.692 6.430 150 HE ARG 24 HE ARG 24 -14.094 -7.890 8.783 151 HH11 ARG 24 1HH1 ARG 24 -13.205 -10.944 7.131 152 HH12 ARG 24 2HH1 ARG 24 -12.121 -11.415 8.401 153 HH21 ARG 24 1HH2 ARG 24 -12.649 -8.534 10.347 154 HH22 ARG 24 2HH2 ARG 24 -11.855 -10.086 10.306 155 H SER 25 H SER 25 -15.624 -4.836 2.174 156 HA SER 25 HA SER 25 -16.283 -6.610 -0.093 157 HB2 SER 25 1HB SER 25 -18.345 -4.894 1.349 158 HB3 SER 25 2HB SER 25 -18.594 -5.760 -0.181 159 HG SER 25 HG SER 25 -19.279 -6.873 1.847 160 H PHE 26 H PHE 26 -14.184 -5.026 -0.394 161 HA PHE 26 HA PHE 26 -15.170 -2.904 -2.194 162 HB2 PHE 26 1HB PHE 26 -13.090 -2.409 -0.037 163 HB3 PHE 26 2HB PHE 26 -13.290 -1.412 -1.470 164 HD1 PHE 26 2HD PHE 26 -15.045 -2.602 1.621 165 HD2 PHE 26 1HD PHE 26 -15.069 0.161 -1.687 166 HE1 PHE 26 2HE PHE 26 -17.134 -1.602 2.488 167 HE2 PHE 26 1HE PHE 26 -17.142 1.209 -0.785 168 HZ PHE 26 HZ PHE 26 -18.238 0.217 1.246 169 H ILE 27 H ILE 27 -14.037 -2.838 -4.108 170 HA ILE 27 HA ILE 27 -12.292 -5.088 -4.667 171 HB ILE 27 HB ILE 27 -13.093 -2.759 -6.439 172 HG12 ILE 27 1HG1 ILE 27 -15.159 -3.692 -5.745 173 HG13 ILE 27 2HG1 ILE 27 -14.852 -4.192 -7.397 174 HG21 ILE 27 1HG2 ILE 27 -12.684 -4.364 -8.308 175 HG22 ILE 27 2HG2 ILE 27 -11.224 -3.973 -7.396 176 HG23 ILE 27 3HG2 ILE 27 -12.036 -5.527 -7.134 177 HD11 ILE 27 3HD1 ILE 27 -14.437 -5.927 -4.922 178 HD12 ILE 27 1HD1 ILE 27 -15.769 -6.044 -6.075 179 HD13 ILE 27 2HD1 ILE 27 -14.119 -6.424 -6.601 180 H LYS 28 H LYS 28 -10.306 -4.832 -3.569 181 HA LYS 28 HA LYS 28 -8.906 -2.226 -3.737 182 HB2 LYS 28 1HB LYS 28 -8.059 -4.870 -2.513 183 HB3 LYS 28 2HB LYS 28 -7.282 -3.302 -2.238 184 HG2 LYS 28 1HG LYS 28 -9.087 -2.516 -0.880 185 HG3 LYS 28 2HG LYS 28 -10.168 -3.783 -1.441 186 HD2 LYS 28 1HD LYS 28 -8.206 -5.346 -0.399 187 HD3 LYS 28 2HD LYS 28 -8.048 -3.937 0.656 188 HE2 LYS 28 1HE LYS 28 -10.555 -5.582 0.072 189 HE3 LYS 28 2HE LYS 28 -9.566 -5.700 1.528 190 HZ1 LYS 28 3HZ LYS 28 -11.500 -4.431 1.880 191 HZ2 LYS 28 1HZ LYS 28 -11.145 -3.348 0.709 192 HZ3 LYS 28 2HZ LYS 28 -10.181 -3.457 2.078 193 H SER 29 H SER 29 -6.782 -1.996 -4.718 194 HA SER 29 HA SER 29 -5.720 -4.280 -6.284 195 HB2 SER 29 1HB SER 29 -6.478 -1.485 -7.228 196 HB3 SER 29 2HB SER 29 -5.256 -2.443 -8.059 197 HG SER 29 HG SER 29 -6.754 -3.899 -8.633 198 H VAL 30 H VAL 30 -3.434 -4.353 -6.163 199 HA VAL 30 HA VAL 30 -2.080 -1.798 -5.596 200 HB VAL 30 HB VAL 30 -1.171 -4.360 -4.291 201 HG11 VAL 30 1HG1 VAL 30 0.581 -2.684 -4.696 202 HG12 VAL 30 2HG1 VAL 30 -0.380 -1.491 -3.778 203 HG13 VAL 30 3HG1 VAL 30 0.266 -2.945 -2.974 204 HG21 VAL 30 3HG2 VAL 30 -3.291 -3.789 -3.234 205 HG22 VAL 30 1HG2 VAL 30 -1.973 -3.395 -2.122 206 HG23 VAL 30 2HG2 VAL 30 -2.790 -2.100 -3.023 207 H VAL 31 H VAL 31 -0.632 -1.458 -7.144 208 HA VAL 31 HA VAL 31 0.563 -3.703 -8.653 209 HB VAL 31 HB VAL 31 0.337 -0.726 -9.325 210 HG11 VAL 31 1HG1 VAL 31 1.033 -1.417 -11.574 211 HG12 VAL 31 2HG1 VAL 31 2.257 -1.867 -10.385 212 HG13 VAL 31 3HG1 VAL 31 1.169 -3.104 -11.036 213 HG21 VAL 31 3HG2 VAL 31 -1.414 -3.057 -10.198 214 HG22 VAL 31 1HG2 VAL 31 -1.909 -1.557 -9.387 215 HG23 VAL 31 2HG2 VAL 31 -1.338 -1.514 -11.048 216 H VAL 32 H VAL 32 2.459 -4.250 -7.589 217 HA VAL 32 HA VAL 32 4.001 -2.111 -6.297 218 HB VAL 32 HB VAL 32 3.060 -3.169 -4.503 219 HG11 VAL 32 1HG1 VAL 32 2.942 -5.634 -4.173 220 HG12 VAL 32 2HG1 VAL 32 1.953 -5.055 -5.525 221 HG13 VAL 32 3HG1 VAL 32 3.528 -5.806 -5.845 222 HG21 VAL 32 3HG2 VAL 32 5.526 -4.937 -4.871 223 HG22 VAL 32 1HG2 VAL 32 5.669 -3.244 -4.435 224 HG23 VAL 32 2HG2 VAL 32 4.819 -4.351 -3.344 225 H VAL 33 H VAL 33 6.066 -1.866 -6.806 226 HA VAL 33 HA VAL 33 7.418 -3.963 -8.425 227 HB VAL 33 HB VAL 33 7.507 -0.954 -8.925 228 HG11 VAL 33 1HG1 VAL 33 8.462 -1.655 -11.112 229 HG12 VAL 33 2HG1 VAL 33 9.456 -2.183 -9.752 230 HG13 VAL 33 3HG1 VAL 33 8.414 -3.354 -10.587 231 HG21 VAL 33 3HG2 VAL 33 5.209 -1.593 -9.442 232 HG22 VAL 33 1HG2 VAL 33 6.107 -1.322 -10.930 233 HG23 VAL 33 2HG2 VAL 33 5.771 -2.983 -10.392 234 H ALA 34 H ALA 34 9.607 -4.253 -7.780 235 HA ALA 34 HA ALA 34 10.894 -2.036 -6.337 236 HB1 ALA 34 1HB ALA 34 12.177 -3.676 -4.996 237 HB2 ALA 34 2HB ALA 34 10.467 -3.589 -4.569 238 HB3 ALA 34 3HB ALA 34 11.079 -4.961 -5.535 239 H ASN 35 H ASN 35 12.140 -1.325 -7.842 240 HA ASN 35 HA ASN 35 13.428 -2.781 -9.976 241 HB2 ASN 35 1HB ASN 35 12.919 -0.268 -9.748 242 HB3 ASN 35 2HB ASN 35 14.304 -0.214 -8.679 243 HD21 ASN 35 1HD2 ASN 35 13.531 1.066 -11.126 244 HD22 ASN 35 2HD2 ASN 35 14.664 0.723 -12.407 245 H GLY 36 H GLY 36 14.939 -4.341 -9.486 246 HA2 GLY 36 1HA GLY 36 17.157 -4.885 -9.049 247 HA3 GLY 36 2HA GLY 36 17.254 -3.610 -7.840 248 H THR 37 H THR 37 14.532 -5.186 -6.734 249 HA THR 37 HA THR 37 15.952 -7.351 -5.373 250 HB THR 37 HB THR 37 16.655 -5.278 -4.212 251 HG1 THR 37 1HG THR 37 14.942 -6.728 -2.503 252 HG21 THR 37 3HG2 THR 37 13.702 -5.041 -3.509 253 HG22 THR 37 1HG2 THR 37 14.623 -3.957 -4.572 254 HG23 THR 37 2HG2 THR 37 15.022 -4.045 -2.846 255 H GLN 38 H GLN 38 14.439 -8.287 -3.596 256 HA GLN 38 HA GLN 38 11.762 -8.617 -4.809 257 HB2 GLN 38 1HB GLN 38 13.436 -10.294 -2.903 258 HB3 GLN 38 2HB GLN 38 11.682 -10.407 -2.888 259 HG2 GLN 38 1HG GLN 38 11.996 -11.985 -4.428 260 HG3 GLN 38 2HG GLN 38 11.954 -10.622 -5.522 261 HE21 GLN 38 1HE2 GLN 38 13.386 -13.290 -5.191 262 HE22 GLN 38 2HE2 GLN 38 15.001 -13.001 -5.836 263 H LEU 39 H LEU 39 10.030 -8.818 -3.374 264 HA LEU 39 HA LEU 39 9.834 -6.697 -1.311 265 HB2 LEU 39 1HB LEU 39 8.034 -8.026 -3.280 266 HB3 LEU 39 2HB LEU 39 7.337 -7.930 -1.683 267 HG LEU 39 HG LEU 39 6.858 -6.113 -3.432 268 HD11 LEU 39 1HD1 LEU 39 6.085 -5.980 -1.154 269 HD12 LEU 39 2HD1 LEU 39 6.649 -4.386 -1.671 270 HD13 LEU 39 3HD1 LEU 39 7.658 -5.375 -0.591 271 HD21 LEU 39 3HD2 LEU 39 9.367 -5.694 -3.849 272 HD22 LEU 39 1HD2 LEU 39 9.328 -4.789 -2.306 273 HD23 LEU 39 2HD2 LEU 39 8.314 -4.289 -3.679 274 H LYS 40 H LYS 40 8.720 -7.312 0.617 275 HA LYS 40 HA LYS 40 8.869 -10.183 1.348 276 HB2 LYS 40 1HB LYS 40 10.682 -8.857 2.423 277 HB3 LYS 40 2HB LYS 40 9.461 -7.749 3.072 278 HG2 LYS 40 1HG LYS 40 8.417 -9.787 4.255 279 HG3 LYS 40 2HG LYS 40 9.858 -10.697 3.739 280 HD2 LYS 40 1HD LYS 40 11.280 -8.944 4.857 281 HD3 LYS 40 2HD LYS 40 9.778 -8.176 5.442 282 HE2 LYS 40 1HE LYS 40 9.197 -10.395 6.531 283 HE3 LYS 40 2HE LYS 40 10.815 -10.965 6.070 284 HZ1 LYS 40 3HZ LYS 40 10.895 -10.165 8.263 285 HZ2 LYS 40 1HZ LYS 40 10.160 -8.748 7.899 286 HZ3 LYS 40 2HZ LYS 40 11.683 -9.014 7.367 287 H ASP 41 H ASP 41 6.914 -10.918 1.955 288 HA ASP 41 HA ASP 41 4.594 -9.089 2.085 289 HB2 ASP 41 1HB ASP 41 4.469 -11.436 1.092 290 HB3 ASP 41 2HB ASP 41 4.694 -12.062 2.721 291 H GLY 42 H GLY 42 4.086 -8.125 4.022 292 HA2 GLY 42 1HA GLY 42 5.637 -8.676 6.396 293 HA3 GLY 42 2HA GLY 42 4.251 -7.583 6.257 294 H ALA 43 H ALA 43 2.639 -10.129 5.140 295 HA ALA 43 HA ALA 43 1.395 -10.434 7.706 296 HB1 ALA 43 1HB ALA 43 0.011 -10.343 5.781 297 HB2 ALA 43 2HB ALA 43 0.836 -11.693 5.003 298 HB3 ALA 43 3HB ALA 43 -0.150 -11.974 6.443 299 H THR 44 H THR 44 3.338 -12.795 5.760 300 HA THR 44 HA THR 44 3.809 -14.181 8.354 301 HB THR 44 HB THR 44 4.078 -16.292 6.878 302 HG1 THR 44 1HG THR 44 2.675 -14.710 5.104 303 HG21 THR 44 3HG2 THR 44 1.330 -15.190 7.554 304 HG22 THR 44 1HG2 THR 44 2.429 -15.980 8.711 305 HG23 THR 44 2HG2 THR 44 1.750 -16.903 7.355 306 H GLY 45 H GLY 45 5.309 -12.305 6.097 307 HA2 GLY 45 1HA GLY 45 7.483 -11.702 6.128 308 HA3 GLY 45 2HA GLY 45 7.917 -13.099 7.144 309 H GLU 46 H GLU 46 6.090 -13.264 4.088 310 HA GLU 46 HA GLU 46 7.904 -15.298 3.052 311 HB2 GLU 46 1HB GLU 46 5.400 -14.106 1.807 312 HB3 GLU 46 2HB GLU 46 6.185 -15.611 1.359 313 HG2 GLU 46 1HG GLU 46 5.732 -15.986 4.094 314 HG3 GLU 46 2HG GLU 46 4.370 -14.986 3.600 315 H SER 47 H SER 47 8.394 -15.036 0.563 316 HA SER 47 HA SER 47 9.378 -12.239 0.108 317 HB2 SER 47 1HB SER 47 11.114 -13.686 0.798 318 HB3 SER 47 2HB SER 47 10.859 -14.816 -0.539 319 HG SER 47 HG SER 47 12.550 -13.127 -0.710 320 H LEU 48 H LEU 48 9.001 -11.404 -1.619 321 HA LEU 48 HA LEU 48 7.251 -12.863 -3.582 322 HB2 LEU 48 1HB LEU 48 7.083 -9.971 -2.792 323 HB3 LEU 48 2HB LEU 48 5.955 -10.875 -3.796 324 HG LEU 48 HG LEU 48 6.437 -11.223 -0.799 325 HD11 LEU 48 1HD1 LEU 48 5.267 -9.209 -1.392 326 HD12 LEU 48 2HD1 LEU 48 4.077 -10.332 -0.745 327 HD13 LEU 48 3HD1 LEU 48 4.170 -10.089 -2.496 328 HD21 LEU 48 3HD2 LEU 48 5.872 -13.434 -1.845 329 HD22 LEU 48 1HD2 LEU 48 4.425 -12.701 -2.530 330 HD23 LEU 48 2HD2 LEU 48 4.593 -12.838 -0.764 331 H ALA 49 H ALA 49 7.750 -12.883 -5.509 332 HA ALA 49 HA ALA 49 10.170 -11.603 -6.620 333 HB1 ALA 49 1HB ALA 49 8.141 -13.541 -7.812 334 HB2 ALA 49 2HB ALA 49 9.563 -12.904 -8.656 335 HB3 ALA 49 3HB ALA 49 9.779 -13.925 -7.221 336 H SER 50 H SER 50 9.596 -9.422 -6.541 337 HA SER 50 HA SER 50 7.137 -8.479 -7.661 338 HB2 SER 50 1HB SER 50 7.856 -6.408 -7.009 339 HB3 SER 50 2HB SER 50 8.665 -7.420 -5.858 340 HG SER 50 HG SER 50 10.581 -7.198 -7.135 341 HA PRO 51 HA PRO 51 6.802 -6.143 -8.888 342 HB2 PRO 51 1HB PRO 51 5.286 -5.829 -11.155 343 HB3 PRO 51 2HB PRO 51 6.783 -4.914 -10.825 344 HG2 PRO 51 1HG PRO 51 6.473 -7.398 -12.512 345 HG3 PRO 51 2HG PRO 51 7.342 -5.879 -12.920 346 HD2 PRO 51 1HD PRO 51 8.659 -8.057 -11.949 347 HD3 PRO 51 2HD PRO 51 9.127 -6.408 -11.451 348 H VAL 52 H VAL 52 4.637 -6.548 -8.216 349 HA VAL 52 HA VAL 52 3.326 -8.961 -9.139 350 HB VAL 52 HB VAL 52 4.829 -9.654 -7.371 351 HG11 VAL 52 1HG1 VAL 52 4.940 -7.610 -6.032 352 HG12 VAL 52 2HG1 VAL 52 3.288 -7.959 -5.434 353 HG13 VAL 52 3HG1 VAL 52 4.621 -9.064 -5.068 354 HG21 VAL 52 3HG2 VAL 52 2.637 -10.838 -7.627 355 HG22 VAL 52 1HG2 VAL 52 3.252 -10.905 -5.973 356 HG23 VAL 52 2HG2 VAL 52 1.943 -9.791 -6.374 357 H ILE 53 H ILE 53 1.106 -9.058 -8.470 358 HA ILE 53 HA ILE 53 -0.034 -6.394 -7.929 359 HB ILE 53 HB ILE 53 -1.180 -8.687 -9.552 360 HG12 ILE 53 1HG1 ILE 53 0.551 -7.755 -10.910 361 HG13 ILE 53 2HG1 ILE 53 -0.980 -7.150 -11.507 362 HG21 ILE 53 1HG2 ILE 53 -2.921 -7.017 -10.189 363 HG22 ILE 53 2HG2 ILE 53 -2.937 -7.473 -8.484 364 HG23 ILE 53 3HG2 ILE 53 -2.225 -5.916 -8.965 365 HD11 ILE 53 3HD1 ILE 53 -0.470 -5.010 -10.112 366 HD12 ILE 53 1HD1 ILE 53 1.189 -5.650 -10.060 367 HD13 ILE 53 2HD1 ILE 53 0.433 -5.309 -11.613 368 H LEU 54 H LEU 54 -0.935 -6.347 -5.982 369 HA LEU 54 HA LEU 54 -1.470 -8.899 -4.541 370 HB2 LEU 54 1HB LEU 54 -2.018 -6.093 -3.537 371 HB3 LEU 54 2HB LEU 54 -2.130 -7.563 -2.640 372 HG LEU 54 HG LEU 54 0.451 -6.353 -3.701 373 HD11 LEU 54 1HD1 LEU 54 -0.528 -5.224 -1.715 374 HD12 LEU 54 2HD1 LEU 54 0.999 -6.046 -1.341 375 HD13 LEU 54 3HD1 LEU 54 -0.538 -6.780 -0.851 376 HD21 LEU 54 3HD2 LEU 54 1.593 -8.173 -2.400 377 HD22 LEU 54 1HD2 LEU 54 0.676 -8.803 -3.768 378 HD23 LEU 54 2HD2 LEU 54 0.018 -8.941 -2.130 379 H SER 55 H SER 55 -3.605 -9.187 -3.658 380 HA SER 55 HA SER 55 -5.832 -8.050 -5.216 381 HB2 SER 55 1HB SER 55 -5.265 -11.023 -4.890 382 HB3 SER 55 2HB SER 55 -6.638 -10.289 -5.715 383 HG SER 55 HG SER 55 -5.198 -9.360 -7.211 384 H ASP 56 H ASP 56 -7.877 -9.430 -4.183 385 HA ASP 56 HA ASP 56 -8.383 -8.227 -1.755 386 HB2 ASP 56 1HB ASP 56 -9.971 -9.204 -3.478 387 HB3 ASP 56 2HB ASP 56 -9.582 -10.817 -2.876 388 H GLU 57 H GLU 57 -7.172 -11.581 -2.250 389 HA GLU 57 HA GLU 57 -7.533 -12.445 0.450 390 HB2 GLU 57 1HB GLU 57 -5.696 -13.386 -1.787 391 HB3 GLU 57 2HB GLU 57 -5.917 -14.260 -0.272 392 HG2 GLU 57 1HG GLU 57 -8.245 -13.592 -2.139 393 HG3 GLU 57 2HG GLU 57 -7.274 -15.050 -2.293 394 H GLU 58 H GLU 58 -4.851 -10.960 -1.271 395 HA GLU 58 HA GLU 58 -2.900 -11.246 0.803 396 HB2 GLU 58 1HB GLU 58 -2.947 -8.986 -1.221 397 HB3 GLU 58 2HB GLU 58 -1.551 -9.801 -0.524 398 HG2 GLU 58 1HG GLU 58 -3.476 -10.828 -2.649 399 HG3 GLU 58 2HG GLU 58 -1.784 -10.416 -2.868 400 H LEU 59 H LEU 59 -5.571 -9.110 0.281 401 HA LEU 59 HA LEU 59 -4.689 -7.146 2.340 402 HB2 LEU 59 1HB LEU 59 -6.455 -6.975 -0.121 403 HB3 LEU 59 2HB LEU 59 -6.388 -5.718 1.080 404 HG LEU 59 HG LEU 59 -4.196 -6.588 -0.835 405 HD11 LEU 59 1HD1 LEU 59 -5.921 -5.006 -1.535 406 HD12 LEU 59 2HD1 LEU 59 -4.352 -4.206 -1.435 407 HD13 LEU 59 3HD1 LEU 59 -5.544 -3.942 -0.156 408 HD21 LEU 59 3HD2 LEU 59 -2.905 -6.253 1.145 409 HD22 LEU 59 1HD2 LEU 59 -3.858 -4.822 1.634 410 HD23 LEU 59 2HD2 LEU 59 -2.773 -4.765 0.222 411 H ALA 60 H ALA 60 -6.186 -9.807 2.569 412 HA ALA 60 HA ALA 60 -8.895 -9.209 3.142 413 HB1 ALA 60 1HB ALA 60 -7.196 -11.624 3.916 414 HB2 ALA 60 2HB ALA 60 -8.972 -11.557 3.892 415 HB3 ALA 60 3HB ALA 60 -8.075 -11.399 2.384 416 H VAL 61 H VAL 61 -6.433 -8.075 4.957 417 HA VAL 61 HA VAL 61 -7.545 -8.811 7.620 418 HB VAL 61 HB VAL 61 -5.173 -8.589 8.389 419 HG11 VAL 61 1HG1 VAL 61 -5.460 -10.649 6.170 420 HG12 VAL 61 2HG1 VAL 61 -4.249 -10.637 7.460 421 HG13 VAL 61 3HG1 VAL 61 -5.970 -10.849 7.864 422 HG21 VAL 61 3HG2 VAL 61 -4.391 -7.114 6.500 423 HG22 VAL 61 1HG2 VAL 61 -3.339 -8.511 6.814 424 HG23 VAL 61 2HG2 VAL 61 -4.438 -8.527 5.433 425 H GLU 62 H GLU 62 -7.034 -7.264 9.344 426 HA GLU 62 HA GLU 62 -7.822 -4.634 8.937 427 HB2 GLU 62 1HB GLU 62 -6.809 -4.223 11.195 428 HB3 GLU 62 2HB GLU 62 -7.887 -5.625 11.122 429 HG2 GLU 62 1HG GLU 62 -6.184 -7.155 11.343 430 HG3 GLU 62 2HG GLU 62 -4.946 -6.129 10.661 431 H LYS 63 H LYS 63 -4.586 -5.865 8.326 432 HA LYS 63 HA LYS 63 -3.530 -3.211 7.732 433 HB2 LYS 63 1HB LYS 63 -3.416 -3.933 10.369 434 HB3 LYS 63 2HB LYS 63 -1.983 -4.740 9.811 435 HG2 LYS 63 1HG LYS 63 -2.581 -1.766 9.602 436 HG3 LYS 63 2HG LYS 63 -1.527 -2.573 10.762 437 HD2 LYS 63 1HD LYS 63 -0.274 -3.380 8.527 438 HD3 LYS 63 2HD LYS 63 -1.046 -1.923 7.888 439 HE2 LYS 63 1HE LYS 63 0.775 -0.845 8.685 440 HE3 LYS 63 2HE LYS 63 -0.057 -0.941 10.244 441 HZ1 LYS 63 3HZ LYS 63 1.975 -2.834 9.208 442 HZ2 LYS 63 1HZ LYS 63 1.150 -3.037 10.618 443 HZ3 LYS 63 2HZ LYS 63 2.209 -1.766 10.405 444 H VAL 64 H VAL 64 -1.895 -3.494 6.107 445 HA VAL 64 HA VAL 64 -0.398 -6.023 6.331 446 HB VAL 64 HB VAL 64 -0.842 -4.969 3.550 447 HG11 VAL 64 1HG1 VAL 64 -0.182 -7.737 4.610 448 HG12 VAL 64 2HG1 VAL 64 -0.356 -7.280 2.917 449 HG13 VAL 64 3HG1 VAL 64 0.973 -6.615 3.850 450 HG21 VAL 64 3HG2 VAL 64 -3.139 -5.422 4.350 451 HG22 VAL 64 1HG2 VAL 64 -2.599 -6.704 3.265 452 HG23 VAL 64 2HG2 VAL 64 -2.572 -6.995 4.985 453 H THR 65 H THR 65 1.855 -5.741 5.342 454 HA THR 65 HA THR 65 2.891 -2.981 5.348 455 HB THR 65 HB THR 65 4.068 -5.238 7.028 456 HG1 THR 65 1HG THR 65 2.340 -4.860 8.110 457 HG21 THR 65 3HG2 THR 65 5.699 -3.567 6.402 458 HG22 THR 65 1HG2 THR 65 5.287 -3.338 8.102 459 HG23 THR 65 2HG2 THR 65 4.631 -2.244 6.870 460 H LEU 66 H LEU 66 4.444 -2.832 3.664 461 HA LEU 66 HA LEU 66 5.575 -5.377 2.613 462 HB2 LEU 66 1HB LEU 66 4.190 -3.213 0.987 463 HB3 LEU 66 2HB LEU 66 5.406 -4.251 0.322 464 HG LEU 66 HG LEU 66 3.401 -5.172 -0.375 465 HD11 LEU 66 1HD1 LEU 66 4.003 -6.894 2.038 466 HD12 LEU 66 2HD1 LEU 66 4.978 -6.892 0.557 467 HD13 LEU 66 3HD1 LEU 66 3.283 -7.379 0.500 468 HD21 LEU 66 3HD2 LEU 66 1.473 -5.655 1.018 469 HD22 LEU 66 1HD2 LEU 66 1.927 -3.940 1.180 470 HD23 LEU 66 2HD2 LEU 66 2.340 -5.110 2.452 471 H SER 67 H SER 67 7.666 -5.213 2.143 472 HA SER 67 HA SER 67 9.141 -2.664 2.302 473 HB2 SER 67 1HB SER 67 8.694 -3.299 4.650 474 HB3 SER 67 2HB SER 67 9.359 -4.896 4.374 475 HG SER 67 HG SER 67 10.916 -3.703 5.319 476 H THR 68 H THR 68 11.485 -3.192 1.881 477 HA THR 68 HA THR 68 11.610 -5.527 -0.007 478 HB THR 68 HB THR 68 13.748 -4.444 -0.830 479 HG1 THR 68 1HG THR 68 14.293 -2.623 -0.155 480 HG21 THR 68 3HG2 THR 68 11.818 -4.525 -2.189 481 HG22 THR 68 1HG2 THR 68 12.372 -2.844 -2.237 482 HG23 THR 68 2HG2 THR 68 10.988 -3.318 -1.214 483 H THR 69 H THR 69 13.389 -6.897 -0.200 484 HA THR 69 HA THR 69 14.596 -7.682 2.308 485 HB THR 69 HB THR 69 15.666 -9.370 0.761 486 HG1 THR 69 1HG THR 69 15.503 -9.137 -1.262 487 HG21 THR 69 3HG2 THR 69 12.627 -9.106 0.446 488 HG22 THR 69 1HG2 THR 69 13.457 -9.801 1.856 489 HG23 THR 69 2HG2 THR 69 13.596 -10.577 0.266 490 H GLY 70 H GLY 70 15.571 -5.607 -0.433 491 HA2 GLY 70 1HA GLY 70 17.999 -4.833 1.067 492 HA3 GLY 70 2HA GLY 70 18.194 -5.493 -0.573 493 H LYS 71 H LYS 71 19.209 -3.211 -0.732 494 HA LYS 71 HA LYS 71 17.752 -0.831 -1.060 495 HB2 LYS 71 1HB LYS 71 20.246 -1.027 -1.409 496 HB3 LYS 71 2HB LYS 71 19.932 -1.980 -2.891 497 HG2 LYS 71 1HG LYS 71 18.818 -0.125 -3.933 498 HG3 LYS 71 2HG LYS 71 19.064 0.888 -2.505 499 HD2 LYS 71 1HD LYS 71 21.441 1.022 -2.961 500 HD3 LYS 71 2HD LYS 71 21.378 -0.403 -4.001 501 HE2 LYS 71 1HE LYS 71 19.978 0.737 -5.603 502 HE3 LYS 71 2HE LYS 71 19.958 2.237 -4.694 503 HZ1 LYS 71 3HZ LYS 71 22.261 0.894 -5.992 504 HZ2 LYS 71 1HZ LYS 71 22.415 2.317 -5.170 505 HZ3 LYS 71 2HZ LYS 71 21.544 2.202 -6.565 506 H ALA 72 H ALA 72 16.364 -0.054 -2.657 507 HA ALA 72 HA ALA 72 16.157 -1.648 -5.114 508 HB1 ALA 72 1HB ALA 72 13.860 -0.230 -3.751 509 HB2 ALA 72 2HB ALA 72 13.752 -1.187 -5.246 510 HB3 ALA 72 3HB ALA 72 14.052 -1.978 -3.683 511 H ILE 73 H ILE 73 15.163 -0.127 -6.781 512 HA ILE 73 HA ILE 73 16.385 2.570 -6.453 513 HB ILE 73 HB ILE 73 15.591 1.326 -9.067 514 HG12 ILE 73 1HG1 ILE 73 16.956 -0.452 -8.212 515 HG13 ILE 73 2HG1 ILE 73 17.803 0.423 -9.440 516 HG21 ILE 73 1HG2 ILE 73 17.581 2.712 -9.797 517 HG22 ILE 73 2HG2 ILE 73 15.985 3.408 -9.419 518 HG23 ILE 73 3HG2 ILE 73 17.338 3.552 -8.242 519 HD11 ILE 73 3HD1 ILE 73 19.387 -0.051 -7.724 520 HD12 ILE 73 1HD1 ILE 73 19.019 1.679 -7.552 521 HD13 ILE 73 2HD1 ILE 73 18.294 0.467 -6.452 522 H GLU 74 H GLU 74 13.218 1.146 -6.520 523 HA GLU 74 HA GLU 74 11.946 3.720 -6.864 524 HB2 GLU 74 1HB GLU 74 10.848 3.250 -8.951 525 HB3 GLU 74 2HB GLU 74 12.448 2.669 -9.260 526 HG2 GLU 74 1HG GLU 74 11.644 0.510 -8.581 527 HG3 GLU 74 2HG GLU 74 10.001 1.061 -8.425 528 H PHE 75 H PHE 75 9.602 3.473 -6.207 529 HA PHE 75 HA PHE 75 8.599 0.816 -5.661 530 HB2 PHE 75 1HB PHE 75 9.644 1.746 -3.491 531 HB3 PHE 75 2HB PHE 75 8.358 2.913 -3.471 532 HD1 PHE 75 1HD PHE 75 8.737 -0.815 -4.038 533 HD2 PHE 75 2HD PHE 75 6.593 2.312 -1.993 534 HE1 PHE 75 1HE PHE 75 7.409 -2.507 -2.851 535 HE2 PHE 75 2HE PHE 75 5.085 0.637 -1.055 536 HZ PHE 75 HZ PHE 75 5.551 -1.807 -1.337 537 H ALA 76 H ALA 76 6.961 0.972 -7.118 538 HA ALA 76 HA ALA 76 5.284 3.421 -7.254 539 HB1 ALA 76 1HB ALA 76 4.396 2.466 -9.240 540 HB2 ALA 76 2HB ALA 76 6.149 2.289 -9.319 541 HB3 ALA 76 3HB ALA 76 5.145 0.876 -8.916 542 H VAL 77 H VAL 77 2.997 3.341 -6.781 543 HA VAL 77 HA VAL 77 1.782 0.819 -5.882 544 HB VAL 77 HB VAL 77 1.739 3.270 -4.053 545 HG11 VAL 77 1HG1 VAL 77 0.546 1.830 -2.526 546 HG12 VAL 77 2HG1 VAL 77 -0.276 1.701 -4.079 547 HG13 VAL 77 3HG1 VAL 77 0.804 0.407 -3.557 548 HG21 VAL 77 3HG2 VAL 77 2.930 1.958 -2.390 549 HG22 VAL 77 1HG2 VAL 77 3.133 0.660 -3.519 550 HG23 VAL 77 2HG2 VAL 77 3.975 2.208 -3.813 551 H SER 78 H SER 78 -0.086 0.876 -7.306 552 HA SER 78 HA SER 78 -1.763 3.291 -6.901 553 HB2 SER 78 1HB SER 78 -2.440 3.220 -9.297 554 HB3 SER 78 2HB SER 78 -0.706 3.545 -9.132 555 HG SER 78 HG SER 78 -0.655 1.964 -10.546 556 H GLY 79 H GLY 79 -4.105 2.804 -7.509 557 HA2 GLY 79 1HA GLY 79 -5.089 0.377 -8.267 558 HA3 GLY 79 2HA GLY 79 -4.937 0.204 -6.508 559 H GLY 80 H GLY 80 -6.361 1.146 -5.180 560 HA2 GLY 80 1HA GLY 80 -7.840 3.146 -4.741 561 HA3 GLY 80 2HA GLY 80 -8.513 2.915 -6.358 562 H VAL 81 H VAL 81 -10.557 2.798 -4.841 563 HA VAL 81 HA VAL 81 -11.201 -0.013 -4.517 564 HB VAL 81 HB VAL 81 -12.469 0.697 -2.332 565 HG11 VAL 81 1HG1 VAL 81 -9.548 -0.088 -2.178 566 HG12 VAL 81 2HG1 VAL 81 -10.827 -0.361 -0.969 567 HG13 VAL 81 3HG1 VAL 81 -10.913 -1.179 -2.532 568 HG21 VAL 81 3HG2 VAL 81 -11.494 3.074 -2.417 569 HG22 VAL 81 1HG2 VAL 81 -11.436 2.212 -0.893 570 HG23 VAL 81 2HG2 VAL 81 -9.958 2.338 -1.884 571 H VAL 82 H VAL 82 -12.478 0.187 -6.231 572 HA VAL 82 HA VAL 82 -14.797 1.999 -6.064 573 HB VAL 82 HB VAL 82 -13.722 1.374 -8.235 574 HG11 VAL 82 1HG1 VAL 82 -13.198 -0.965 -7.854 575 HG12 VAL 82 2HG1 VAL 82 -14.927 -1.376 -7.756 576 HG13 VAL 82 3HG1 VAL 82 -14.216 -0.767 -9.275 577 HG21 VAL 82 3HG2 VAL 82 -15.818 1.080 -9.453 578 HG22 VAL 82 1HG2 VAL 82 -16.645 0.686 -7.936 579 HG23 VAL 82 2HG2 VAL 82 -15.940 2.290 -8.163 580 H ASP 83 H ASP 83 -16.941 1.169 -5.572 581 HA ASP 83 HA ASP 83 -17.084 -1.301 -3.977 582 HB2 ASP 83 1HB ASP 83 -18.092 0.094 -2.575 583 HB3 ASP 83 2HB ASP 83 -18.201 1.404 -3.711 584 H GLY 84 H GLY 84 -18.874 -2.702 -4.561 585 HA2 GLY 84 1HA GLY 84 -19.552 -2.535 -7.486 586 HA3 GLY 84 2HA GLY 84 -18.975 -4.010 -6.677 587 H GLU 85 H GLU 85 -21.120 -2.065 -4.725 588 HA GLU 85 HA GLU 85 -23.387 -3.844 -5.556 589 HB2 GLU 85 1HB GLU 85 -22.728 -3.183 -2.690 590 HB3 GLU 85 2HB GLU 85 -23.948 -4.306 -3.280 591 HG2 GLU 85 1HG GLU 85 -20.939 -4.643 -3.268 592 HG3 GLU 85 2HG GLU 85 -22.135 -5.540 -2.371 593 H ASP 86 H ASP 86 -25.445 -3.008 -4.112 594 HA ASP 86 HA ASP 86 -25.835 -0.210 -4.051 595 HB2 ASP 86 1HB ASP 86 -27.300 -0.023 -5.950 596 HB3 ASP 86 2HB ASP 86 -25.689 -0.437 -6.498 597 H GLY 87 H GLY 87 -27.303 -0.074 -2.567 598 HA2 GLY 87 1HA GLY 87 -29.495 -0.264 -1.680 599 HA3 GLY 87 2HA GLY 87 -29.773 -1.695 -2.682 600 H VAL 88 H VAL 88 -26.910 -2.486 -1.412 601 HA VAL 88 HA VAL 88 -27.790 -4.138 0.734 602 HB VAL 88 HB VAL 88 -25.392 -4.380 1.209 603 HG11 VAL 88 1HG1 VAL 88 -26.010 -4.569 -1.766 604 HG12 VAL 88 2HG1 VAL 88 -24.752 -5.454 -0.883 605 HG13 VAL 88 3HG1 VAL 88 -26.462 -5.763 -0.531 606 HG21 VAL 88 3HG2 VAL 88 -24.630 -2.061 0.668 607 HG22 VAL 88 1HG2 VAL 88 -23.675 -3.306 -0.139 608 HG23 VAL 88 2HG2 VAL 88 -24.891 -2.405 -1.060 609 H VAL 89 H VAL 89 -26.827 -3.852 3.050 610 HA VAL 89 HA VAL 89 -27.103 -1.016 3.901 611 HB VAL 89 HB VAL 89 -28.420 -3.351 5.317 612 HG11 VAL 89 1HG1 VAL 89 -27.775 -1.577 6.839 613 HG12 VAL 89 2HG1 VAL 89 -28.394 -0.336 5.733 614 HG13 VAL 89 3HG1 VAL 89 -29.520 -1.435 6.565 615 HG21 VAL 89 3HG2 VAL 89 -29.685 -2.874 3.225 616 HG22 VAL 89 1HG2 VAL 89 -30.583 -2.426 4.683 617 HG23 VAL 89 2HG2 VAL 89 -29.788 -1.170 3.726 618 H ASN 90 H ASN 90 -24.877 -1.042 3.773 619 HA ASN 90 HA ASN 90 -23.349 -2.978 5.407 620 HB2 ASN 90 1HB ASN 90 -22.824 -1.441 2.892 621 HB3 ASN 90 2HB ASN 90 -21.463 -1.862 3.928 622 HD21 ASN 90 1HD2 ASN 90 -20.550 -3.503 2.789 623 HD22 ASN 90 2HD2 ASN 90 -21.367 -5.016 2.392 624 H GLU 91 H GLU 91 -21.108 -1.800 6.077 625 HA GLU 91 HA GLU 91 -21.691 0.896 7.151 626 HB2 GLU 91 1HB GLU 91 -20.242 -1.442 8.433 627 HB3 GLU 91 2HB GLU 91 -19.570 0.163 8.639 628 HG2 GLU 91 1HG GLU 91 -22.137 0.756 9.204 629 HG3 GLU 91 2HG GLU 91 -22.144 -0.929 9.703 630 HA PRO 92 HA PRO 92 -18.445 2.094 4.531 631 HB2 PRO 92 1HB PRO 92 -17.446 4.341 5.672 632 HB3 PRO 92 2HB PRO 92 -19.198 4.232 5.275 633 HG2 PRO 92 1HG PRO 92 -17.900 3.584 7.946 634 HG3 PRO 92 2HG PRO 92 -19.172 4.798 7.633 635 HD2 PRO 92 1HD PRO 92 -19.828 2.299 8.390 636 HD3 PRO 92 2HD PRO 92 -20.761 3.101 7.093 637 H MET 93 H MET 93 -15.991 2.765 4.407 638 HA MET 93 HA MET 93 -14.384 1.658 6.580 639 HB2 MET 93 1HB MET 93 -13.261 0.081 5.277 640 HB3 MET 93 2HB MET 93 -14.954 -0.198 4.991 641 HG2 MET 93 1HG MET 93 -14.875 0.470 2.797 642 HG3 MET 93 2HG MET 93 -13.556 1.577 3.036 643 HE1 MET 93 3HE MET 93 -10.414 -0.873 3.133 644 HE2 MET 93 1HE MET 93 -10.987 0.772 3.485 645 HE3 MET 93 2HE MET 93 -11.370 -0.554 4.592 646 H GLN 94 H GLN 94 -12.050 2.039 6.248 647 HA GLN 94 HA GLN 94 -11.391 4.461 4.649 648 HB2 GLN 94 1HB GLN 94 -10.882 3.989 7.611 649 HB3 GLN 94 2HB GLN 94 -10.043 5.215 6.657 650 HG2 GLN 94 1HG GLN 94 -12.080 6.399 6.220 651 HG3 GLN 94 2HG GLN 94 -13.071 5.153 6.996 652 HE21 GLN 94 1HE2 GLN 94 -13.496 5.444 9.243 653 HE22 GLN 94 2HE2 GLN 94 -12.505 6.470 10.254 654 H TRP 95 H TRP 95 -9.037 4.729 4.448 655 HA TRP 95 HA TRP 95 -7.359 2.319 4.900 656 HB2 TRP 95 1HB TRP 95 -7.851 3.812 2.316 657 HB3 TRP 95 2HB TRP 95 -6.198 3.416 2.697 658 HD1 TRP 95 HD TRP 95 -8.540 0.721 3.778 659 HE1 TRP 95 1HE TRP 95 -8.245 -1.327 2.318 660 HE3 TRP 95 3HE TRP 95 -5.546 2.745 0.068 661 HZ2 TRP 95 2HZ TRP 95 -6.718 -2.092 0.045 662 HZ3 TRP 95 3HZ TRP 95 -4.506 1.226 -1.552 663 HH2 TRP 95 HH TRP 95 -5.042 -1.193 -1.576 664 H VAL 96 H VAL 96 -5.187 2.885 5.459 665 HA VAL 96 HA VAL 96 -4.428 5.710 5.203 666 HB VAL 96 HB VAL 96 -3.426 4.074 7.536 667 HG11 VAL 96 1HG1 VAL 96 -2.573 6.190 8.336 668 HG12 VAL 96 2HG1 VAL 96 -2.020 5.926 6.694 669 HG13 VAL 96 3HG1 VAL 96 -3.339 7.068 6.984 670 HG21 VAL 96 3HG2 VAL 96 -4.812 5.420 9.072 671 HG22 VAL 96 1HG2 VAL 96 -5.667 6.136 7.683 672 HG23 VAL 96 2HG2 VAL 96 -5.808 4.405 8.036 673 H VAL 97 H VAL 97 -2.449 5.810 4.106 674 HA VAL 97 HA VAL 97 -1.124 3.243 3.505 675 HB VAL 97 HB VAL 97 -1.182 4.164 1.121 676 HG11 VAL 97 1HG1 VAL 97 -2.343 2.158 1.902 677 HG12 VAL 97 2HG1 VAL 97 -3.777 3.139 2.292 678 HG13 VAL 97 3HG1 VAL 97 -3.212 2.986 0.612 679 HG21 VAL 97 3HG2 VAL 97 -2.168 6.402 1.691 680 HG22 VAL 97 1HG2 VAL 97 -3.032 5.534 0.425 681 HG23 VAL 97 2HG2 VAL 97 -3.704 5.598 2.065 682 H THR 98 H THR 98 0.356 4.072 5.109 683 HA THR 98 HA THR 98 1.656 6.658 4.557 684 HB THR 98 HB THR 98 2.323 4.678 6.758 685 HG1 THR 98 1HG THR 98 0.192 5.046 6.999 686 HG21 THR 98 3HG2 THR 98 2.497 7.726 6.602 687 HG22 THR 98 1HG2 THR 98 3.871 6.603 6.474 688 HG23 THR 98 2HG2 THR 98 2.963 6.728 7.990 689 H VAL 99 H VAL 99 3.762 6.814 3.824 690 HA VAL 99 HA VAL 99 5.027 4.288 2.897 691 HB VAL 99 HB VAL 99 5.288 7.060 1.673 692 HG11 VAL 99 1HG1 VAL 99 7.178 5.634 1.280 693 HG12 VAL 99 2HG1 VAL 99 6.109 4.332 0.711 694 HG13 VAL 99 3HG1 VAL 99 6.251 5.839 -0.208 695 HG21 VAL 99 3HG2 VAL 99 3.497 4.712 0.943 696 HG22 VAL 99 1HG2 VAL 99 2.953 6.335 1.372 697 HG23 VAL 99 2HG2 VAL 99 3.819 6.077 -0.149 698 H TYR 100 H TYR 100 6.824 3.787 3.977 699 HA TYR 100 HA TYR 100 8.433 5.990 5.133 700 HB2 TYR 100 1HB TYR 100 8.493 3.028 5.884 701 HB3 TYR 100 2HB TYR 100 9.493 4.307 6.498 702 HD1 TYR 100 1HD TYR 100 5.882 3.223 6.388 703 HD2 TYR 100 2HD TYR 100 8.863 5.662 8.328 704 HE1 TYR 100 1HE TYR 100 4.212 3.928 8.080 705 HE2 TYR 100 2HE TYR 100 7.199 6.376 9.998 706 HH TYR 100 HH TYR 100 4.708 6.714 10.002 707 H LYS 101 H LYS 101 10.632 5.778 4.869 708 HA LYS 101 HA LYS 101 11.711 4.413 2.488 709 HB2 LYS 101 1HB LYS 101 11.306 6.880 2.374 710 HB3 LYS 101 2HB LYS 101 12.500 7.105 3.653 711 HG2 LYS 101 1HG LYS 101 14.247 6.120 2.207 712 HG3 LYS 101 2HG LYS 101 12.988 5.504 1.130 713 HD2 LYS 101 1HD LYS 101 13.517 7.218 -0.116 714 HD3 LYS 101 2HD LYS 101 12.394 8.110 0.880 715 HE2 LYS 101 1HE LYS 101 15.437 8.036 1.142 716 HE3 LYS 101 2HE LYS 101 14.461 9.383 0.547 717 HZ1 LYS 101 3HZ LYS 101 13.661 9.785 2.736 718 HZ2 LYS 101 1HZ LYS 101 15.273 9.577 2.855 719 HZ3 LYS 101 2HZ LYS 101 14.321 8.383 3.336 720 H ASN 102 H ASN 102 14.134 4.103 3.006 721 HA ASN 102 HA ASN 102 14.919 2.573 4.972 722 HB2 ASN 102 1HB ASN 102 17.058 2.804 4.443 723 HB3 ASN 102 2HB ASN 102 16.186 3.144 2.974 724 HD21 ASN 102 1HD2 ASN 102 16.326 5.395 2.071 725 HD22 ASN 102 2HD2 ASN 102 17.755 6.298 2.543 726 H GLY 103 H GLY 103 13.886 3.386 6.823 727 HA2 GLY 103 1HA GLY 103 13.700 4.319 8.977 728 HA3 GLY 103 2HA GLY 103 15.386 4.819 8.864 729 H LYS 104 H LYS 104 12.302 5.804 7.150 730 HA LYS 104 HA LYS 104 11.844 7.787 8.920 731 HB2 LYS 104 1HB LYS 104 13.571 8.822 6.857 732 HB3 LYS 104 2HB LYS 104 11.991 9.561 6.646 733 HG2 LYS 104 1HG LYS 104 13.335 9.431 9.372 734 HG3 LYS 104 2HG LYS 104 13.672 10.729 8.242 735 HD2 LYS 104 1HD LYS 104 10.846 10.021 9.047 736 HD3 LYS 104 2HD LYS 104 11.826 11.106 10.013 737 HE2 LYS 104 1HE LYS 104 11.896 12.772 8.398 738 HE3 LYS 104 2HE LYS 104 11.511 11.675 7.061 739 HZ1 LYS 104 3HZ LYS 104 9.552 12.204 9.172 740 HZ2 LYS 104 1HZ LYS 104 9.314 11.616 7.629 741 HZ3 LYS 104 2HZ LYS 104 9.658 13.196 7.873 742 H GLU 105 H GLU 105 9.750 8.741 8.549 743 HA GLU 105 HA GLU 105 7.987 7.533 6.544 744 HB2 GLU 105 1HB GLU 105 7.500 8.416 8.974 745 HB3 GLU 105 2HB GLU 105 7.437 10.006 8.221 746 HG2 GLU 105 1HG GLU 105 5.636 9.220 6.713 747 HG3 GLU 105 2HG GLU 105 5.757 7.595 7.389 748 H ILE 106 H ILE 106 7.348 8.557 4.540 749 HA ILE 106 HA ILE 106 8.372 11.308 4.035 750 HB ILE 106 HB ILE 106 8.971 10.587 1.777 751 HG12 ILE 106 1HG1 ILE 106 8.891 7.664 2.559 752 HG13 ILE 106 2HG1 ILE 106 7.388 8.422 2.042 753 HG21 ILE 106 1HG2 ILE 106 10.688 10.692 3.553 754 HG22 ILE 106 2HG2 ILE 106 10.471 8.954 3.861 755 HG23 ILE 106 3HG2 ILE 106 11.070 9.513 2.284 756 HD11 ILE 106 3HD1 ILE 106 8.386 9.161 -0.049 757 HD12 ILE 106 1HD1 ILE 106 9.937 8.411 0.408 758 HD13 ILE 106 2HD1 ILE 106 8.490 7.405 0.148 759 H GLU 107 H GLU 107 5.540 9.683 4.428 760 HA GLU 107 HA GLU 107 4.104 11.416 2.538 761 HB2 GLU 107 1HB GLU 107 4.663 9.334 1.259 762 HB3 GLU 107 2HB GLU 107 3.956 8.384 2.566 763 HG2 GLU 107 1HG GLU 107 2.500 8.438 0.695 764 HG3 GLU 107 2HG GLU 107 1.722 9.214 2.056 765 H LYS 108 H LYS 108 1.724 11.386 3.133 766 HA LYS 108 HA LYS 108 0.896 9.609 5.228 767 HB2 LYS 108 1HB LYS 108 2.091 11.576 6.491 768 HB3 LYS 108 2HB LYS 108 0.663 12.514 6.100 769 HG2 LYS 108 1HG LYS 108 -0.689 10.549 7.113 770 HG3 LYS 108 2HG LYS 108 0.879 9.909 7.661 771 HD2 LYS 108 1HD LYS 108 1.234 12.190 8.805 772 HD3 LYS 108 2HD LYS 108 -0.452 12.535 8.448 773 HE2 LYS 108 1HE LYS 108 0.712 10.362 10.223 774 HE3 LYS 108 2HE LYS 108 -0.367 11.685 10.682 775 HZ1 LYS 108 3HZ LYS 108 -2.044 10.541 9.195 776 HZ2 LYS 108 1HZ LYS 108 -1.660 9.755 10.600 777 HZ3 LYS 108 2HZ LYS 108 -1.012 9.230 9.199 778 H LYS 109 H LYS 109 -0.654 9.040 3.529 779 HA LYS 109 HA LYS 109 -2.959 10.897 3.630 780 HB2 LYS 109 1HB LYS 109 -3.680 10.109 1.377 781 HB3 LYS 109 2HB LYS 109 -2.334 11.220 1.369 782 HG2 LYS 109 1HG LYS 109 -0.889 9.773 0.491 783 HG3 LYS 109 2HG LYS 109 -1.456 8.416 1.434 784 HD2 LYS 109 1HD LYS 109 -2.095 7.635 -0.587 785 HD3 LYS 109 2HD LYS 109 -3.569 8.516 -0.215 786 HE2 LYS 109 1HE LYS 109 -1.260 9.283 -2.064 787 HE3 LYS 109 2HE LYS 109 -2.927 8.888 -2.509 788 HZ1 LYS 109 3HZ LYS 109 -2.713 11.153 -2.657 789 HZ2 LYS 109 1HZ LYS 109 -2.007 11.342 -1.166 790 HZ3 LYS 109 2HZ LYS 109 -3.609 10.896 -1.319 791 H SER 110 H SER 110 -4.998 9.938 3.608 792 HA SER 110 HA SER 110 -5.331 7.107 3.878 793 HB2 SER 110 1HB SER 110 -6.942 8.163 5.803 794 HB3 SER 110 2HB SER 110 -5.293 7.570 6.049 795 HG SER 110 HG SER 110 -5.943 10.285 5.719 796 H LEU 111 H LEU 111 -7.762 6.703 3.679 797 HA LEU 111 HA LEU 111 -9.036 8.686 1.860 798 HB2 LEU 111 1HB LEU 111 -9.154 5.683 1.466 799 HB3 LEU 111 2HB LEU 111 -9.791 6.945 0.409 800 HG LEU 111 HG LEU 111 -6.836 6.330 0.861 801 HD11 LEU 111 1HD1 LEU 111 -8.700 5.772 -1.485 802 HD12 LEU 111 2HD1 LEU 111 -8.029 4.566 -0.356 803 HD13 LEU 111 3HD1 LEU 111 -6.953 5.459 -1.445 804 HD21 LEU 111 3HD2 LEU 111 -8.158 8.270 -1.092 805 HD22 LEU 111 1HD2 LEU 111 -6.435 7.815 -1.081 806 HD23 LEU 111 2HD2 LEU 111 -7.122 8.709 0.280 807 H VAL 112 H VAL 112 -11.412 8.492 1.881 808 HA VAL 112 HA VAL 112 -12.523 6.931 4.109 809 HB VAL 112 HB VAL 112 -12.004 9.068 5.052 810 HG11 VAL 112 1HG1 VAL 112 -13.075 11.186 4.250 811 HG12 VAL 112 2HG1 VAL 112 -11.807 10.570 3.177 812 HG13 VAL 112 3HG1 VAL 112 -13.516 10.364 2.754 813 HG21 VAL 112 3HG2 VAL 112 -14.200 9.751 5.842 814 HG22 VAL 112 1HG2 VAL 112 -14.995 8.965 4.467 815 HG23 VAL 112 2HG2 VAL 112 -14.149 7.994 5.688 816 H PHE 113 H PHE 113 -14.368 5.950 3.576 817 HA PHE 113 HA PHE 113 -15.912 6.937 1.271 818 HB2 PHE 113 1HB PHE 113 -14.806 4.149 1.728 819 HB3 PHE 113 2HB PHE 113 -16.185 4.455 0.686 820 HD1 PHE 113 1HD PHE 113 -15.979 5.947 -1.320 821 HD2 PHE 113 2HD PHE 113 -12.529 4.812 0.988 822 HE1 PHE 113 1HE PHE 113 -14.469 6.705 -3.154 823 HE2 PHE 113 2HE PHE 113 -11.053 5.457 -0.893 824 HZ PHE 113 HZ PHE 113 -12.031 6.402 -2.963 825 H ARG 114 H ARG 114 -18.009 5.599 1.281 826 HA ARG 114 HA ARG 114 -19.240 5.823 3.994 827 HB2 ARG 114 1HB ARG 114 -20.261 7.040 1.439 828 HB3 ARG 114 2HB ARG 114 -20.937 7.184 3.068 829 HG2 ARG 114 1HG ARG 114 -18.625 8.277 3.665 830 HG3 ARG 114 2HG ARG 114 -18.495 8.536 1.928 831 HD2 ARG 114 1HD ARG 114 -20.446 9.662 3.923 832 HD3 ARG 114 2HD ARG 114 -19.481 10.531 2.710 833 HE ARG 114 HE ARG 114 -21.118 9.035 1.149 834 HH11 ARG 114 1HH1 ARG 114 -21.932 11.159 3.894 835 HH12 ARG 114 2HH1 ARG 114 -23.624 11.171 3.553 836 HH21 ARG 114 1HH2 ARG 114 -23.223 8.971 0.753 837 HH22 ARG 114 2HH2 ARG 114 -24.428 9.887 1.595 838 H ASP 115 H ASP 115 -18.648 3.715 1.750 839 HA ASP 115 HA ASP 115 -19.514 1.935 0.663 840 HB2 ASP 115 1HB ASP 115 -20.489 1.157 2.680 841 HB3 ASP 115 2HB ASP 115 -21.795 2.321 2.606 842 H GLY 116 H GLY 116 -21.377 1.297 -0.868 843 HA2 GLY 116 1HA GLY 116 -22.439 1.662 -2.826 844 HA3 GLY 116 2HA GLY 116 -23.322 2.829 -1.847 845 H LYS 117 H LYS 117 -20.169 2.740 -3.644 846 HA LYS 117 HA LYS 117 -20.898 5.105 -5.091 847 HB2 LYS 117 1HB LYS 117 -19.426 5.393 -2.575 848 HB3 LYS 117 2HB LYS 117 -18.496 6.062 -3.896 849 HG2 LYS 117 1HG LYS 117 -21.396 6.804 -3.276 850 HG3 LYS 117 2HG LYS 117 -19.974 7.690 -2.686 851 HD2 LYS 117 1HD LYS 117 -19.197 8.077 -4.980 852 HD3 LYS 117 2HD LYS 117 -20.565 7.166 -5.629 853 HE2 LYS 117 1HE LYS 117 -22.105 8.836 -4.501 854 HE3 LYS 117 2HE LYS 117 -20.658 9.817 -4.152 855 HZ1 LYS 117 3HZ LYS 117 -20.223 9.745 -6.571 856 HZ2 LYS 117 1HZ LYS 117 -21.667 10.495 -6.239 857 HZ3 LYS 117 2HZ LYS 117 -21.630 8.953 -6.802 858 H GLU 118 H GLU 118 -20.128 4.717 -7.011 859 HA GLU 118 HA GLU 118 -17.771 3.476 -7.849 860 HB2 GLU 118 1HB GLU 118 -18.063 4.776 -9.897 861 HB3 GLU 118 2HB GLU 118 -19.654 4.287 -9.297 862 HG2 GLU 118 1HG GLU 118 -19.851 6.583 -8.213 863 HG3 GLU 118 2HG GLU 118 -18.328 7.027 -8.971 864 H ILE 119 H ILE 119 -15.756 4.544 -8.710 865 HA ILE 119 HA ILE 119 -14.957 7.071 -7.468 866 HB ILE 119 HB ILE 119 -12.935 6.318 -6.574 867 HG12 ILE 119 1HG1 ILE 119 -12.709 3.641 -6.460 868 HG13 ILE 119 2HG1 ILE 119 -13.474 3.742 -8.034 869 HG21 ILE 119 1HG2 ILE 119 -15.011 4.321 -5.601 870 HG22 ILE 119 2HG2 ILE 119 -13.628 4.983 -4.717 871 HG23 ILE 119 3HG2 ILE 119 -14.983 6.042 -5.181 872 HD11 ILE 119 3HD1 ILE 119 -11.633 5.234 -8.806 873 HD12 ILE 119 1HD1 ILE 119 -10.918 5.186 -7.185 874 HD13 ILE 119 2HD1 ILE 119 -10.996 3.709 -8.164 875 H SER 120 H SER 120 -13.101 7.998 -8.565 876 HA SER 120 HA SER 120 -12.000 6.795 -10.952 877 HB2 SER 120 1HB SER 120 -14.460 7.779 -11.380 878 HB3 SER 120 2HB SER 120 -13.573 9.285 -11.557 879 HG SER 120 HG SER 120 -14.004 7.668 -13.367 880 H THR 121 H THR 121 -11.075 8.073 -8.404 881 HA THR 121 HA THR 121 -9.940 10.664 -9.253 882 HB THR 121 HB THR 121 -9.763 10.855 -6.736 883 HG1 THR 121 1HG THR 121 -10.422 9.291 -5.530 884 HG21 THR 121 3HG2 THR 121 -12.589 10.416 -7.809 885 HG22 THR 121 1HG2 THR 121 -11.626 11.897 -8.009 886 HG23 THR 121 2HG2 THR 121 -12.123 11.378 -6.391 887 H ASP 122 H ASP 122 -7.733 11.104 -8.102 888 HA ASP 122 HA ASP 122 -5.885 8.971 -8.886 889 HB2 ASP 122 1HB ASP 122 -5.393 11.790 -7.910 890 HB3 ASP 122 2HB ASP 122 -4.126 10.656 -8.338 891 H ASP 123 H ASP 123 -7.643 8.498 -6.658 892 HA ASP 123 HA ASP 123 -6.750 9.158 -4.092 893 HB2 ASP 123 1HB ASP 123 -8.449 6.947 -5.251 894 HB3 ASP 123 2HB ASP 123 -7.838 6.718 -3.628 895 H LEU 124 H LEU 124 -5.730 6.391 -6.157 896 HA LEU 124 HA LEU 124 -3.384 6.085 -4.417 897 HB2 LEU 124 1HB LEU 124 -5.586 4.250 -4.391 898 HB3 LEU 124 2HB LEU 124 -4.365 3.543 -5.416 899 HG LEU 124 HG LEU 124 -4.197 2.796 -3.101 900 HD11 LEU 124 1HD1 LEU 124 -2.180 2.841 -4.522 901 HD12 LEU 124 2HD1 LEU 124 -1.833 3.020 -2.792 902 HD13 LEU 124 3HD1 LEU 124 -1.746 4.432 -3.879 903 HD21 LEU 124 3HD2 LEU 124 -3.452 4.175 -1.312 904 HD22 LEU 124 1HD2 LEU 124 -4.878 4.962 -2.024 905 HD23 LEU 124 2HD2 LEU 124 -3.262 5.589 -2.370 906 H ASN 125 H ASN 125 -2.246 7.028 -5.844 907 HA ASN 125 HA ASN 125 -1.364 5.468 -8.108 908 HB2 ASN 125 1HB ASN 125 -3.334 6.914 -9.003 909 HB3 ASN 125 2HB ASN 125 -2.175 8.247 -9.001 910 HD21 ASN 125 1HD2 ASN 125 -0.004 7.739 -10.186 911 HD22 ASN 125 2HD2 ASN 125 0.056 6.352 -11.289 912 H LEU 126 H LEU 126 0.496 5.370 -6.855 913 HA LEU 126 HA LEU 126 2.128 7.832 -6.526 914 HB2 LEU 126 1HB LEU 126 1.340 5.627 -4.707 915 HB3 LEU 126 2HB LEU 126 3.079 5.750 -4.873 916 HG LEU 126 HG LEU 126 2.922 8.200 -4.327 917 HD11 LEU 126 1HD1 LEU 126 0.863 9.069 -3.342 918 HD12 LEU 126 2HD1 LEU 126 0.022 7.525 -3.618 919 HD13 LEU 126 3HD1 LEU 126 0.552 8.551 -4.985 920 HD21 LEU 126 3HD2 LEU 126 3.473 6.355 -2.726 921 HD22 LEU 126 1HD2 LEU 126 1.779 6.298 -2.240 922 HD23 LEU 126 2HD2 LEU 126 2.780 7.780 -1.968 923 H TYR 127 H TYR 127 4.211 7.801 -7.017 924 HA TYR 127 HA TYR 127 5.587 5.395 -7.940 925 HB2 TYR 127 1HB TYR 127 4.307 7.204 -9.747 926 HB3 TYR 127 2HB TYR 127 6.018 7.536 -9.844 927 HD1 TYR 127 2HD TYR 127 7.589 5.515 -10.392 928 HD2 TYR 127 1HD TYR 127 3.295 5.321 -10.709 929 HE1 TYR 127 2HE TYR 127 7.799 3.438 -11.695 930 HE2 TYR 127 1HE TYR 127 3.474 3.272 -12.068 931 HH TYR 127 HH TYR 127 6.629 1.620 -12.678 932 H TYR 128 H TYR 128 7.307 5.512 -6.606 933 HA TYR 128 HA TYR 128 8.639 8.153 -6.134 934 HB2 TYR 128 1HB TYR 128 8.269 5.717 -4.419 935 HB3 TYR 128 2HB TYR 128 9.550 6.793 -4.065 936 HD1 TYR 128 1HD TYR 128 8.692 9.465 -4.128 937 HD2 TYR 128 2HD TYR 128 6.425 6.019 -2.875 938 HE1 TYR 128 1HE TYR 128 7.248 10.919 -2.728 939 HE2 TYR 128 2HE TYR 128 5.023 7.494 -1.420 940 HH TYR 128 HH TYR 128 4.270 9.972 -1.294 941 H ASN 129 H ASN 129 10.424 8.171 -7.237 942 HA ASN 129 HA ASN 129 12.284 5.969 -7.349 943 HB2 ASN 129 1HB ASN 129 12.320 5.357 -9.587 944 HB3 ASN 129 2HB ASN 129 10.623 5.336 -9.178 945 HD21 ASN 129 1HD2 ASN 129 12.240 5.716 -11.718 946 HD22 ASN 129 2HD2 ASN 129 11.465 7.036 -12.549 Start of MODEL 5 1 H1 GLY 1 H GLY 1 31.194 -16.722 -7.306 2 HA2 GLY 1 1HA GLY 1 33.177 -16.089 -6.039 3 HA3 GLY 1 2HA GLY 1 33.894 -15.501 -7.574 4 H ASP 2 H ASP 2 32.943 -14.028 -4.897 5 HA ASP 2 HA ASP 2 31.283 -11.988 -6.132 6 HB2 ASP 2 1HB ASP 2 29.682 -13.657 -5.258 7 HB3 ASP 2 2HB ASP 2 30.550 -13.713 -3.720 8 H ASP 3 H ASP 3 32.362 -10.155 -5.533 9 HA ASP 3 HA ASP 3 34.024 -9.975 -3.130 10 HB2 ASP 3 1HB ASP 3 35.328 -11.324 -4.811 11 HB3 ASP 3 2HB ASP 3 35.194 -9.999 -5.961 12 H ASP 4 H ASP 4 32.486 -8.282 -2.744 13 HA ASP 4 HA ASP 4 32.382 -5.903 -4.464 14 HB2 ASP 4 1HB ASP 4 30.298 -8.092 -4.275 15 HB3 ASP 4 2HB ASP 4 29.731 -6.439 -4.299 16 H GLU 5 H GLU 5 31.471 -4.155 -3.197 17 HA GLU 5 HA GLU 5 29.777 -4.713 -0.937 18 HB2 GLU 5 1HB GLU 5 31.012 -3.344 0.702 19 HB3 GLU 5 2HB GLU 5 31.697 -4.939 0.386 20 HG2 GLU 5 1HG GLU 5 33.612 -4.068 -0.662 21 HG3 GLU 5 2HG GLU 5 32.865 -2.497 -1.000 22 HA PRO 6 HA PRO 6 29.178 -0.974 -3.590 23 HB2 PRO 6 1HB PRO 6 26.499 -1.283 -4.147 24 HB3 PRO 6 2HB PRO 6 27.860 -1.959 -5.075 25 HG2 PRO 6 1HG PRO 6 26.173 -3.328 -2.948 26 HG3 PRO 6 2HG PRO 6 26.660 -3.955 -4.564 27 HD2 PRO 6 1HD PRO 6 28.002 -4.627 -2.295 28 HD3 PRO 6 2HD PRO 6 28.866 -4.351 -3.840 29 H GLY 7 H GLY 7 28.753 0.940 -2.846 30 HA2 GLY 7 1HA GLY 7 27.755 1.403 -0.170 31 HA3 GLY 7 2HA GLY 7 28.393 2.605 -1.306 32 H GLY 8 H GLY 8 26.899 3.904 -2.439 33 HA2 GLY 8 1HA GLY 8 25.113 3.955 -3.979 34 HA3 GLY 8 2HA GLY 8 24.223 2.788 -3.008 35 H LYS 9 H LYS 9 23.193 5.358 -3.923 36 HA LYS 9 HA LYS 9 22.738 6.705 -1.365 37 HB2 LYS 9 1HB LYS 9 23.143 7.974 -4.093 38 HB3 LYS 9 2HB LYS 9 22.681 8.821 -2.614 39 HG2 LYS 9 1HG LYS 9 24.830 8.116 -1.556 40 HG3 LYS 9 2HG LYS 9 25.268 7.295 -3.062 41 HD2 LYS 9 1HD LYS 9 25.147 9.479 -4.271 42 HD3 LYS 9 2HD LYS 9 24.894 10.272 -2.700 43 HE2 LYS 9 1HE LYS 9 27.023 9.210 -1.870 44 HE3 LYS 9 2HE LYS 9 27.248 8.487 -3.471 45 HZ1 LYS 9 3HZ LYS 9 28.555 10.353 -3.435 46 HZ2 LYS 9 1HZ LYS 9 27.417 11.347 -2.768 47 HZ3 LYS 9 2HZ LYS 9 27.300 10.818 -4.336 48 H GLY 10 H GLY 10 20.688 7.023 -1.015 49 HA2 GLY 10 1HA GLY 10 18.438 7.490 -2.630 50 HA3 GLY 10 2HA GLY 10 18.560 5.738 -2.388 51 H ALA 11 H ALA 11 17.190 5.171 -0.744 52 HA ALA 11 HA ALA 11 17.607 6.256 1.914 53 HB1 ALA 11 1HB ALA 11 15.301 7.020 2.313 54 HB2 ALA 11 2HB ALA 11 15.978 7.928 0.969 55 HB3 ALA 11 3HB ALA 11 14.838 6.609 0.653 56 H MET 12 H MET 12 15.024 5.164 2.826 57 HA MET 12 HA MET 12 14.757 2.474 1.886 58 HB2 MET 12 1HB MET 12 14.510 3.290 4.848 59 HB3 MET 12 2HB MET 12 14.080 1.745 4.144 60 HG2 MET 12 1HG MET 12 16.531 1.693 3.323 61 HG3 MET 12 2HG MET 12 16.845 2.953 4.472 62 HE1 MET 12 3HE MET 12 15.584 -1.364 5.552 63 HE2 MET 12 1HE MET 12 14.370 -0.144 5.124 64 HE3 MET 12 2HE MET 12 15.586 -0.632 3.928 65 H TYR 13 H TYR 13 12.370 1.967 2.239 66 HA TYR 13 HA TYR 13 10.747 4.256 3.064 67 HB2 TYR 13 1HB TYR 13 10.288 2.738 0.491 68 HB3 TYR 13 2HB TYR 13 9.101 3.788 1.273 69 HD1 TYR 13 1HD TYR 13 10.154 6.246 1.932 70 HD2 TYR 13 2HD TYR 13 11.311 3.710 -1.334 71 HE1 TYR 13 1HE TYR 13 11.038 8.201 0.735 72 HE2 TYR 13 2HE TYR 13 12.093 5.688 -2.633 73 HH TYR 13 HH TYR 13 12.551 8.071 -2.520 74 H GLU 14 H GLU 14 8.773 3.654 3.935 75 HA GLU 14 HA GLU 14 8.132 0.817 4.336 76 HB2 GLU 14 1HB GLU 14 9.605 1.105 6.080 77 HB3 GLU 14 2HB GLU 14 9.151 2.779 6.401 78 HG2 GLU 14 1HG GLU 14 7.012 1.970 7.405 79 HG3 GLU 14 2HG GLU 14 7.537 0.290 7.130 80 H VAL 15 H VAL 15 5.975 0.648 4.085 81 HA VAL 15 HA VAL 15 4.361 3.142 4.057 82 HB VAL 15 HB VAL 15 5.095 2.525 1.815 83 HG11 VAL 15 1HG1 VAL 15 5.373 0.065 2.064 84 HG12 VAL 15 2HG1 VAL 15 3.607 -0.118 2.154 85 HG13 VAL 15 3HG1 VAL 15 4.367 0.485 0.673 86 HG21 VAL 15 3HG2 VAL 15 2.959 2.530 0.693 87 HG22 VAL 15 1HG2 VAL 15 2.143 1.917 2.146 88 HG23 VAL 15 2HG2 VAL 15 2.874 3.526 2.165 89 H THR 16 H THR 16 2.178 2.941 4.734 90 HA THR 16 HA THR 16 1.390 0.260 5.750 91 HB THR 16 HB THR 16 0.128 1.458 7.505 92 HG1 THR 16 1HG THR 16 0.289 3.543 7.837 93 HG21 THR 16 3HG2 THR 16 3.068 2.271 7.570 94 HG22 THR 16 1HG2 THR 16 2.391 0.723 8.108 95 HG23 THR 16 2HG2 THR 16 1.958 2.205 8.955 96 H ILE 17 H ILE 17 -0.765 -0.270 5.767 97 HA ILE 17 HA ILE 17 -2.592 1.643 4.532 98 HB ILE 17 HB ILE 17 -1.948 0.394 2.691 99 HG12 ILE 17 1HG1 ILE 17 -3.972 -0.846 1.960 100 HG13 ILE 17 2HG1 ILE 17 -4.456 -1.060 3.637 101 HG21 ILE 17 1HG2 ILE 17 -2.350 -2.226 4.073 102 HG22 ILE 17 2HG2 ILE 17 -1.945 -2.002 2.372 103 HG23 ILE 17 3HG2 ILE 17 -0.781 -1.510 3.600 104 HD11 ILE 17 3HD1 ILE 17 -5.826 0.618 2.723 105 HD12 ILE 17 1HD1 ILE 17 -4.711 1.471 3.791 106 HD13 ILE 17 2HD1 ILE 17 -4.449 1.501 2.024 107 H GLU 18 H GLU 18 -3.449 2.066 6.548 108 HA GLU 18 HA GLU 18 -4.648 -0.173 8.075 109 HB2 GLU 18 1HB GLU 18 -4.484 2.828 8.389 110 HB3 GLU 18 2HB GLU 18 -5.802 1.923 9.150 111 HG2 GLU 18 1HG GLU 18 -3.974 0.412 10.148 112 HG3 GLU 18 2HG GLU 18 -2.826 1.667 9.669 113 H GLN 19 H GLN 19 -6.639 -0.867 7.699 114 HA GLN 19 HA GLN 19 -8.307 0.393 5.593 115 HB2 GLN 19 1HB GLN 19 -7.802 -2.477 6.476 116 HB3 GLN 19 2HB GLN 19 -9.266 -1.974 5.623 117 HG2 GLN 19 1HG GLN 19 -8.057 -1.307 3.679 118 HG3 GLN 19 2HG GLN 19 -6.553 -1.170 4.566 119 HE21 GLN 19 1HE2 GLN 19 -8.427 -4.227 4.913 120 HE22 GLN 19 2HE2 GLN 19 -7.340 -5.119 3.888 121 H SER 20 H SER 20 -9.866 1.567 6.558 122 HA SER 20 HA SER 20 -10.774 0.820 9.224 123 HB2 SER 20 1HB SER 20 -11.838 3.057 7.447 124 HB3 SER 20 2HB SER 20 -11.750 3.044 9.212 125 HG SER 20 HG SER 20 -9.492 3.306 9.050 126 H GLY 21 H GLY 21 -13.308 1.179 9.471 127 HA2 GLY 21 1HA GLY 21 -15.466 0.583 8.978 128 HA3 GLY 21 2HA GLY 21 -15.030 1.084 7.352 129 H ASP 22 H ASP 22 -15.940 -0.373 6.009 130 HA ASP 22 HA ASP 22 -16.325 -3.070 6.964 131 HB2 ASP 22 1HB ASP 22 -17.990 -1.251 5.943 132 HB3 ASP 22 2HB ASP 22 -17.623 -2.081 4.497 133 H PHE 23 H PHE 23 -13.721 -2.752 6.243 134 HA PHE 23 HA PHE 23 -12.940 -2.914 3.681 135 HB2 PHE 23 1HB PHE 23 -10.728 -3.494 4.541 136 HB3 PHE 23 2HB PHE 23 -11.544 -2.294 5.520 137 HD1 PHE 23 1HD PHE 23 -10.767 -5.996 5.448 138 HD2 PHE 23 2HD PHE 23 -11.714 -2.511 7.837 139 HE1 PHE 23 1HE PHE 23 -10.255 -7.250 7.505 140 HE2 PHE 23 2HE PHE 23 -11.146 -3.763 9.877 141 HZ PHE 23 HZ PHE 23 -10.381 -6.143 9.716 142 H ARG 24 H ARG 24 -14.717 -5.402 4.431 143 HA ARG 24 HA ARG 24 -12.840 -7.583 3.786 144 HB2 ARG 24 1HB ARG 24 -14.392 -8.851 5.254 145 HB3 ARG 24 2HB ARG 24 -13.335 -7.665 5.974 146 HG2 ARG 24 1HG ARG 24 -15.515 -7.688 6.976 147 HG3 ARG 24 2HG ARG 24 -15.144 -6.112 6.287 148 HD2 ARG 24 1HD ARG 24 -16.553 -6.674 4.298 149 HD3 ARG 24 2HD ARG 24 -16.997 -8.222 5.059 150 HE ARG 24 HE ARG 24 -18.069 -5.596 5.495 151 HH11 ARG 24 1HH1 ARG 24 -17.857 -8.854 6.927 152 HH12 ARG 24 2HH1 ARG 24 -19.025 -8.475 8.154 153 HH21 ARG 24 1HH2 ARG 24 -19.391 -5.114 7.198 154 HH22 ARG 24 2HH2 ARG 24 -20.112 -6.389 8.169 155 H SER 25 H SER 25 -14.872 -5.977 1.933 156 HA SER 25 HA SER 25 -15.977 -8.365 0.564 157 HB2 SER 25 1HB SER 25 -17.620 -6.050 1.707 158 HB3 SER 25 2HB SER 25 -18.229 -7.310 0.618 159 HG SER 25 HG SER 25 -17.281 -8.779 2.328 160 H PHE 26 H PHE 26 -13.900 -6.290 -0.223 161 HA PHE 26 HA PHE 26 -15.207 -5.284 -2.684 162 HB2 PHE 26 1HB PHE 26 -13.402 -3.558 -0.971 163 HB3 PHE 26 2HB PHE 26 -14.204 -3.113 -2.471 164 HD1 PHE 26 2HD PHE 26 -16.948 -3.545 -2.334 165 HD2 PHE 26 1HD PHE 26 -14.311 -2.704 0.969 166 HE1 PHE 26 2HE PHE 26 -18.878 -2.757 -0.978 167 HE2 PHE 26 1HE PHE 26 -16.249 -1.876 2.306 168 HZ PHE 26 HZ PHE 26 -18.530 -1.914 1.325 169 H ILE 27 H ILE 27 -13.864 -5.844 -4.429 170 HA ILE 27 HA ILE 27 -11.456 -7.280 -3.891 171 HB ILE 27 HB ILE 27 -11.909 -6.209 -6.670 172 HG12 ILE 27 1HG1 ILE 27 -13.275 -8.523 -6.868 173 HG13 ILE 27 2HG1 ILE 27 -13.831 -8.026 -5.281 174 HG21 ILE 27 1HG2 ILE 27 -9.924 -7.593 -6.095 175 HG22 ILE 27 2HG2 ILE 27 -10.997 -8.906 -5.573 176 HG23 ILE 27 3HG2 ILE 27 -10.964 -8.384 -7.272 177 HD11 ILE 27 3HD1 ILE 27 -14.456 -5.780 -6.344 178 HD12 ILE 27 1HD1 ILE 27 -13.983 -6.460 -7.912 179 HD13 ILE 27 2HD1 ILE 27 -15.324 -7.172 -7.027 180 H LYS 28 H LYS 28 -9.923 -6.054 -2.775 181 HA LYS 28 HA LYS 28 -8.894 -3.600 -4.081 182 HB2 LYS 28 1HB LYS 28 -7.330 -3.454 -2.176 183 HB3 LYS 28 2HB LYS 28 -9.018 -3.360 -1.721 184 HG2 LYS 28 1HG LYS 28 -7.891 -6.105 -1.599 185 HG3 LYS 28 2HG LYS 28 -7.131 -4.933 -0.535 186 HD2 LYS 28 1HD LYS 28 -9.156 -4.445 0.619 187 HD3 LYS 28 2HD LYS 28 -10.126 -5.187 -0.651 188 HE2 LYS 28 1HE LYS 28 -8.921 -7.408 -0.025 189 HE3 LYS 28 2HE LYS 28 -8.438 -6.570 1.455 190 HZ1 LYS 28 3HZ LYS 28 -10.840 -6.202 1.886 191 HZ2 LYS 28 1HZ LYS 28 -10.505 -7.796 1.710 192 HZ3 LYS 28 2HZ LYS 28 -11.208 -7.035 0.496 193 H SER 29 H SER 29 -6.755 -3.358 -4.877 194 HA SER 29 HA SER 29 -4.999 -5.680 -4.948 195 HB2 SER 29 1HB SER 29 -5.716 -3.828 -7.267 196 HB3 SER 29 2HB SER 29 -4.504 -5.106 -7.279 197 HG SER 29 HG SER 29 -6.533 -5.721 -8.244 198 H VAL 30 H VAL 30 -2.781 -4.915 -4.897 199 HA VAL 30 HA VAL 30 -2.301 -1.986 -4.819 200 HB VAL 30 HB VAL 30 -1.372 -3.983 -2.701 201 HG11 VAL 30 1HG1 VAL 30 -0.805 -1.014 -3.046 202 HG12 VAL 30 2HG1 VAL 30 -0.445 -1.946 -1.572 203 HG13 VAL 30 3HG1 VAL 30 0.361 -2.357 -3.076 204 HG21 VAL 30 3HG2 VAL 30 -3.711 -3.370 -2.273 205 HG22 VAL 30 1HG2 VAL 30 -2.664 -2.561 -1.107 206 HG23 VAL 30 2HG2 VAL 30 -3.327 -1.647 -2.474 207 H VAL 31 H VAL 31 -0.756 -1.647 -6.374 208 HA VAL 31 HA VAL 31 1.205 -3.760 -7.048 209 HB VAL 31 HB VAL 31 0.438 -2.342 -8.880 210 HG11 VAL 31 1HG1 VAL 31 -0.165 -0.310 -7.847 211 HG12 VAL 31 2HG1 VAL 31 1.528 0.044 -7.378 212 HG13 VAL 31 3HG1 VAL 31 1.046 0.015 -9.084 213 HG21 VAL 31 3HG2 VAL 31 2.895 -3.136 -8.819 214 HG22 VAL 31 1HG2 VAL 31 2.551 -1.744 -9.858 215 HG23 VAL 31 2HG2 VAL 31 3.316 -1.513 -8.282 216 H VAL 32 H VAL 32 3.435 -3.601 -6.383 217 HA VAL 32 HA VAL 32 4.222 -1.103 -5.110 218 HB VAL 32 HB VAL 32 3.741 -2.519 -3.232 219 HG11 VAL 32 1HG1 VAL 32 5.898 -4.369 -4.269 220 HG12 VAL 32 2HG1 VAL 32 5.042 -4.496 -2.714 221 HG13 VAL 32 3HG1 VAL 32 4.152 -4.707 -4.232 222 HG21 VAL 32 3HG2 VAL 32 6.738 -2.049 -3.551 223 HG22 VAL 32 1HG2 VAL 32 5.537 -0.816 -3.102 224 HG23 VAL 32 2HG2 VAL 32 5.819 -2.185 -2.029 225 H VAL 33 H VAL 33 6.105 -0.368 -5.946 226 HA VAL 33 HA VAL 33 7.797 -2.236 -7.529 227 HB VAL 33 HB VAL 33 7.446 0.752 -8.010 228 HG11 VAL 33 1HG1 VAL 33 8.699 0.220 -10.143 229 HG12 VAL 33 2HG1 VAL 33 9.657 0.064 -8.689 230 HG13 VAL 33 3HG1 VAL 33 9.029 -1.401 -9.496 231 HG21 VAL 33 3HG2 VAL 33 6.332 -1.602 -9.610 232 HG22 VAL 33 1HG2 VAL 33 5.395 -0.368 -8.739 233 HG23 VAL 33 2HG2 VAL 33 6.342 0.087 -10.152 234 H ALA 34 H ALA 34 10.106 -1.762 -7.266 235 HA ALA 34 HA ALA 34 10.943 0.221 -5.396 236 HB1 ALA 34 1HB ALA 34 12.282 -1.532 -4.063 237 HB2 ALA 34 2HB ALA 34 10.538 -1.455 -3.713 238 HB3 ALA 34 3HB ALA 34 11.205 -2.754 -4.738 239 H ASN 35 H ASN 35 13.248 0.367 -5.450 240 HA ASN 35 HA ASN 35 14.598 -0.736 -7.887 241 HB2 ASN 35 1HB ASN 35 13.855 1.612 -8.189 242 HB3 ASN 35 2HB ASN 35 14.702 2.070 -6.726 243 HD21 ASN 35 1HD2 ASN 35 15.128 3.028 -9.545 244 HD22 ASN 35 2HD2 ASN 35 16.806 2.674 -9.897 245 H GLY 36 H GLY 36 16.178 -2.013 -7.142 246 HA2 GLY 36 1HA GLY 36 18.373 -2.214 -6.505 247 HA3 GLY 36 2HA GLY 36 18.223 -0.794 -5.476 248 H THR 37 H THR 37 15.672 -2.857 -4.543 249 HA THR 37 HA THR 37 17.168 -4.796 -3.103 250 HB THR 37 HB THR 37 17.497 -2.547 -1.810 251 HG1 THR 37 1HG THR 37 18.133 -4.247 -0.782 252 HG21 THR 37 3HG2 THR 37 14.791 -3.241 -0.660 253 HG22 THR 37 1HG2 THR 37 15.002 -2.009 -1.914 254 HG23 THR 37 2HG2 THR 37 15.822 -1.841 -0.349 255 H GLN 38 H GLN 38 15.422 -5.844 -1.410 256 HA GLN 38 HA GLN 38 13.024 -6.332 -3.109 257 HB2 GLN 38 1HB GLN 38 14.817 -8.069 -1.478 258 HB3 GLN 38 2HB GLN 38 13.094 -8.415 -1.306 259 HG2 GLN 38 1HG GLN 38 12.832 -8.562 -3.747 260 HG3 GLN 38 2HG GLN 38 14.505 -8.149 -3.996 261 HE21 GLN 38 1HE2 GLN 38 12.355 -10.604 -2.604 262 HE22 GLN 38 2HE2 GLN 38 13.462 -11.961 -2.778 263 H LEU 39 H LEU 39 11.194 -7.349 -1.528 264 HA LEU 39 HA LEU 39 10.485 -5.088 0.277 265 HB2 LEU 39 1HB LEU 39 9.034 -6.723 -1.731 266 HB3 LEU 39 2HB LEU 39 8.211 -6.680 -0.212 267 HG LEU 39 HG LEU 39 7.582 -4.952 -1.999 268 HD11 LEU 39 1HD1 LEU 39 7.079 -3.243 -0.291 269 HD12 LEU 39 2HD1 LEU 39 8.205 -4.036 0.836 270 HD13 LEU 39 3HD1 LEU 39 6.740 -4.872 0.276 271 HD21 LEU 39 3HD2 LEU 39 8.766 -2.930 -2.187 272 HD22 LEU 39 1HD2 LEU 39 9.979 -4.211 -2.429 273 HD23 LEU 39 2HD2 LEU 39 9.869 -3.336 -0.862 274 H LYS 40 H LYS 40 9.277 -5.670 2.142 275 HA LYS 40 HA LYS 40 9.728 -8.392 3.242 276 HB2 LYS 40 1HB LYS 40 11.453 -6.780 4.160 277 HB3 LYS 40 2HB LYS 40 10.144 -5.793 4.811 278 HG2 LYS 40 1HG LYS 40 9.364 -7.912 6.055 279 HG3 LYS 40 2HG LYS 40 10.876 -8.673 5.519 280 HD2 LYS 40 1HD LYS 40 12.139 -6.823 6.659 281 HD3 LYS 40 2HD LYS 40 10.578 -6.153 7.222 282 HE2 LYS 40 1HE LYS 40 10.118 -8.480 8.209 283 HE3 LYS 40 2HE LYS 40 11.798 -8.875 7.832 284 HZ1 LYS 40 3HZ LYS 40 11.730 -8.186 10.035 285 HZ2 LYS 40 1HZ LYS 40 10.769 -6.880 9.726 286 HZ3 LYS 40 2HZ LYS 40 12.350 -6.864 9.245 287 H ASP 41 H ASP 41 7.841 -9.154 4.051 288 HA ASP 41 HA ASP 41 5.575 -7.309 4.124 289 HB2 ASP 41 1HB ASP 41 5.628 -9.599 2.778 290 HB3 ASP 41 2HB ASP 41 5.153 -10.260 4.342 291 H GLY 42 H GLY 42 4.804 -6.548 5.942 292 HA2 GLY 42 1HA GLY 42 5.560 -7.338 8.570 293 HA3 GLY 42 2HA GLY 42 4.179 -6.348 8.114 294 H ALA 43 H ALA 43 3.427 -9.021 6.362 295 HA ALA 43 HA ALA 43 1.513 -10.044 8.108 296 HB1 ALA 43 1HB ALA 43 1.446 -10.407 5.681 297 HB2 ALA 43 2HB ALA 43 2.929 -11.386 5.754 298 HB3 ALA 43 3HB ALA 43 1.436 -11.974 6.501 299 H THR 44 H THR 44 4.728 -11.332 7.393 300 HA THR 44 HA THR 44 4.870 -12.844 9.941 301 HB THR 44 HB THR 44 5.754 -14.671 8.070 302 HG1 THR 44 1HG THR 44 3.907 -14.561 6.497 303 HG21 THR 44 3HG2 THR 44 2.828 -14.346 8.871 304 HG22 THR 44 1HG2 THR 44 4.096 -15.012 9.932 305 HG23 THR 44 2HG2 THR 44 3.674 -15.854 8.444 306 H GLY 45 H GLY 45 6.504 -10.846 7.658 307 HA2 GLY 45 1HA GLY 45 8.777 -10.208 7.878 308 HA3 GLY 45 2HA GLY 45 9.189 -11.804 8.511 309 H GLU 46 H GLU 46 6.921 -12.157 5.925 310 HA GLU 46 HA GLU 46 8.808 -13.625 4.394 311 HB2 GLU 46 1HB GLU 46 5.954 -12.718 4.028 312 HB3 GLU 46 2HB GLU 46 6.887 -13.329 2.650 313 HG2 GLU 46 1HG GLU 46 7.195 -15.067 5.035 314 HG3 GLU 46 2HG GLU 46 5.505 -14.884 4.556 315 H SER 47 H SER 47 10.362 -12.884 3.095 316 HA SER 47 HA SER 47 10.309 -10.264 1.974 317 HB2 SER 47 1HB SER 47 12.474 -11.951 1.097 318 HB3 SER 47 2HB SER 47 12.450 -10.598 2.223 319 HG SER 47 HG SER 47 11.925 -12.018 3.913 320 H LEU 48 H LEU 48 9.865 -9.799 -0.108 321 HA LEU 48 HA LEU 48 9.033 -12.009 -1.928 322 HB2 LEU 48 1HB LEU 48 7.666 -9.324 -1.534 323 HB3 LEU 48 2HB LEU 48 7.133 -10.618 -2.604 324 HG LEU 48 HG LEU 48 7.227 -10.861 0.437 325 HD11 LEU 48 1HD1 LEU 48 5.652 -9.141 -0.343 326 HD12 LEU 48 2HD1 LEU 48 4.827 -10.507 0.418 327 HD13 LEU 48 3HD1 LEU 48 4.830 -10.329 -1.354 328 HD21 LEU 48 3HD2 LEU 48 5.878 -12.673 -1.554 329 HD22 LEU 48 1HD2 LEU 48 5.812 -12.745 0.232 330 HD23 LEU 48 2HD2 LEU 48 7.345 -12.998 -0.604 331 H ALA 49 H ALA 49 8.701 -11.002 -4.218 332 HA ALA 49 HA ALA 49 11.260 -9.620 -4.926 333 HB1 ALA 49 1HB ALA 49 9.834 -11.998 -6.215 334 HB2 ALA 49 2HB ALA 49 11.264 -11.179 -6.858 335 HB3 ALA 49 3HB ALA 49 11.371 -12.031 -5.312 336 H SER 50 H SER 50 10.553 -7.624 -5.475 337 HA SER 50 HA SER 50 7.995 -7.137 -6.719 338 HB2 SER 50 1HB SER 50 9.932 -4.902 -6.539 339 HB3 SER 50 2HB SER 50 8.287 -5.023 -5.922 340 HG SER 50 HG SER 50 9.016 -6.047 -4.119 341 HA PRO 51 HA PRO 51 7.467 -4.819 -7.853 342 HB2 PRO 51 1HB PRO 51 6.150 -4.196 -10.100 343 HB3 PRO 51 2HB PRO 51 7.732 -3.444 -9.714 344 HG2 PRO 51 1HG PRO 51 7.217 -5.824 -11.527 345 HG3 PRO 51 2HG PRO 51 8.170 -4.348 -11.890 346 HD2 PRO 51 1HD PRO 51 9.316 -6.669 -10.978 347 HD3 PRO 51 2HD PRO 51 9.949 -5.045 -10.507 348 H VAL 52 H VAL 52 5.381 -5.524 -7.231 349 HA VAL 52 HA VAL 52 4.216 -7.834 -8.569 350 HB VAL 52 HB VAL 52 5.894 -8.700 -7.018 351 HG11 VAL 52 1HG1 VAL 52 4.196 -7.478 -4.823 352 HG12 VAL 52 2HG1 VAL 52 5.558 -8.616 -4.597 353 HG13 VAL 52 3HG1 VAL 52 5.850 -6.998 -5.270 354 HG21 VAL 52 3HG2 VAL 52 3.112 -9.407 -6.013 355 HG22 VAL 52 1HG2 VAL 52 3.735 -9.901 -7.619 356 HG23 VAL 52 2HG2 VAL 52 4.549 -10.442 -6.155 357 H ILE 53 H ILE 53 2.100 -8.420 -7.628 358 HA ILE 53 HA ILE 53 0.654 -5.985 -6.832 359 HB ILE 53 HB ILE 53 -0.421 -8.152 -8.604 360 HG12 ILE 53 1HG1 ILE 53 1.372 -7.209 -9.911 361 HG13 ILE 53 2HG1 ILE 53 -0.195 -6.721 -10.501 362 HG21 ILE 53 1HG2 ILE 53 -2.121 -6.400 -9.098 363 HG22 ILE 53 2HG2 ILE 53 -2.096 -6.861 -7.393 364 HG23 ILE 53 3HG2 ILE 53 -1.365 -5.327 -7.906 365 HD11 ILE 53 3HD1 ILE 53 1.656 -4.958 -8.916 366 HD12 ILE 53 1HD1 ILE 53 1.386 -4.879 -10.655 367 HD13 ILE 53 2HD1 ILE 53 0.062 -4.482 -9.548 368 H LEU 54 H LEU 54 -0.076 -6.317 -4.865 369 HA LEU 54 HA LEU 54 -0.631 -9.007 -3.707 370 HB2 LEU 54 1HB LEU 54 -0.860 -6.181 -2.608 371 HB3 LEU 54 2HB LEU 54 -1.275 -7.658 -1.747 372 HG LEU 54 HG LEU 54 0.822 -6.743 -1.008 373 HD11 LEU 54 1HD1 LEU 54 0.437 -9.164 -0.837 374 HD12 LEU 54 2HD1 LEU 54 2.155 -8.826 -1.095 375 HD13 LEU 54 3HD1 LEU 54 1.175 -9.407 -2.437 376 HD21 LEU 54 3HD2 LEU 54 2.082 -7.414 -3.668 377 HD22 LEU 54 1HD2 LEU 54 2.825 -6.635 -2.269 378 HD23 LEU 54 2HD2 LEU 54 1.570 -5.776 -3.192 379 H SER 55 H SER 55 -2.614 -9.754 -3.542 380 HA SER 55 HA SER 55 -4.753 -8.424 -5.103 381 HB2 SER 55 1HB SER 55 -4.473 -11.354 -4.332 382 HB3 SER 55 2HB SER 55 -5.518 -10.649 -5.566 383 HG SER 55 HG SER 55 -2.669 -10.787 -5.620 384 H ASP 56 H ASP 56 -6.988 -9.485 -4.277 385 HA ASP 56 HA ASP 56 -7.751 -8.124 -2.040 386 HB2 ASP 56 1HB ASP 56 -9.180 -9.059 -3.853 387 HB3 ASP 56 2HB ASP 56 -8.994 -10.661 -3.166 388 H GLU 57 H GLU 57 -6.786 -11.544 -2.140 389 HA GLU 57 HA GLU 57 -7.601 -12.048 0.577 390 HB2 GLU 57 1HB GLU 57 -5.961 -13.649 -1.433 391 HB3 GLU 57 2HB GLU 57 -6.379 -14.200 0.180 392 HG2 GLU 57 1HG GLU 57 -8.872 -13.406 -0.606 393 HG3 GLU 57 2HG GLU 57 -8.146 -13.614 -2.200 394 H GLU 58 H GLU 58 -4.561 -11.185 -0.922 395 HA GLU 58 HA GLU 58 -2.913 -11.609 1.396 396 HB2 GLU 58 1HB GLU 58 -2.205 -9.332 -0.402 397 HB3 GLU 58 2HB GLU 58 -1.207 -10.625 0.223 398 HG2 GLU 58 1HG GLU 58 -3.083 -10.725 -2.156 399 HG3 GLU 58 2HG GLU 58 -1.337 -10.655 -2.210 400 H LEU 59 H LEU 59 -5.039 -8.951 0.324 401 HA LEU 59 HA LEU 59 -4.195 -7.101 2.453 402 HB2 LEU 59 1HB LEU 59 -5.907 -7.047 -0.037 403 HB3 LEU 59 2HB LEU 59 -6.157 -5.827 1.174 404 HG LEU 59 HG LEU 59 -4.748 -5.150 -0.699 405 HD11 LEU 59 1HD1 LEU 59 -4.114 -3.547 0.715 406 HD12 LEU 59 2HD1 LEU 59 -2.746 -4.528 1.247 407 HD13 LEU 59 3HD1 LEU 59 -4.290 -4.632 2.096 408 HD21 LEU 59 3HD2 LEU 59 -2.432 -5.701 -0.868 409 HD22 LEU 59 1HD2 LEU 59 -3.434 -7.142 -1.063 410 HD23 LEU 59 2HD2 LEU 59 -2.564 -6.888 0.467 411 H ALA 60 H ALA 60 -6.062 -9.730 2.634 412 HA ALA 60 HA ALA 60 -8.609 -8.704 3.508 413 HB1 ALA 60 1HB ALA 60 -9.166 -11.060 3.816 414 HB2 ALA 60 2HB ALA 60 -8.331 -10.821 2.276 415 HB3 ALA 60 3HB ALA 60 -7.455 -11.512 3.672 416 H VAL 61 H VAL 61 -6.819 -7.500 5.095 417 HA VAL 61 HA VAL 61 -7.268 -8.517 7.854 418 HB VAL 61 HB VAL 61 -4.851 -7.730 8.283 419 HG11 VAL 61 1HG1 VAL 61 -5.228 -10.243 6.613 420 HG12 VAL 61 2HG1 VAL 61 -3.881 -9.897 7.700 421 HG13 VAL 61 3HG1 VAL 61 -5.514 -10.099 8.367 422 HG21 VAL 61 3HG2 VAL 61 -4.481 -8.253 5.305 423 HG22 VAL 61 1HG2 VAL 61 -4.549 -6.632 6.033 424 HG23 VAL 61 2HG2 VAL 61 -3.266 -7.771 6.489 425 H GLU 62 H GLU 62 -6.701 -6.711 9.473 426 HA GLU 62 HA GLU 62 -8.164 -4.342 8.690 427 HB2 GLU 62 1HB GLU 62 -7.890 -3.649 10.915 428 HB3 GLU 62 2HB GLU 62 -8.115 -5.408 10.978 429 HG2 GLU 62 1HG GLU 62 -5.585 -5.624 11.150 430 HG3 GLU 62 2HG GLU 62 -5.503 -3.857 11.255 431 H LYS 63 H LYS 63 -4.735 -5.138 8.662 432 HA LYS 63 HA LYS 63 -4.152 -2.556 7.523 433 HB2 LYS 63 1HB LYS 63 -3.883 -2.202 10.014 434 HB3 LYS 63 2HB LYS 63 -2.714 -3.522 10.037 435 HG2 LYS 63 1HG LYS 63 -1.335 -2.121 8.361 436 HG3 LYS 63 2HG LYS 63 -2.453 -0.794 8.693 437 HD2 LYS 63 1HD LYS 63 -1.836 -1.141 11.156 438 HD3 LYS 63 2HD LYS 63 -0.585 -2.257 10.577 439 HE2 LYS 63 1HE LYS 63 -0.032 -0.082 9.028 440 HE3 LYS 63 2HE LYS 63 -0.765 0.739 10.417 441 HZ1 LYS 63 3HZ LYS 63 1.507 0.583 10.881 442 HZ2 LYS 63 1HZ LYS 63 1.643 -0.977 10.361 443 HZ3 LYS 63 2HZ LYS 63 0.864 -0.646 11.764 444 H VAL 64 H VAL 64 -2.334 -2.705 6.134 445 HA VAL 64 HA VAL 64 -0.636 -5.087 6.542 446 HB VAL 64 HB VAL 64 -0.938 -3.926 3.768 447 HG11 VAL 64 1HG1 VAL 64 -0.133 -6.675 4.726 448 HG12 VAL 64 2HG1 VAL 64 -0.219 -6.121 3.056 449 HG13 VAL 64 3HG1 VAL 64 0.968 -5.399 4.127 450 HG21 VAL 64 3HG2 VAL 64 -2.580 -6.190 4.932 451 HG22 VAL 64 1HG2 VAL 64 -3.241 -4.654 4.305 452 HG23 VAL 64 2HG2 VAL 64 -2.474 -5.815 3.212 453 H THR 65 H THR 65 1.622 -4.575 6.144 454 HA THR 65 HA THR 65 2.445 -1.799 5.831 455 HB THR 65 HB THR 65 3.016 -3.308 8.420 456 HG1 THR 65 1HG THR 65 1.026 -1.845 7.713 457 HG21 THR 65 3HG2 THR 65 4.129 -1.080 9.043 458 HG22 THR 65 1HG2 THR 65 4.065 -0.649 7.339 459 HG23 THR 65 2HG2 THR 65 5.010 -2.058 7.863 460 H LEU 66 H LEU 66 4.453 -1.666 4.932 461 HA LEU 66 HA LEU 66 5.993 -4.183 4.495 462 HB2 LEU 66 1HB LEU 66 5.129 -2.148 2.373 463 HB3 LEU 66 2HB LEU 66 6.279 -3.443 2.148 464 HG LEU 66 HG LEU 66 4.331 -4.125 1.115 465 HD11 LEU 66 1HD1 LEU 66 4.449 -5.565 3.749 466 HD12 LEU 66 2HD1 LEU 66 5.404 -5.928 2.281 467 HD13 LEU 66 3HD1 LEU 66 3.644 -6.133 2.314 468 HD21 LEU 66 3HD2 LEU 66 2.795 -2.544 2.450 469 HD22 LEU 66 1HD2 LEU 66 2.613 -3.910 3.576 470 HD23 LEU 66 2HD2 LEU 66 2.142 -4.089 1.889 471 H SER 67 H SER 67 8.157 -3.674 3.575 472 HA SER 67 HA SER 67 9.081 -0.940 3.694 473 HB2 SER 67 1HB SER 67 9.255 -1.508 6.072 474 HB3 SER 67 2HB SER 67 10.114 -3.014 5.674 475 HG SER 67 HG SER 67 11.872 -1.994 5.458 476 H THR 68 H THR 68 11.188 -0.765 2.843 477 HA THR 68 HA THR 68 12.089 -2.637 0.811 478 HB THR 68 HB THR 68 14.116 -1.112 1.041 479 HG1 THR 68 1HG THR 68 13.371 -0.543 3.237 480 HG21 THR 68 3HG2 THR 68 12.445 -0.438 -0.678 481 HG22 THR 68 1HG2 THR 68 12.941 1.016 0.187 482 HG23 THR 68 2HG2 THR 68 11.389 0.254 0.567 483 H THR 69 H THR 69 13.685 -4.381 1.190 484 HA THR 69 HA THR 69 14.360 -4.768 3.936 485 HB THR 69 HB THR 69 15.746 -6.677 3.101 486 HG1 THR 69 1HG THR 69 15.724 -7.217 1.028 487 HG21 THR 69 3HG2 THR 69 13.866 -8.002 2.050 488 HG22 THR 69 1HG2 THR 69 12.904 -6.517 2.042 489 HG23 THR 69 2HG2 THR 69 13.492 -7.208 3.579 490 H GLY 70 H GLY 70 15.869 -2.819 1.566 491 HA2 GLY 70 1HA GLY 70 18.171 -2.300 3.302 492 HA3 GLY 70 2HA GLY 70 18.506 -3.028 1.719 493 H LYS 71 H LYS 71 19.670 -1.014 1.398 494 HA LYS 71 HA LYS 71 18.350 1.518 1.304 495 HB2 LYS 71 1HB LYS 71 20.893 0.825 1.471 496 HB3 LYS 71 2HB LYS 71 20.833 0.836 -0.281 497 HG2 LYS 71 1HG LYS 71 20.226 3.106 1.644 498 HG3 LYS 71 2HG LYS 71 21.673 2.962 0.651 499 HD2 LYS 71 1HD LYS 71 18.875 3.311 -0.521 500 HD3 LYS 71 2HD LYS 71 19.895 4.613 -0.056 501 HE2 LYS 71 1HE LYS 71 19.960 4.240 -2.402 502 HE3 LYS 71 2HE LYS 71 21.561 4.040 -1.663 503 HZ1 LYS 71 3HZ LYS 71 21.450 1.701 -1.945 504 HZ2 LYS 71 1HZ LYS 71 21.036 2.324 -3.377 505 HZ3 LYS 71 2HZ LYS 71 19.886 1.708 -2.385 506 H ALA 72 H ALA 72 16.885 2.170 -0.195 507 HA ALA 72 HA ALA 72 16.841 0.827 -2.839 508 HB1 ALA 72 1HB ALA 72 14.279 1.655 -1.591 509 HB2 ALA 72 2HB ALA 72 14.716 0.198 -2.552 510 HB3 ALA 72 3HB ALA 72 15.079 0.271 -0.831 511 H ILE 73 H ILE 73 15.369 2.111 -4.396 512 HA ILE 73 HA ILE 73 15.739 5.050 -3.991 513 HB ILE 73 HB ILE 73 16.001 3.884 -6.713 514 HG12 ILE 73 1HG1 ILE 73 17.382 2.230 -5.564 515 HG13 ILE 73 2HG1 ILE 73 18.249 3.263 -6.597 516 HG21 ILE 73 1HG2 ILE 73 16.221 6.310 -6.334 517 HG22 ILE 73 2HG2 ILE 73 17.553 6.047 -5.234 518 HG23 ILE 73 3HG2 ILE 73 17.730 5.628 -6.952 519 HD11 ILE 73 3HD1 ILE 73 18.657 4.528 -4.163 520 HD12 ILE 73 1HD1 ILE 73 18.601 2.805 -3.749 521 HD13 ILE 73 2HD1 ILE 73 19.755 3.381 -4.940 522 H GLU 74 H GLU 74 13.162 2.924 -4.323 523 HA GLU 74 HA GLU 74 11.513 5.087 -5.464 524 HB2 GLU 74 1HB GLU 74 11.933 2.413 -6.799 525 HB3 GLU 74 2HB GLU 74 10.291 3.013 -6.690 526 HG2 GLU 74 1HG GLU 74 11.327 5.275 -7.597 527 HG3 GLU 74 2HG GLU 74 12.652 4.232 -8.088 528 H PHE 75 H PHE 75 9.222 4.714 -5.153 529 HA PHE 75 HA PHE 75 8.259 2.271 -4.160 530 HB2 PHE 75 1HB PHE 75 8.737 4.230 -2.046 531 HB3 PHE 75 2HB PHE 75 7.015 3.973 -2.208 532 HD1 PHE 75 2HD PHE 75 9.221 1.000 -2.814 533 HD2 PHE 75 1HD PHE 75 6.949 3.270 0.090 534 HE1 PHE 75 2HE PHE 75 9.401 -0.833 -1.227 535 HE2 PHE 75 1HE PHE 75 7.216 1.429 1.705 536 HZ PHE 75 HZ PHE 75 8.407 -0.652 1.053 537 H ALA 76 H ALA 76 7.247 2.437 -6.190 538 HA ALA 76 HA ALA 76 5.135 4.491 -6.449 539 HB1 ALA 76 1HB ALA 76 6.284 3.790 -8.535 540 HB2 ALA 76 2HB ALA 76 5.702 2.115 -8.301 541 HB3 ALA 76 3HB ALA 76 4.556 3.428 -8.573 542 H VAL 77 H VAL 77 2.973 4.064 -6.085 543 HA VAL 77 HA VAL 77 2.098 1.380 -5.355 544 HB VAL 77 HB VAL 77 1.575 3.783 -3.553 545 HG11 VAL 77 1HG1 VAL 77 0.721 0.897 -3.498 546 HG12 VAL 77 2HG1 VAL 77 0.694 1.919 -2.055 547 HG13 VAL 77 3HG1 VAL 77 -0.281 2.358 -3.471 548 HG21 VAL 77 3HG2 VAL 77 2.950 2.603 -1.836 549 HG22 VAL 77 1HG2 VAL 77 3.531 1.508 -3.109 550 HG23 VAL 77 2HG2 VAL 77 3.891 3.234 -3.194 551 H SER 78 H SER 78 0.113 1.078 -6.279 552 HA SER 78 HA SER 78 -1.776 3.254 -6.516 553 HB2 SER 78 1HB SER 78 -0.994 1.555 -8.874 554 HB3 SER 78 2HB SER 78 -2.300 2.772 -8.822 555 HG SER 78 HG SER 78 -0.852 4.005 -9.574 556 H GLY 79 H GLY 79 -4.008 2.192 -7.072 557 HA2 GLY 79 1HA GLY 79 -4.594 -0.487 -6.892 558 HA3 GLY 79 2HA GLY 79 -4.370 0.056 -5.219 559 H GLY 80 H GLY 80 -6.864 -0.648 -5.448 560 HA2 GLY 80 1HA GLY 80 -8.395 1.499 -4.787 561 HA3 GLY 80 2HA GLY 80 -8.654 1.343 -6.535 562 H VAL 81 H VAL 81 -10.918 0.894 -5.519 563 HA VAL 81 HA VAL 81 -11.437 -1.963 -5.506 564 HB VAL 81 HB VAL 81 -13.089 -1.465 -3.523 565 HG11 VAL 81 1HG1 VAL 81 -11.508 -2.230 -1.838 566 HG12 VAL 81 2HG1 VAL 81 -11.332 -3.109 -3.347 567 HG13 VAL 81 3HG1 VAL 81 -10.153 -1.834 -2.928 568 HG21 VAL 81 3HG2 VAL 81 -10.938 0.574 -2.833 569 HG22 VAL 81 1HG2 VAL 81 -12.653 0.917 -3.209 570 HG23 VAL 81 2HG2 VAL 81 -12.208 -0.028 -1.776 571 H VAL 82 H VAL 82 -13.780 -2.301 -5.763 572 HA VAL 82 HA VAL 82 -15.524 0.003 -6.315 573 HB VAL 82 HB VAL 82 -16.834 -1.591 -7.792 574 HG11 VAL 82 1HG1 VAL 82 -15.637 0.069 -8.925 575 HG12 VAL 82 2HG1 VAL 82 -14.149 -0.912 -8.924 576 HG13 VAL 82 3HG1 VAL 82 -15.592 -1.446 -9.834 577 HG21 VAL 82 3HG2 VAL 82 -14.381 -3.370 -7.712 578 HG22 VAL 82 1HG2 VAL 82 -15.988 -3.704 -7.023 579 HG23 VAL 82 2HG2 VAL 82 -15.785 -3.575 -8.765 580 H ASP 83 H ASP 83 -17.715 -0.474 -5.893 581 HA ASP 83 HA ASP 83 -18.131 -3.082 -4.744 582 HB2 ASP 83 1HB ASP 83 -18.477 -1.177 -3.163 583 HB3 ASP 83 2HB ASP 83 -19.689 -0.551 -4.276 584 H GLY 84 H GLY 84 -19.854 -3.941 -5.860 585 HA2 GLY 84 1HA GLY 84 -21.130 -2.582 -8.127 586 HA3 GLY 84 2HA GLY 84 -20.124 -3.990 -8.563 587 H GLU 85 H GLU 85 -22.070 -3.560 -5.581 588 HA GLU 85 HA GLU 85 -23.815 -5.827 -6.495 589 HB2 GLU 85 1HB GLU 85 -22.916 -4.961 -3.731 590 HB3 GLU 85 2HB GLU 85 -24.175 -6.171 -4.044 591 HG2 GLU 85 1HG GLU 85 -22.738 -7.671 -5.117 592 HG3 GLU 85 2HG GLU 85 -21.471 -6.481 -5.358 593 H ASP 86 H ASP 86 -26.060 -5.716 -5.992 594 HA ASP 86 HA ASP 86 -27.181 -2.991 -5.716 595 HB2 ASP 86 1HB ASP 86 -26.451 -3.219 -8.086 596 HB3 ASP 86 2HB ASP 86 -27.521 -4.615 -8.258 597 H GLY 87 H GLY 87 -28.309 -3.649 -3.986 598 HA2 GLY 87 1HA GLY 87 -30.608 -4.585 -3.451 599 HA3 GLY 87 2HA GLY 87 -30.075 -6.076 -4.227 600 H VAL 88 H VAL 88 -27.677 -4.312 -2.253 601 HA VAL 88 HA VAL 88 -28.101 -6.132 0.008 602 HB VAL 88 HB VAL 88 -25.592 -6.007 0.149 603 HG11 VAL 88 1HG1 VAL 88 -25.199 -7.789 -1.480 604 HG12 VAL 88 2HG1 VAL 88 -26.772 -8.016 -0.695 605 HG13 VAL 88 3HG1 VAL 88 -26.686 -7.374 -2.348 606 HG21 VAL 88 3HG2 VAL 88 -25.336 -4.046 -1.407 607 HG22 VAL 88 1HG2 VAL 88 -24.266 -5.416 -1.747 608 HG23 VAL 88 2HG2 VAL 88 -25.697 -5.131 -2.760 609 H VAL 89 H VAL 89 -26.483 -5.048 1.857 610 HA VAL 89 HA VAL 89 -26.762 -2.129 1.846 611 HB VAL 89 HB VAL 89 -27.748 -3.680 4.268 612 HG11 VAL 89 1HG1 VAL 89 -27.977 -0.735 3.471 613 HG12 VAL 89 2HG1 VAL 89 -28.540 -1.465 4.992 614 HG13 VAL 89 3HG1 VAL 89 -26.811 -1.390 4.634 615 HG21 VAL 89 3HG2 VAL 89 -30.037 -2.923 3.738 616 HG22 VAL 89 1HG2 VAL 89 -29.486 -2.321 2.163 617 HG23 VAL 89 2HG2 VAL 89 -29.441 -4.058 2.529 618 H ASN 90 H ASN 90 -24.551 -2.232 1.480 619 HA ASN 90 HA ASN 90 -22.720 -3.568 3.310 620 HB2 ASN 90 1HB ASN 90 -22.195 -1.423 1.217 621 HB3 ASN 90 2HB ASN 90 -20.992 -2.488 1.936 622 HD21 ASN 90 1HD2 ASN 90 -20.687 -4.587 1.010 623 HD22 ASN 90 2HD2 ASN 90 -21.600 -5.045 -0.448 624 H GLU 91 H GLU 91 -20.823 -1.899 4.023 625 HA GLU 91 HA GLU 91 -21.857 0.742 4.797 626 HB2 GLU 91 1HB GLU 91 -20.228 -1.213 6.387 627 HB3 GLU 91 2HB GLU 91 -19.915 0.508 6.581 628 HG2 GLU 91 1HG GLU 91 -22.790 -0.408 6.668 629 HG3 GLU 91 2HG GLU 91 -21.739 -0.904 7.956 630 HA PRO 92 HA PRO 92 -18.168 1.619 2.395 631 HB2 PRO 92 1HB PRO 92 -17.535 4.220 3.083 632 HB3 PRO 92 2HB PRO 92 -19.053 3.829 2.238 633 HG2 PRO 92 1HG PRO 92 -18.618 4.182 5.228 634 HG3 PRO 92 2HG PRO 92 -19.871 4.952 4.200 635 HD2 PRO 92 1HD PRO 92 -20.341 2.679 5.675 636 HD3 PRO 92 2HD PRO 92 -21.120 2.957 4.099 637 H MET 93 H MET 93 -15.811 2.629 2.671 638 HA MET 93 HA MET 93 -14.721 2.249 5.353 639 HB2 MET 93 1HB MET 93 -12.963 0.785 4.551 640 HB3 MET 93 2HB MET 93 -14.537 -0.014 4.418 641 HG2 MET 93 1HG MET 93 -14.611 0.353 2.040 642 HG3 MET 93 2HG MET 93 -13.175 1.370 2.086 643 HE1 MET 93 3HE MET 93 -10.874 0.463 2.970 644 HE2 MET 93 1HE MET 93 -11.420 -0.631 4.235 645 HE3 MET 93 2HE MET 93 -10.369 -1.258 2.957 646 H GLN 94 H GLN 94 -12.479 2.937 5.464 647 HA GLN 94 HA GLN 94 -11.687 4.946 3.418 648 HB2 GLN 94 1HB GLN 94 -11.665 5.111 6.465 649 HB3 GLN 94 2HB GLN 94 -10.768 6.228 5.428 650 HG2 GLN 94 1HG GLN 94 -12.736 7.157 4.490 651 HG3 GLN 94 2HG GLN 94 -13.750 5.806 4.980 652 HE21 GLN 94 1HE2 GLN 94 -11.737 8.412 6.501 653 HE22 GLN 94 2HE2 GLN 94 -12.941 8.700 7.777 654 H TRP 95 H TRP 95 -9.316 5.290 3.418 655 HA TRP 95 HA TRP 95 -7.683 2.982 4.338 656 HB2 TRP 95 1HB TRP 95 -7.778 4.294 1.604 657 HB3 TRP 95 2HB TRP 95 -6.292 3.603 2.210 658 HD1 TRP 95 HD TRP 95 -9.019 1.355 3.179 659 HE1 TRP 95 1HE TRP 95 -9.288 -0.586 1.505 660 HE3 TRP 95 3HE TRP 95 -5.576 2.772 -0.292 661 HZ2 TRP 95 2HZ TRP 95 -8.158 -1.418 -0.967 662 HZ3 TRP 95 3HZ TRP 95 -5.014 1.240 -2.183 663 HH2 TRP 95 HH TRP 95 -6.343 -0.814 -2.569 664 H VAL 96 H VAL 96 -5.923 3.766 5.449 665 HA VAL 96 HA VAL 96 -5.139 6.594 5.007 666 HB VAL 96 HB VAL 96 -6.498 6.795 6.793 667 HG11 VAL 96 1HG1 VAL 96 -6.529 4.275 7.505 668 HG12 VAL 96 2HG1 VAL 96 -5.209 4.806 8.591 669 HG13 VAL 96 3HG1 VAL 96 -6.809 5.563 8.654 670 HG21 VAL 96 3HG2 VAL 96 -3.693 6.626 7.933 671 HG22 VAL 96 1HG2 VAL 96 -4.394 7.998 7.040 672 HG23 VAL 96 2HG2 VAL 96 -5.048 7.543 8.614 673 H VAL 97 H VAL 97 -3.354 6.442 3.985 674 HA VAL 97 HA VAL 97 -1.472 4.253 4.553 675 HB VAL 97 HB VAL 97 -0.983 4.311 2.237 676 HG11 VAL 97 1HG1 VAL 97 -2.875 2.983 2.980 677 HG12 VAL 97 2HG1 VAL 97 -3.992 4.292 2.549 678 HG13 VAL 97 3HG1 VAL 97 -3.036 3.476 1.290 679 HG21 VAL 97 3HG2 VAL 97 -2.345 6.915 2.075 680 HG22 VAL 97 1HG2 VAL 97 -1.160 6.179 1.000 681 HG23 VAL 97 2HG2 VAL 97 -2.864 5.781 0.814 682 H THR 98 H THR 98 0.207 5.001 5.775 683 HA THR 98 HA THR 98 1.145 7.797 5.405 684 HB THR 98 HB THR 98 1.910 5.643 7.415 685 HG1 THR 98 1HG THR 98 -0.190 7.442 7.266 686 HG21 THR 98 3HG2 THR 98 3.634 7.433 7.261 687 HG22 THR 98 1HG2 THR 98 2.763 7.470 8.790 688 HG23 THR 98 2HG2 THR 98 2.367 8.651 7.552 689 H VAL 99 H VAL 99 3.429 8.099 4.943 690 HA VAL 99 HA VAL 99 4.892 5.610 4.202 691 HB VAL 99 HB VAL 99 5.383 8.164 2.625 692 HG11 VAL 99 1HG1 VAL 99 6.723 6.637 1.175 693 HG12 VAL 99 2HG1 VAL 99 7.372 6.749 2.799 694 HG13 VAL 99 3HG1 VAL 99 6.441 5.314 2.328 695 HG21 VAL 99 3HG2 VAL 99 3.226 7.267 1.918 696 HG22 VAL 99 1HG2 VAL 99 4.427 6.883 0.684 697 HG23 VAL 99 2HG2 VAL 99 3.934 5.616 1.816 698 H TYR 100 H TYR 100 6.828 5.408 5.047 699 HA TYR 100 HA TYR 100 8.056 7.626 6.559 700 HB2 TYR 100 1HB TYR 100 8.126 4.633 7.111 701 HB3 TYR 100 2HB TYR 100 9.053 5.843 7.973 702 HD1 TYR 100 2HD TYR 100 5.630 4.532 7.341 703 HD2 TYR 100 1HD TYR 100 8.083 7.107 9.787 704 HE1 TYR 100 2HE TYR 100 3.737 4.848 8.902 705 HE2 TYR 100 1HE TYR 100 6.185 7.445 11.339 706 HH TYR 100 HH TYR 100 3.159 5.629 10.995 707 H LYS 101 H LYS 101 10.267 7.673 6.398 708 HA LYS 101 HA LYS 101 11.571 6.534 4.012 709 HB2 LYS 101 1HB LYS 101 11.230 9.023 4.438 710 HB3 LYS 101 2HB LYS 101 12.307 8.901 5.823 711 HG2 LYS 101 1HG LYS 101 14.179 8.397 4.374 712 HG3 LYS 101 2HG LYS 101 13.089 8.098 3.012 713 HD2 LYS 101 1HD LYS 101 12.788 10.304 2.576 714 HD3 LYS 101 2HD LYS 101 12.907 10.826 4.254 715 HE2 LYS 101 1HE LYS 101 15.364 9.829 2.779 716 HE3 LYS 101 2HE LYS 101 14.781 11.474 2.537 717 HZ1 LYS 101 3HZ LYS 101 15.025 11.932 4.870 718 HZ2 LYS 101 1HZ LYS 101 16.439 11.272 4.345 719 HZ3 LYS 101 2HZ LYS 101 15.365 10.381 5.209 720 H ASN 102 H ASN 102 14.116 6.497 4.748 721 HA ASN 102 HA ASN 102 14.618 4.564 6.783 722 HB2 ASN 102 1HB ASN 102 16.864 4.744 6.481 723 HB3 ASN 102 2HB ASN 102 16.151 4.908 4.902 724 HD21 ASN 102 1HD2 ASN 102 15.684 7.800 4.925 725 HD22 ASN 102 2HD2 ASN 102 17.296 8.417 4.653 726 H GLY 103 H GLY 103 13.287 5.594 8.430 727 HA2 GLY 103 1HA GLY 103 13.386 6.185 10.684 728 HA3 GLY 103 2HA GLY 103 14.967 6.903 10.441 729 H LYS 104 H LYS 104 11.796 7.677 8.833 730 HA LYS 104 HA LYS 104 11.220 9.806 10.552 731 HB2 LYS 104 1HB LYS 104 12.696 10.531 8.066 732 HB3 LYS 104 2HB LYS 104 11.127 11.295 8.142 733 HG2 LYS 104 1HG LYS 104 13.256 11.505 10.321 734 HG3 LYS 104 2HG LYS 104 12.959 12.711 9.068 735 HD2 LYS 104 1HD LYS 104 10.911 11.834 11.136 736 HD3 LYS 104 2HD LYS 104 11.939 13.260 11.288 737 HE2 LYS 104 1HE LYS 104 10.937 14.327 9.380 738 HE3 LYS 104 2HE LYS 104 10.148 12.844 8.870 739 HZ1 LYS 104 3HZ LYS 104 9.452 14.353 11.306 740 HZ2 LYS 104 1HZ LYS 104 8.797 12.933 10.846 741 HZ3 LYS 104 2HZ LYS 104 8.569 14.263 9.912 742 H GLU 105 H GLU 105 8.977 10.496 10.153 743 HA GLU 105 HA GLU 105 7.390 8.992 8.146 744 HB2 GLU 105 1HB GLU 105 6.508 9.648 10.454 745 HB3 GLU 105 2HB GLU 105 6.608 11.326 9.924 746 HG2 GLU 105 1HG GLU 105 5.027 10.760 8.032 747 HG3 GLU 105 2HG GLU 105 4.894 9.130 8.697 748 H ILE 106 H ILE 106 6.886 9.905 6.111 749 HA ILE 106 HA ILE 106 7.716 12.730 5.652 750 HB ILE 106 HB ILE 106 8.456 12.028 3.386 751 HG12 ILE 106 1HG1 ILE 106 8.545 9.174 4.454 752 HG13 ILE 106 2HG1 ILE 106 7.202 9.771 3.482 753 HG21 ILE 106 1HG2 ILE 106 10.661 11.363 4.088 754 HG22 ILE 106 2HG2 ILE 106 10.008 12.487 5.284 755 HG23 ILE 106 3HG2 ILE 106 10.049 10.754 5.649 756 HD11 ILE 106 3HD1 ILE 106 8.714 10.321 1.637 757 HD12 ILE 106 1HD1 ILE 106 10.090 9.683 2.565 758 HD13 ILE 106 2HD1 ILE 106 8.776 8.599 2.073 759 H GLU 107 H GLU 107 5.170 10.314 5.230 760 HA GLU 107 HA GLU 107 3.691 12.456 3.863 761 HB2 GLU 107 1HB GLU 107 4.670 10.915 2.099 762 HB3 GLU 107 2HB GLU 107 3.703 9.604 2.782 763 HG2 GLU 107 1HG GLU 107 2.654 10.689 0.770 764 HG3 GLU 107 2HG GLU 107 1.635 10.698 2.210 765 H LYS 108 H LYS 108 1.572 12.470 4.270 766 HA LYS 108 HA LYS 108 0.397 10.396 6.019 767 HB2 LYS 108 1HB LYS 108 1.614 11.842 7.551 768 HB3 LYS 108 2HB LYS 108 0.846 13.288 6.875 769 HG2 LYS 108 1HG LYS 108 -1.347 12.551 7.658 770 HG3 LYS 108 2HG LYS 108 -0.682 10.992 8.169 771 HD2 LYS 108 1HD LYS 108 0.848 12.242 9.756 772 HD3 LYS 108 2HD LYS 108 0.014 13.741 9.333 773 HE2 LYS 108 1HE LYS 108 -1.238 11.240 10.559 774 HE3 LYS 108 2HE LYS 108 -0.835 12.730 11.430 775 HZ1 LYS 108 3HZ LYS 108 -3.141 12.702 10.881 776 HZ2 LYS 108 1HZ LYS 108 -2.875 12.459 9.292 777 HZ3 LYS 108 2HZ LYS 108 -2.424 13.884 9.984 778 H LYS 109 H LYS 109 -1.213 9.981 4.648 779 HA LYS 109 HA LYS 109 -3.224 12.139 4.278 780 HB2 LYS 109 1HB LYS 109 -3.553 11.848 1.978 781 HB3 LYS 109 2HB LYS 109 -1.832 12.118 2.229 782 HG2 LYS 109 1HG LYS 109 -1.486 9.607 2.078 783 HG3 LYS 109 2HG LYS 109 -3.213 9.463 1.673 784 HD2 LYS 109 1HD LYS 109 -2.499 11.435 -0.073 785 HD3 LYS 109 2HD LYS 109 -0.933 10.593 0.047 786 HE2 LYS 109 1HE LYS 109 -1.835 8.601 -0.866 787 HE3 LYS 109 2HE LYS 109 -3.494 9.036 -0.418 788 HZ1 LYS 109 3HZ LYS 109 -2.001 10.568 -2.433 789 HZ2 LYS 109 1HZ LYS 109 -3.568 10.696 -2.018 790 HZ3 LYS 109 2HZ LYS 109 -3.109 9.385 -2.824 791 H SER 110 H SER 110 -5.340 11.159 3.217 792 HA SER 110 HA SER 110 -5.817 8.407 3.904 793 HB2 SER 110 1HB SER 110 -6.117 9.435 6.024 794 HB3 SER 110 2HB SER 110 -7.230 10.644 5.361 795 HG SER 110 HG SER 110 -8.075 8.671 6.475 796 H LEU 111 H LEU 111 -7.957 7.769 3.121 797 HA LEU 111 HA LEU 111 -8.918 9.349 0.781 798 HB2 LEU 111 1HB LEU 111 -8.964 6.350 0.717 799 HB3 LEU 111 2HB LEU 111 -9.018 7.533 -0.577 800 HG LEU 111 HG LEU 111 -6.601 6.787 1.005 801 HD11 LEU 111 1HD1 LEU 111 -5.804 5.563 -0.920 802 HD12 LEU 111 2HD1 LEU 111 -7.221 6.059 -1.851 803 HD13 LEU 111 3HD1 LEU 111 -7.423 4.957 -0.493 804 HD21 LEU 111 3HD2 LEU 111 -6.839 8.494 -1.467 805 HD22 LEU 111 1HD2 LEU 111 -5.297 7.994 -0.743 806 HD23 LEU 111 2HD2 LEU 111 -6.379 9.090 0.132 807 H VAL 112 H VAL 112 -11.138 8.570 0.116 808 HA VAL 112 HA VAL 112 -12.751 7.258 2.189 809 HB VAL 112 HB VAL 112 -12.750 9.568 2.798 810 HG11 VAL 112 1HG1 VAL 112 -13.942 10.347 0.121 811 HG12 VAL 112 2HG1 VAL 112 -13.689 11.374 1.522 812 HG13 VAL 112 3HG1 VAL 112 -12.291 10.705 0.667 813 HG21 VAL 112 3HG2 VAL 112 -15.440 8.800 1.615 814 HG22 VAL 112 1HG2 VAL 112 -14.785 8.223 3.157 815 HG23 VAL 112 2HG2 VAL 112 -15.145 9.949 2.941 816 H PHE 113 H PHE 113 -12.938 5.493 0.850 817 HA PHE 113 HA PHE 113 -14.055 5.775 -1.861 818 HB2 PHE 113 1HB PHE 113 -13.062 3.515 -0.102 819 HB3 PHE 113 2HB PHE 113 -14.304 3.169 -1.282 820 HD1 PHE 113 1HD PHE 113 -13.966 3.775 -3.717 821 HD2 PHE 113 2HD PHE 113 -10.730 3.666 -0.886 822 HE1 PHE 113 1HE PHE 113 -12.373 3.386 -5.569 823 HE2 PHE 113 2HE PHE 113 -9.142 3.228 -2.728 824 HZ PHE 113 HZ PHE 113 -9.968 3.089 -5.085 825 H ARG 114 H ARG 114 -16.115 4.253 -2.093 826 HA ARG 114 HA ARG 114 -17.879 4.468 0.199 827 HB2 ARG 114 1HB ARG 114 -18.219 6.062 -2.349 828 HB3 ARG 114 2HB ARG 114 -19.657 5.397 -1.568 829 HG2 ARG 114 1HG ARG 114 -18.861 6.544 0.578 830 HG3 ARG 114 2HG ARG 114 -17.591 7.320 -0.399 831 HD2 ARG 114 1HD ARG 114 -19.506 8.824 -0.175 832 HD3 ARG 114 2HD ARG 114 -19.317 8.323 -1.854 833 HE ARG 114 HE ARG 114 -21.093 6.493 -0.620 834 HH11 ARG 114 1HH1 ARG 114 -21.229 9.698 -1.997 835 HH12 ARG 114 2HH1 ARG 114 -22.856 10.011 -1.508 836 HH21 ARG 114 1HH2 ARG 114 -23.261 6.594 -0.720 837 HH22 ARG 114 2HH2 ARG 114 -24.131 8.093 -0.978 838 H ASP 115 H ASP 115 -20.003 3.560 -0.418 839 HA ASP 115 HA ASP 115 -19.565 0.821 -1.340 840 HB2 ASP 115 1HB ASP 115 -21.331 0.366 0.353 841 HB3 ASP 115 2HB ASP 115 -19.886 1.086 1.030 842 H GLY 116 H GLY 116 -21.491 -0.352 -2.017 843 HA2 GLY 116 1HA GLY 116 -23.243 -0.760 -3.371 844 HA3 GLY 116 2HA GLY 116 -23.691 0.958 -3.385 845 H LYS 117 H LYS 117 -22.125 2.390 -4.633 846 HA LYS 117 HA LYS 117 -21.165 1.355 -7.070 847 HB2 LYS 117 1HB LYS 117 -23.134 2.105 -8.286 848 HB3 LYS 117 2HB LYS 117 -23.291 0.601 -7.388 849 HG2 LYS 117 1HG LYS 117 -25.308 2.065 -7.288 850 HG3 LYS 117 2HG LYS 117 -24.663 1.684 -5.685 851 HD2 LYS 117 1HD LYS 117 -23.533 3.771 -5.536 852 HD3 LYS 117 2HD LYS 117 -23.733 4.063 -7.252 853 HE2 LYS 117 1HE LYS 117 -26.250 4.138 -6.912 854 HE3 LYS 117 2HE LYS 117 -25.975 4.109 -5.163 855 HZ1 LYS 117 3HZ LYS 117 -24.968 6.236 -5.300 856 HZ2 LYS 117 1HZ LYS 117 -26.270 6.335 -6.276 857 HZ3 LYS 117 2HZ LYS 117 -24.763 6.182 -6.932 858 H GLU 118 H GLU 118 -20.370 3.449 -5.070 859 HA GLU 118 HA GLU 118 -19.899 5.579 -7.053 860 HB2 GLU 118 1HB GLU 118 -21.742 6.264 -5.621 861 HB3 GLU 118 2HB GLU 118 -20.946 5.711 -4.152 862 HG2 GLU 118 1HG GLU 118 -19.210 7.314 -4.387 863 HG3 GLU 118 2HG GLU 118 -19.851 7.889 -5.950 864 H ILE 119 H ILE 119 -17.808 5.396 -7.414 865 HA ILE 119 HA ILE 119 -15.776 5.451 -5.345 866 HB ILE 119 HB ILE 119 -14.549 3.560 -6.147 867 HG12 ILE 119 1HG1 ILE 119 -16.258 1.861 -7.471 868 HG13 ILE 119 2HG1 ILE 119 -16.716 3.406 -8.189 869 HG21 ILE 119 1HG2 ILE 119 -16.140 3.290 -4.231 870 HG22 ILE 119 2HG2 ILE 119 -17.301 2.572 -5.348 871 HG23 ILE 119 3HG2 ILE 119 -15.713 1.800 -5.068 872 HD11 ILE 119 3HD1 ILE 119 -14.948 2.367 -9.507 873 HD12 ILE 119 1HD1 ILE 119 -14.339 3.818 -8.711 874 HD13 ILE 119 2HD1 ILE 119 -13.910 2.223 -8.066 875 H SER 120 H SER 120 -13.576 5.786 -6.431 876 HA SER 120 HA SER 120 -13.829 6.683 -9.241 877 HB2 SER 120 1HB SER 120 -12.223 8.327 -8.983 878 HB3 SER 120 2HB SER 120 -13.306 8.570 -7.602 879 HG SER 120 HG SER 120 -10.830 8.487 -7.406 880 H THR 121 H THR 121 -11.961 6.262 -10.460 881 HA THR 121 HA THR 121 -10.548 3.732 -9.779 882 HB THR 121 HB THR 121 -9.658 4.047 -12.155 883 HG1 THR 121 1HG THR 121 -11.556 6.194 -12.104 884 HG21 THR 121 3HG2 THR 121 -11.770 3.312 -13.215 885 HG22 THR 121 1HG2 THR 121 -12.669 3.789 -11.753 886 HG23 THR 121 2HG2 THR 121 -11.467 2.488 -11.670 887 H ASP 122 H ASP 122 -10.066 6.881 -9.061 888 HA ASP 122 HA ASP 122 -7.240 6.684 -9.733 889 HB2 ASP 122 1HB ASP 122 -7.228 9.074 -10.103 890 HB3 ASP 122 2HB ASP 122 -8.509 8.314 -11.034 891 H ASP 123 H ASP 123 -8.732 6.044 -7.134 892 HA ASP 123 HA ASP 123 -8.117 7.908 -5.187 893 HB2 ASP 123 1HB ASP 123 -9.279 5.303 -5.338 894 HB3 ASP 123 2HB ASP 123 -8.094 5.238 -4.035 895 H LEU 124 H LEU 124 -5.738 5.783 -6.677 896 HA LEU 124 HA LEU 124 -3.741 6.829 -4.722 897 HB2 LEU 124 1HB LEU 124 -3.781 4.033 -5.784 898 HB3 LEU 124 2HB LEU 124 -2.363 4.806 -5.131 899 HG LEU 124 HG LEU 124 -3.147 3.332 -3.516 900 HD11 LEU 124 1HD1 LEU 124 -2.196 5.501 -2.755 901 HD12 LEU 124 2HD1 LEU 124 -3.298 4.756 -1.580 902 HD13 LEU 124 3HD1 LEU 124 -3.849 6.130 -2.559 903 HD21 LEU 124 3HD2 LEU 124 -5.294 3.467 -2.407 904 HD22 LEU 124 1HD2 LEU 124 -5.515 3.143 -4.139 905 HD23 LEU 124 2HD2 LEU 124 -5.826 4.747 -3.454 906 H ASN 125 H ASN 125 -2.152 7.787 -5.673 907 HA ASN 125 HA ASN 125 -0.829 6.530 -7.912 908 HB2 ASN 125 1HB ASN 125 -2.404 8.326 -8.952 909 HB3 ASN 125 2HB ASN 125 -1.279 9.506 -8.335 910 HD21 ASN 125 1HD2 ASN 125 1.236 9.118 -9.197 911 HD22 ASN 125 2HD2 ASN 125 1.249 8.416 -10.801 912 H LEU 126 H LEU 126 0.750 6.095 -6.253 913 HA LEU 126 HA LEU 126 2.191 8.489 -5.178 914 HB2 LEU 126 1HB LEU 126 2.357 5.700 -4.061 915 HB3 LEU 126 2HB LEU 126 2.997 7.175 -3.367 916 HG LEU 126 HG LEU 126 0.057 6.402 -3.559 917 HD11 LEU 126 1HD1 LEU 126 1.887 6.796 -1.162 918 HD12 LEU 126 2HD1 LEU 126 1.374 5.236 -1.803 919 HD13 LEU 126 3HD1 LEU 126 0.168 6.339 -1.114 920 HD21 LEU 126 3HD2 LEU 126 1.328 8.931 -2.412 921 HD22 LEU 126 1HD2 LEU 126 -0.363 8.450 -2.226 922 HD23 LEU 126 2HD2 LEU 126 0.252 8.846 -3.830 923 H TYR 127 H TYR 127 4.366 8.596 -5.692 924 HA TYR 127 HA TYR 127 5.799 6.380 -6.995 925 HB2 TYR 127 1HB TYR 127 4.390 7.584 -8.743 926 HB3 TYR 127 2HB TYR 127 5.356 9.012 -8.435 927 HD1 TYR 127 1HD TYR 127 7.796 9.061 -9.153 928 HD2 TYR 127 2HD TYR 127 5.230 5.674 -9.946 929 HE1 TYR 127 1HE TYR 127 9.353 8.290 -10.914 930 HE2 TYR 127 2HE TYR 127 6.773 4.928 -11.713 931 HH TYR 127 HH TYR 127 9.146 5.177 -12.403 932 H TYR 128 H TYR 128 6.870 6.682 -4.858 933 HA TYR 128 HA TYR 128 8.454 9.142 -4.551 934 HB2 TYR 128 1HB TYR 128 8.215 6.552 -3.001 935 HB3 TYR 128 2HB TYR 128 9.700 7.484 -2.880 936 HD1 TYR 128 2HD TYR 128 9.351 10.140 -2.632 937 HD2 TYR 128 1HD TYR 128 6.601 7.073 -1.342 938 HE1 TYR 128 2HE TYR 128 8.153 11.816 -1.281 939 HE2 TYR 128 1HE TYR 128 5.342 8.775 -0.045 940 HH TYR 128 HH TYR 128 6.278 12.227 0.083 941 H ASN 129 H ASN 129 10.622 9.341 -4.932 942 HA ASN 129 HA ASN 129 12.235 7.050 -5.416 943 HB2 ASN 129 1HB ASN 129 13.602 8.472 -7.116 944 HB3 ASN 129 2HB ASN 129 12.295 7.424 -7.647 945 HD21 ASN 129 1HD2 ASN 129 11.583 8.428 -9.541 946 HD22 ASN 129 2HD2 ASN 129 11.053 10.088 -9.563 Start of MODEL 6 1 H1 GLY 1 H GLY 1 43.489 -11.391 -8.456 2 HA2 GLY 1 1HA GLY 1 43.359 -9.114 -9.486 3 HA3 GLY 1 2HA GLY 1 42.473 -10.365 -10.456 4 H ASP 2 H ASP 2 42.132 -7.261 -9.003 5 HA ASP 2 HA ASP 2 39.531 -7.766 -7.765 6 HB2 ASP 2 1HB ASP 2 41.876 -6.605 -6.243 7 HB3 ASP 2 2HB ASP 2 40.458 -7.421 -5.639 8 H ASP 3 H ASP 3 38.369 -5.991 -8.539 9 HA ASP 3 HA ASP 3 39.464 -3.347 -8.972 10 HB2 ASP 3 1HB ASP 3 40.216 -4.704 -10.944 11 HB3 ASP 3 2HB ASP 3 38.571 -5.248 -11.198 12 H ASP 4 H ASP 4 37.604 -1.978 -8.508 13 HA ASP 4 HA ASP 4 34.961 -2.921 -9.043 14 HB2 ASP 4 1HB ASP 4 34.153 -3.536 -7.067 15 HB3 ASP 4 2HB ASP 4 35.814 -3.948 -6.684 16 H GLU 5 H GLU 5 33.303 -1.307 -8.136 17 HA GLU 5 HA GLU 5 34.190 1.375 -7.701 18 HB2 GLU 5 1HB GLU 5 33.341 2.534 -9.568 19 HB3 GLU 5 2HB GLU 5 34.554 1.382 -10.055 20 HG2 GLU 5 1HG GLU 5 33.171 1.012 -11.766 21 HG3 GLU 5 2HG GLU 5 32.448 -0.143 -10.665 22 HA PRO 6 HA PRO 6 30.308 -0.178 -5.889 23 HB2 PRO 6 1HB PRO 6 30.595 0.650 -3.337 24 HB3 PRO 6 2HB PRO 6 31.688 -0.539 -4.094 25 HG2 PRO 6 1HG PRO 6 32.209 2.426 -3.790 26 HG3 PRO 6 2HG PRO 6 33.254 1.062 -3.257 27 HD2 PRO 6 1HD PRO 6 33.537 2.310 -5.695 28 HD3 PRO 6 2HD PRO 6 33.913 0.580 -5.453 29 H GLY 7 H GLY 7 29.701 1.603 -7.582 30 HA2 GLY 7 1HA GLY 7 29.785 4.185 -6.610 31 HA3 GLY 7 2HA GLY 7 29.301 3.683 -8.237 32 H GLY 8 H GLY 8 27.229 2.296 -5.917 33 HA2 GLY 8 1HA GLY 8 25.114 4.305 -6.545 34 HA3 GLY 8 2HA GLY 8 24.871 2.553 -6.614 35 H LYS 9 H LYS 9 23.431 4.499 -4.960 36 HA LYS 9 HA LYS 9 23.672 3.349 -2.369 37 HB2 LYS 9 1HB LYS 9 25.236 5.389 -2.550 38 HB3 LYS 9 2HB LYS 9 23.771 6.370 -2.714 39 HG2 LYS 9 1HG LYS 9 23.009 5.760 -0.519 40 HG3 LYS 9 2HG LYS 9 24.156 4.402 -0.439 41 HD2 LYS 9 1HD LYS 9 26.041 6.029 -0.434 42 HD3 LYS 9 2HD LYS 9 24.864 7.355 -0.307 43 HE2 LYS 9 1HE LYS 9 24.202 6.736 1.846 44 HE3 LYS 9 2HE LYS 9 24.617 5.033 1.606 45 HZ1 LYS 9 3HZ LYS 9 26.116 6.170 3.102 46 HZ2 LYS 9 1HZ LYS 9 26.634 7.150 1.872 47 HZ3 LYS 9 2HZ LYS 9 26.894 5.518 1.792 48 H GLY 10 H GLY 10 21.637 4.256 -1.182 49 HA2 GLY 10 1HA GLY 10 19.555 5.512 -2.742 50 HA3 GLY 10 2HA GLY 10 19.213 3.806 -2.473 51 H ALA 11 H ALA 11 17.739 3.640 -0.867 52 HA ALA 11 HA ALA 11 18.087 5.155 1.641 53 HB1 ALA 11 1HB ALA 11 15.534 5.237 -0.035 54 HB2 ALA 11 2HB ALA 11 15.805 6.061 1.518 55 HB3 ALA 11 3HB ALA 11 16.714 6.553 0.089 56 H MET 12 H MET 12 15.421 4.437 2.615 57 HA MET 12 HA MET 12 14.864 1.716 2.200 58 HB2 MET 12 1HB MET 12 15.274 2.869 5.016 59 HB3 MET 12 2HB MET 12 14.313 1.443 4.662 60 HG2 MET 12 1HG MET 12 16.496 0.767 3.278 61 HG3 MET 12 2HG MET 12 17.214 1.929 4.365 62 HE1 MET 12 3HE MET 12 15.330 -2.126 5.479 63 HE2 MET 12 1HE MET 12 14.322 -0.693 5.144 64 HE3 MET 12 2HE MET 12 15.388 -1.334 3.888 65 H TYR 13 H TYR 13 12.702 1.411 3.192 66 HA TYR 13 HA TYR 13 10.904 3.700 3.344 67 HB2 TYR 13 1HB TYR 13 11.164 1.910 0.904 68 HB3 TYR 13 2HB TYR 13 9.640 2.649 1.299 69 HD1 TYR 13 1HD TYR 13 10.255 5.413 2.084 70 HD2 TYR 13 2HD TYR 13 11.971 2.985 -1.048 71 HE1 TYR 13 1HE TYR 13 10.743 7.439 0.799 72 HE2 TYR 13 2HE TYR 13 12.553 5.050 -2.293 73 HH TYR 13 HH TYR 13 12.694 7.393 -2.204 74 H GLU 14 H GLU 14 8.671 2.956 3.789 75 HA GLU 14 HA GLU 14 8.024 0.305 4.583 76 HB2 GLU 14 1HB GLU 14 9.621 0.556 6.330 77 HB3 GLU 14 2HB GLU 14 9.175 2.228 6.644 78 HG2 GLU 14 1HG GLU 14 7.099 1.540 7.702 79 HG3 GLU 14 2HG GLU 14 7.342 -0.136 7.193 80 H VAL 15 H VAL 15 5.777 0.352 4.496 81 HA VAL 15 HA VAL 15 4.338 2.930 4.777 82 HB VAL 15 HB VAL 15 3.174 2.306 2.535 83 HG11 VAL 15 1HG1 VAL 15 4.408 4.096 2.892 84 HG12 VAL 15 2HG1 VAL 15 5.893 3.196 2.491 85 HG13 VAL 15 3HG1 VAL 15 4.597 3.453 1.275 86 HG21 VAL 15 3HG2 VAL 15 4.333 0.866 0.977 87 HG22 VAL 15 1HG2 VAL 15 5.027 0.051 2.402 88 HG23 VAL 15 2HG2 VAL 15 3.306 0.130 2.205 89 H THR 16 H THR 16 2.014 2.690 5.098 90 HA THR 16 HA THR 16 1.223 -0.031 6.011 91 HB THR 16 HB THR 16 -0.253 1.378 7.638 92 HG1 THR 16 1HG THR 16 0.628 3.361 8.162 93 HG21 THR 16 3HG2 THR 16 2.770 1.198 8.046 94 HG22 THR 16 1HG2 THR 16 1.529 -0.033 8.441 95 HG23 THR 16 2HG2 THR 16 1.565 1.490 9.323 96 H ILE 17 H ILE 17 -0.959 -0.565 5.978 97 HA ILE 17 HA ILE 17 -2.732 1.254 4.502 98 HB ILE 17 HB ILE 17 -2.038 -0.411 2.920 99 HG12 ILE 17 1HG1 ILE 17 -4.168 -1.441 2.263 100 HG13 ILE 17 2HG1 ILE 17 -4.804 -1.254 3.894 101 HG21 ILE 17 1HG2 ILE 17 -2.353 -2.793 3.089 102 HG22 ILE 17 2HG2 ILE 17 -1.247 -2.224 4.341 103 HG23 ILE 17 3HG2 ILE 17 -2.935 -2.648 4.736 104 HD11 ILE 17 3HD1 ILE 17 -5.717 0.422 2.328 105 HD12 ILE 17 1HD1 ILE 17 -4.810 1.196 3.639 106 HD13 ILE 17 2HD1 ILE 17 -4.076 1.041 2.030 107 H GLU 18 H GLU 18 -4.134 1.904 6.111 108 HA GLU 18 HA GLU 18 -5.212 -0.204 7.924 109 HB2 GLU 18 1HB GLU 18 -5.536 2.825 7.905 110 HB3 GLU 18 2HB GLU 18 -6.384 1.722 8.955 111 HG2 GLU 18 1HG GLU 18 -4.180 0.973 9.922 112 HG3 GLU 18 2HG GLU 18 -3.372 2.229 8.938 113 H GLN 19 H GLN 19 -7.401 -0.739 7.718 114 HA GLN 19 HA GLN 19 -8.982 0.560 5.585 115 HB2 GLN 19 1HB GLN 19 -8.603 -2.412 6.206 116 HB3 GLN 19 2HB GLN 19 -9.966 -1.798 5.282 117 HG2 GLN 19 1HG GLN 19 -8.176 -0.582 3.801 118 HG3 GLN 19 2HG GLN 19 -6.992 -1.568 4.599 119 HE21 GLN 19 1HE2 GLN 19 -7.255 -3.968 4.367 120 HE22 GLN 19 2HE2 GLN 19 -8.039 -4.641 2.971 121 H SER 20 H SER 20 -10.917 1.299 6.264 122 HA SER 20 HA SER 20 -12.038 0.504 8.847 123 HB2 SER 20 1HB SER 20 -11.216 3.355 8.148 124 HB3 SER 20 2HB SER 20 -11.857 2.749 9.688 125 HG SER 20 HG SER 20 -9.890 1.348 9.647 126 H GLY 21 H GLY 21 -14.058 2.266 9.104 127 HA2 GLY 21 1HA GLY 21 -16.165 2.619 8.343 128 HA3 GLY 21 2HA GLY 21 -15.532 2.781 6.699 129 H ASP 22 H ASP 22 -17.184 1.469 5.751 130 HA ASP 22 HA ASP 22 -17.935 -1.091 6.845 131 HB2 ASP 22 1HB ASP 22 -19.355 0.686 5.655 132 HB3 ASP 22 2HB ASP 22 -18.632 0.120 4.163 133 H PHE 23 H PHE 23 -15.396 -1.677 6.602 134 HA PHE 23 HA PHE 23 -14.615 -2.417 3.912 135 HB2 PHE 23 1HB PHE 23 -12.503 -3.076 4.865 136 HB3 PHE 23 2HB PHE 23 -12.997 -1.519 5.470 137 HD1 PHE 23 2HD PHE 23 -12.428 -5.067 6.382 138 HD2 PHE 23 1HD PHE 23 -13.400 -1.138 7.836 139 HE1 PHE 23 2HE PHE 23 -11.838 -5.777 8.666 140 HE2 PHE 23 1HE PHE 23 -12.824 -1.847 10.145 141 HZ PHE 23 HZ PHE 23 -12.023 -4.162 10.561 142 H ARG 24 H ARG 24 -16.983 -3.779 4.521 143 HA ARG 24 HA ARG 24 -16.062 -6.531 5.165 144 HB2 ARG 24 1HB ARG 24 -18.769 -5.217 5.525 145 HB3 ARG 24 2HB ARG 24 -18.395 -6.896 5.939 146 HG2 ARG 24 1HG ARG 24 -16.750 -6.142 7.606 147 HG3 ARG 24 2HG ARG 24 -17.016 -4.439 7.167 148 HD2 ARG 24 1HD ARG 24 -19.293 -4.499 7.853 149 HD3 ARG 24 2HD ARG 24 -19.279 -6.248 8.063 150 HE ARG 24 HE ARG 24 -17.763 -6.053 9.909 151 HH11 ARG 24 1HH1 ARG 24 -19.748 -3.151 9.168 152 HH12 ARG 24 2HH1 ARG 24 -19.323 -2.354 10.645 153 HH21 ARG 24 1HH2 ARG 24 -17.600 -5.145 11.973 154 HH22 ARG 24 2HH2 ARG 24 -18.456 -3.696 12.363 155 H SER 25 H SER 25 -17.280 -4.823 2.467 156 HA SER 25 HA SER 25 -17.298 -7.355 1.014 157 HB2 SER 25 1HB SER 25 -19.664 -6.805 1.969 158 HB3 SER 25 2HB SER 25 -19.718 -5.529 0.755 159 HG SER 25 HG SER 25 -19.729 -7.041 -0.815 160 H PHE 26 H PHE 26 -15.322 -6.385 0.311 161 HA PHE 26 HA PHE 26 -15.765 -4.660 -2.015 162 HB2 PHE 26 1HB PHE 26 -14.035 -3.871 0.347 163 HB3 PHE 26 2HB PHE 26 -13.526 -3.491 -1.263 164 HD1 PHE 26 1HD PHE 26 -15.236 -2.335 -2.865 165 HD2 PHE 26 2HD PHE 26 -15.620 -2.377 1.433 166 HE1 PHE 26 1HE PHE 26 -16.352 -0.144 -2.945 167 HE2 PHE 26 2HE PHE 26 -16.941 -0.288 1.330 168 HZ PHE 26 HZ PHE 26 -17.281 0.870 -0.847 169 H ILE 27 H ILE 27 -13.860 -4.733 -3.510 170 HA ILE 27 HA ILE 27 -11.937 -6.941 -3.008 171 HB ILE 27 HB ILE 27 -13.299 -6.215 -5.623 172 HG12 ILE 27 1HG1 ILE 27 -13.697 -8.569 -3.684 173 HG13 ILE 27 2HG1 ILE 27 -14.902 -7.393 -4.223 174 HG21 ILE 27 1HG2 ILE 27 -11.384 -8.545 -4.973 175 HG22 ILE 27 2HG2 ILE 27 -12.081 -8.168 -6.569 176 HG23 ILE 27 3HG2 ILE 27 -10.917 -7.075 -5.858 177 HD11 ILE 27 3HD1 ILE 27 -14.636 -8.343 -6.559 178 HD12 ILE 27 1HD1 ILE 27 -13.705 -9.671 -5.822 179 HD13 ILE 27 2HD1 ILE 27 -15.394 -9.403 -5.347 180 H LYS 28 H LYS 28 -10.354 -5.412 -2.340 181 HA LYS 28 HA LYS 28 -9.681 -3.180 -4.183 182 HB2 LYS 28 1HB LYS 28 -8.030 -2.580 -2.493 183 HB3 LYS 28 2HB LYS 28 -9.636 -2.741 -1.787 184 HG2 LYS 28 1HG LYS 28 -8.988 -4.301 -0.349 185 HG3 LYS 28 2HG LYS 28 -8.267 -5.298 -1.599 186 HD2 LYS 28 1HD LYS 28 -6.589 -4.762 -0.036 187 HD3 LYS 28 2HD LYS 28 -6.213 -3.895 -1.523 188 HE2 LYS 28 1HE LYS 28 -7.923 -2.296 0.225 189 HE3 LYS 28 2HE LYS 28 -6.534 -2.870 1.147 190 HZ1 LYS 28 3HZ LYS 28 -5.079 -1.836 -0.413 191 HZ2 LYS 28 1HZ LYS 28 -6.254 -0.718 -0.049 192 HZ3 LYS 28 2HZ LYS 28 -6.303 -1.528 -1.468 193 H SER 29 H SER 29 -7.386 -2.886 -4.800 194 HA SER 29 HA SER 29 -5.772 -5.370 -4.876 195 HB2 SER 29 1HB SER 29 -6.644 -4.825 -7.188 196 HB3 SER 29 2HB SER 29 -5.755 -3.292 -7.102 197 HG SER 29 HG SER 29 -4.490 -4.932 -8.128 198 H VAL 30 H VAL 30 -3.471 -4.894 -4.780 199 HA VAL 30 HA VAL 30 -2.679 -2.123 -4.506 200 HB VAL 30 HB VAL 30 -1.707 -4.097 -2.411 201 HG11 VAL 30 1HG1 VAL 30 -0.564 -2.104 -1.497 202 HG12 VAL 30 2HG1 VAL 30 -0.095 -2.313 -3.180 203 HG13 VAL 30 3HG1 VAL 30 -1.279 -1.078 -2.759 204 HG21 VAL 30 3HG2 VAL 30 -4.010 -3.365 -1.862 205 HG22 VAL 30 1HG2 VAL 30 -2.839 -2.610 -0.763 206 HG23 VAL 30 2HG2 VAL 30 -3.541 -1.669 -2.097 207 H VAL 31 H VAL 31 -1.347 -1.979 -6.136 208 HA VAL 31 HA VAL 31 0.575 -4.031 -7.006 209 HB VAL 31 HB VAL 31 0.344 -1.048 -7.657 210 HG11 VAL 31 1HG1 VAL 31 1.647 -1.574 -9.649 211 HG12 VAL 31 2HG1 VAL 31 2.523 -2.106 -8.215 212 HG13 VAL 31 3HG1 VAL 31 1.675 -3.294 -9.225 213 HG21 VAL 31 3HG2 VAL 31 -0.806 -1.664 -9.753 214 HG22 VAL 31 1HG2 VAL 31 -0.975 -3.328 -9.166 215 HG23 VAL 31 2HG2 VAL 31 -1.779 -1.995 -8.327 216 H VAL 32 H VAL 32 2.630 -4.118 -5.963 217 HA VAL 32 HA VAL 32 3.554 -1.728 -4.452 218 HB VAL 32 HB VAL 32 3.758 -4.660 -3.616 219 HG11 VAL 32 1HG1 VAL 32 4.858 -2.138 -2.311 220 HG12 VAL 32 2HG1 VAL 32 4.750 -3.712 -1.514 221 HG13 VAL 32 3HG1 VAL 32 5.789 -3.520 -2.922 222 HG21 VAL 32 3HG2 VAL 32 2.135 -2.317 -2.551 223 HG22 VAL 32 1HG2 VAL 32 1.552 -3.911 -3.105 224 HG23 VAL 32 2HG2 VAL 32 2.444 -3.784 -1.593 225 H VAL 33 H VAL 33 5.775 -1.306 -4.665 226 HA VAL 33 HA VAL 33 7.424 -3.067 -6.359 227 HB VAL 33 HB VAL 33 7.139 -0.059 -6.795 228 HG11 VAL 33 1HG1 VAL 33 8.633 -2.193 -8.400 229 HG12 VAL 33 2HG1 VAL 33 8.430 -0.497 -8.883 230 HG13 VAL 33 3HG1 VAL 33 9.352 -0.880 -7.441 231 HG21 VAL 33 3HG2 VAL 33 5.065 -1.074 -7.603 232 HG22 VAL 33 1HG2 VAL 33 6.056 -0.597 -8.967 233 HG23 VAL 33 2HG2 VAL 33 5.962 -2.318 -8.477 234 H ALA 34 H ALA 34 9.680 -2.848 -5.801 235 HA ALA 34 HA ALA 34 10.493 -0.794 -3.934 236 HB1 ALA 34 1HB ALA 34 9.928 -2.655 -2.407 237 HB2 ALA 34 2HB ALA 34 11.046 -3.712 -3.311 238 HB3 ALA 34 3HB ALA 34 11.668 -2.301 -2.457 239 H ASN 35 H ASN 35 12.188 0.071 -4.984 240 HA ASN 35 HA ASN 35 13.734 -1.327 -7.058 241 HB2 ASN 35 1HB ASN 35 13.245 1.103 -7.083 242 HB3 ASN 35 2HB ASN 35 14.223 1.315 -5.637 243 HD21 ASN 35 1HD2 ASN 35 14.316 1.988 -8.748 244 HD22 ASN 35 2HD2 ASN 35 16.048 1.899 -9.043 245 H GLY 36 H GLY 36 15.491 -2.579 -6.648 246 HA2 GLY 36 1HA GLY 36 17.666 -2.861 -6.057 247 HA3 GLY 36 2HA GLY 36 17.495 -1.650 -4.779 248 H THR 37 H THR 37 15.035 -3.983 -4.364 249 HA THR 37 HA THR 37 16.525 -5.819 -2.733 250 HB THR 37 HB THR 37 16.708 -3.713 -1.449 251 HG1 THR 37 1HG THR 37 15.071 -5.369 0.064 252 HG21 THR 37 3HG2 THR 37 13.695 -3.931 -1.139 253 HG22 THR 37 1HG2 THR 37 14.547 -2.709 -2.100 254 HG23 THR 37 2HG2 THR 37 14.771 -2.744 -0.355 255 H GLN 38 H GLN 38 14.748 -6.865 -1.093 256 HA GLN 38 HA GLN 38 12.250 -7.339 -2.606 257 HB2 GLN 38 1HB GLN 38 13.958 -9.138 -0.822 258 HB3 GLN 38 2HB GLN 38 12.242 -9.435 -1.082 259 HG2 GLN 38 1HG GLN 38 13.142 -10.727 -2.771 260 HG3 GLN 38 2HG GLN 38 12.741 -9.237 -3.598 261 HE21 GLN 38 1HE2 GLN 38 14.378 -7.904 -4.484 262 HE22 GLN 38 2HE2 GLN 38 15.986 -8.563 -4.697 263 H LEU 39 H LEU 39 10.509 -8.050 -1.002 264 HA LEU 39 HA LEU 39 10.100 -5.773 0.810 265 HB2 LEU 39 1HB LEU 39 8.699 -6.387 -1.367 266 HB3 LEU 39 2HB LEU 39 8.031 -7.655 -0.354 267 HG LEU 39 HG LEU 39 7.423 -5.742 1.304 268 HD11 LEU 39 1HD1 LEU 39 7.195 -3.502 0.291 269 HD12 LEU 39 2HD1 LEU 39 7.931 -4.084 -1.219 270 HD13 LEU 39 3HD1 LEU 39 8.891 -4.002 0.271 271 HD21 LEU 39 3HD2 LEU 39 5.373 -5.242 0.055 272 HD22 LEU 39 1HD2 LEU 39 5.778 -6.944 -0.053 273 HD23 LEU 39 2HD2 LEU 39 6.100 -5.875 -1.435 274 H LYS 40 H LYS 40 8.699 -6.282 2.649 275 HA LYS 40 HA LYS 40 8.801 -9.063 3.673 276 HB2 LYS 40 1HB LYS 40 10.551 -7.704 4.739 277 HB3 LYS 40 2HB LYS 40 9.347 -6.536 5.300 278 HG2 LYS 40 1HG LYS 40 8.224 -8.373 6.597 279 HG3 LYS 40 2HG LYS 40 9.434 -9.511 5.979 280 HD2 LYS 40 1HD LYS 40 11.212 -8.044 7.082 281 HD3 LYS 40 2HD LYS 40 9.883 -7.162 7.869 282 HE2 LYS 40 1HE LYS 40 9.062 -9.342 8.821 283 HE3 LYS 40 2HE LYS 40 10.395 -10.165 8.005 284 HZ1 LYS 40 3HZ LYS 40 11.864 -8.591 9.372 285 HZ2 LYS 40 1HZ LYS 40 11.185 -9.884 10.089 286 HZ3 LYS 40 2HZ LYS 40 10.531 -8.404 10.345 287 H ASP 41 H ASP 41 6.792 -9.670 3.776 288 HA ASP 41 HA ASP 41 4.532 -7.821 3.813 289 HB2 ASP 41 1HB ASP 41 4.531 -10.209 2.811 290 HB3 ASP 41 2HB ASP 41 4.318 -10.756 4.481 291 H GLY 42 H GLY 42 3.831 -6.786 5.663 292 HA2 GLY 42 1HA GLY 42 4.982 -7.388 8.225 293 HA3 GLY 42 2HA GLY 42 3.700 -6.226 7.878 294 H ALA 43 H ALA 43 2.354 -8.960 6.552 295 HA ALA 43 HA ALA 43 0.572 -9.473 8.676 296 HB1 ALA 43 1HB ALA 43 0.076 -9.964 6.312 297 HB2 ALA 43 2HB ALA 43 1.366 -11.173 6.254 298 HB3 ALA 43 3HB ALA 43 -0.047 -11.450 7.288 299 H THR 44 H THR 44 3.162 -11.549 7.383 300 HA THR 44 HA THR 44 3.471 -12.946 9.974 301 HB THR 44 HB THR 44 3.846 -14.906 8.075 302 HG1 THR 44 1HG THR 44 2.320 -14.802 6.570 303 HG21 THR 44 3HG2 THR 44 1.595 -15.683 8.720 304 HG22 THR 44 1HG2 THR 44 1.178 -14.048 9.294 305 HG23 THR 44 2HG2 THR 44 2.427 -14.998 10.126 306 H GLY 45 H GLY 45 5.084 -10.952 7.913 307 HA2 GLY 45 1HA GLY 45 7.237 -10.334 8.032 308 HA3 GLY 45 2HA GLY 45 7.671 -11.801 8.940 309 H GLU 46 H GLU 46 5.834 -12.109 5.980 310 HA GLU 46 HA GLU 46 7.688 -14.044 4.984 311 HB2 GLU 46 1HB GLU 46 5.172 -12.754 3.837 312 HB3 GLU 46 2HB GLU 46 6.040 -14.070 3.041 313 HG2 GLU 46 1HG GLU 46 5.020 -14.266 5.920 314 HG3 GLU 46 2HG GLU 46 4.047 -14.738 4.551 315 H SER 47 H SER 47 9.450 -13.740 3.733 316 HA SER 47 HA SER 47 10.068 -11.191 2.528 317 HB2 SER 47 1HB SER 47 11.880 -13.030 1.539 318 HB3 SER 47 2HB SER 47 12.055 -12.073 3.008 319 HG SER 47 HG SER 47 11.182 -14.752 2.713 320 H LEU 48 H LEU 48 9.106 -10.508 0.735 321 HA LEU 48 HA LEU 48 8.411 -12.504 -1.401 322 HB2 LEU 48 1HB LEU 48 6.997 -9.897 -0.776 323 HB3 LEU 48 2HB LEU 48 6.530 -11.103 -1.971 324 HG LEU 48 HG LEU 48 6.470 -11.464 1.062 325 HD11 LEU 48 1HD1 LEU 48 4.896 -9.911 0.192 326 HD12 LEU 48 2HD1 LEU 48 4.052 -11.370 0.762 327 HD13 LEU 48 3HD1 LEU 48 4.263 -11.105 -0.986 328 HD21 LEU 48 3HD2 LEU 48 5.171 -13.541 0.538 329 HD22 LEU 48 1HD2 LEU 48 6.882 -13.626 0.127 330 HD23 LEU 48 2HD2 LEU 48 5.682 -13.377 -1.167 331 H ALA 49 H ALA 49 8.863 -11.977 -3.467 332 HA ALA 49 HA ALA 49 10.746 -9.745 -3.860 333 HB1 ALA 49 1HB ALA 49 11.046 -10.820 -6.100 334 HB2 ALA 49 2HB ALA 49 11.498 -11.842 -4.708 335 HB3 ALA 49 3HB ALA 49 9.961 -12.113 -5.537 336 H SER 50 H SER 50 9.529 -7.991 -3.746 337 HA SER 50 HA SER 50 7.329 -7.212 -5.353 338 HB2 SER 50 1HB SER 50 8.750 -4.993 -5.089 339 HB3 SER 50 2HB SER 50 7.982 -5.726 -3.675 340 HG SER 50 HG SER 50 10.717 -5.929 -4.456 341 HA PRO 51 HA PRO 51 7.005 -5.226 -6.817 342 HB2 PRO 51 1HB PRO 51 6.003 -4.952 -9.346 343 HB3 PRO 51 2HB PRO 51 7.430 -4.044 -8.761 344 HG2 PRO 51 1HG PRO 51 7.391 -6.568 -10.403 345 HG3 PRO 51 2HG PRO 51 8.358 -5.087 -10.682 346 HD2 PRO 51 1HD PRO 51 9.375 -7.293 -9.396 347 HD3 PRO 51 2HD PRO 51 9.868 -5.632 -8.958 348 H VAL 52 H VAL 52 4.952 -5.931 -6.245 349 HA VAL 52 HA VAL 52 4.066 -8.593 -7.185 350 HB VAL 52 HB VAL 52 5.510 -8.917 -5.251 351 HG11 VAL 52 1HG1 VAL 52 3.571 -7.160 -3.713 352 HG12 VAL 52 2HG1 VAL 52 4.905 -8.099 -3.014 353 HG13 VAL 52 3HG1 VAL 52 5.250 -6.754 -4.114 354 HG21 VAL 52 3HG2 VAL 52 3.562 -10.426 -5.584 355 HG22 VAL 52 1HG2 VAL 52 4.039 -10.270 -3.888 356 HG23 VAL 52 2HG2 VAL 52 2.607 -9.410 -4.474 357 H ILE 53 H ILE 53 1.812 -9.000 -6.710 358 HA ILE 53 HA ILE 53 0.176 -6.543 -6.415 359 HB ILE 53 HB ILE 53 -0.470 -8.981 -8.100 360 HG12 ILE 53 1HG1 ILE 53 1.299 -7.994 -9.324 361 HG13 ILE 53 2HG1 ILE 53 -0.219 -7.560 -10.086 362 HG21 ILE 53 1HG2 ILE 53 -2.295 -7.520 -8.979 363 HG22 ILE 53 2HG2 ILE 53 -2.443 -7.840 -7.254 364 HG23 ILE 53 3HG2 ILE 53 -1.836 -6.269 -7.801 365 HD11 ILE 53 3HD1 ILE 53 1.212 -5.671 -10.175 366 HD12 ILE 53 1HD1 ILE 53 -0.106 -5.312 -9.047 367 HD13 ILE 53 2HD1 ILE 53 1.516 -5.715 -8.441 368 H LEU 54 H LEU 54 -0.994 -6.731 -4.568 369 HA LEU 54 HA LEU 54 -1.333 -9.417 -3.321 370 HB2 LEU 54 1HB LEU 54 -1.845 -6.591 -2.318 371 HB3 LEU 54 2HB LEU 54 -2.325 -8.035 -1.435 372 HG LEU 54 HG LEU 54 0.533 -7.259 -2.179 373 HD11 LEU 54 1HD1 LEU 54 0.814 -7.015 0.285 374 HD12 LEU 54 2HD1 LEU 54 -0.889 -7.371 0.506 375 HD13 LEU 54 3HD1 LEU 54 -0.394 -5.898 -0.367 376 HD21 LEU 54 3HD2 LEU 54 0.403 -9.711 -2.189 377 HD22 LEU 54 1HD2 LEU 54 -0.453 -9.691 -0.626 378 HD23 LEU 54 2HD2 LEU 54 1.223 -9.180 -0.741 379 H SER 55 H SER 55 -3.230 -10.433 -3.190 380 HA SER 55 HA SER 55 -5.506 -9.601 -4.786 381 HB2 SER 55 1HB SER 55 -5.861 -11.880 -3.011 382 HB3 SER 55 2HB SER 55 -5.978 -11.810 -4.757 383 HG SER 55 HG SER 55 -4.063 -12.869 -3.175 384 H ASP 56 H ASP 56 -7.735 -9.732 -3.600 385 HA ASP 56 HA ASP 56 -7.901 -8.209 -1.153 386 HB2 ASP 56 1HB ASP 56 -9.796 -8.474 -2.737 387 HB3 ASP 56 2HB ASP 56 -9.832 -10.218 -2.420 388 H GLU 57 H GLU 57 -7.520 -11.668 -1.899 389 HA GLU 57 HA GLU 57 -8.222 -12.802 0.602 390 HB2 GLU 57 1HB GLU 57 -6.354 -13.551 -1.675 391 HB3 GLU 57 2HB GLU 57 -6.500 -14.593 -0.266 392 HG2 GLU 57 1HG GLU 57 -8.902 -13.698 -1.930 393 HG3 GLU 57 2HG GLU 57 -7.964 -15.121 -2.333 394 H GLU 58 H GLU 58 -5.356 -11.105 -0.392 395 HA GLU 58 HA GLU 58 -3.749 -12.033 1.890 396 HB2 GLU 58 1HB GLU 58 -2.839 -9.795 0.121 397 HB3 GLU 58 2HB GLU 58 -1.894 -11.110 0.821 398 HG2 GLU 58 1HG GLU 58 -3.765 -11.211 -1.582 399 HG3 GLU 58 2HG GLU 58 -2.009 -11.267 -1.635 400 H LEU 59 H LEU 59 -5.678 -9.316 0.904 401 HA LEU 59 HA LEU 59 -4.637 -7.651 3.139 402 HB2 LEU 59 1HB LEU 59 -5.609 -7.036 0.357 403 HB3 LEU 59 2HB LEU 59 -5.705 -5.802 1.614 404 HG LEU 59 HG LEU 59 -3.119 -7.238 0.889 405 HD11 LEU 59 1HD1 LEU 59 -2.516 -5.076 -0.188 406 HD12 LEU 59 2HD1 LEU 59 -4.156 -4.486 0.141 407 HD13 LEU 59 3HD1 LEU 59 -3.896 -5.852 -0.976 408 HD21 LEU 59 3HD2 LEU 59 -3.720 -4.806 2.646 409 HD22 LEU 59 1HD2 LEU 59 -2.094 -5.278 2.112 410 HD23 LEU 59 2HD2 LEU 59 -3.003 -6.351 3.164 411 H ALA 60 H ALA 60 -7.220 -9.492 2.553 412 HA ALA 60 HA ALA 60 -9.371 -8.090 3.770 413 HB1 ALA 60 1HB ALA 60 -9.663 -10.104 2.428 414 HB2 ALA 60 2HB ALA 60 -8.657 -11.048 3.569 415 HB3 ALA 60 3HB ALA 60 -10.235 -10.385 4.058 416 H VAL 61 H VAL 61 -7.237 -7.337 5.188 417 HA VAL 61 HA VAL 61 -7.664 -8.356 7.924 418 HB VAL 61 HB VAL 61 -5.345 -7.480 8.406 419 HG11 VAL 61 1HG1 VAL 61 -4.232 -9.484 7.757 420 HG12 VAL 61 2HG1 VAL 61 -5.924 -9.915 8.086 421 HG13 VAL 61 3HG1 VAL 61 -5.356 -9.771 6.418 422 HG21 VAL 61 3HG2 VAL 61 -5.007 -6.081 6.361 423 HG22 VAL 61 1HG2 VAL 61 -3.710 -7.251 6.636 424 HG23 VAL 61 2HG2 VAL 61 -4.916 -7.571 5.395 425 H GLU 62 H GLU 62 -7.597 -6.586 9.545 426 HA GLU 62 HA GLU 62 -8.766 -4.121 8.757 427 HB2 GLU 62 1HB GLU 62 -7.852 -3.303 11.011 428 HB3 GLU 62 2HB GLU 62 -9.000 -4.637 11.042 429 HG2 GLU 62 1HG GLU 62 -7.555 -6.085 11.862 430 HG3 GLU 62 2HG GLU 62 -6.212 -5.601 10.864 431 H LYS 63 H LYS 63 -5.271 -4.988 9.257 432 HA LYS 63 HA LYS 63 -4.532 -2.685 7.676 433 HB2 LYS 63 1HB LYS 63 -4.787 -1.524 9.724 434 HB3 LYS 63 2HB LYS 63 -4.126 -2.830 10.675 435 HG2 LYS 63 1HG LYS 63 -2.254 -1.408 8.742 436 HG3 LYS 63 2HG LYS 63 -2.778 -0.591 10.209 437 HD2 LYS 63 1HD LYS 63 -2.074 -2.397 11.587 438 HD3 LYS 63 2HD LYS 63 -1.446 -3.305 10.199 439 HE2 LYS 63 1HE LYS 63 0.468 -2.102 10.147 440 HE3 LYS 63 2HE LYS 63 -0.416 -0.581 10.250 441 HZ1 LYS 63 3HZ LYS 63 0.912 -0.816 12.216 442 HZ2 LYS 63 1HZ LYS 63 0.264 -2.324 12.535 443 HZ3 LYS 63 2HZ LYS 63 -0.668 -0.996 12.639 444 H VAL 64 H VAL 64 -2.317 -2.852 6.875 445 HA VAL 64 HA VAL 64 -0.659 -4.699 8.351 446 HB VAL 64 HB VAL 64 -1.678 -6.145 6.673 447 HG11 VAL 64 1HG1 VAL 64 -1.989 -4.775 4.770 448 HG12 VAL 64 2HG1 VAL 64 -0.244 -4.435 4.627 449 HG13 VAL 64 3HG1 VAL 64 -0.872 -6.068 4.321 450 HG21 VAL 64 3HG2 VAL 64 0.571 -6.618 7.647 451 HG22 VAL 64 1HG2 VAL 64 0.242 -7.367 6.083 452 HG23 VAL 64 2HG2 VAL 64 1.286 -5.955 6.149 453 H THR 65 H THR 65 1.641 -4.457 7.551 454 HA THR 65 HA THR 65 2.315 -1.720 6.674 455 HB THR 65 HB THR 65 3.918 -3.519 8.534 456 HG1 THR 65 1HG THR 65 3.109 -1.211 9.660 457 HG21 THR 65 3HG2 THR 65 5.262 -1.511 9.020 458 HG22 THR 65 1HG2 THR 65 4.308 -0.571 7.860 459 HG23 THR 65 2HG2 THR 65 5.319 -1.912 7.300 460 H LEU 66 H LEU 66 3.952 -1.764 4.987 461 HA LEU 66 HA LEU 66 5.073 -4.413 4.241 462 HB2 LEU 66 1HB LEU 66 4.070 -2.279 2.299 463 HB3 LEU 66 2HB LEU 66 5.195 -3.553 1.880 464 HG LEU 66 HG LEU 66 3.114 -4.218 1.065 465 HD11 LEU 66 1HD1 LEU 66 2.666 -6.332 2.174 466 HD12 LEU 66 2HD1 LEU 66 3.477 -5.807 3.640 467 HD13 LEU 66 3HD1 LEU 66 4.418 -6.048 2.147 468 HD21 LEU 66 3HD2 LEU 66 1.067 -4.377 2.297 469 HD22 LEU 66 1HD2 LEU 66 1.730 -2.737 2.547 470 HD23 LEU 66 2HD2 LEU 66 1.887 -3.977 3.815 471 H SER 67 H SER 67 7.211 -4.331 4.092 472 HA SER 67 HA SER 67 8.593 -1.718 3.977 473 HB2 SER 67 1HB SER 67 9.533 -3.598 6.081 474 HB3 SER 67 2HB SER 67 9.487 -1.826 6.025 475 HG SER 67 HG SER 67 7.330 -3.607 6.527 476 H THR 68 H THR 68 11.169 -2.329 4.039 477 HA THR 68 HA THR 68 11.435 -4.609 2.123 478 HB THR 68 HB THR 68 13.443 -3.225 1.364 479 HG1 THR 68 1HG THR 68 13.141 -1.696 3.130 480 HG21 THR 68 3HG2 THR 68 10.581 -2.338 0.824 481 HG22 THR 68 1HG2 THR 68 11.458 -3.619 -0.023 482 HG23 THR 68 2HG2 THR 68 11.980 -1.940 -0.207 483 H THR 69 H THR 69 13.137 -5.907 2.126 484 HA THR 69 HA THR 69 14.393 -6.409 4.628 485 HB THR 69 HB THR 69 15.490 -8.217 3.274 486 HG1 THR 69 1HG THR 69 15.610 -8.049 1.231 487 HG21 THR 69 3HG2 THR 69 13.157 -8.604 4.093 488 HG22 THR 69 1HG2 THR 69 13.488 -9.435 2.559 489 HG23 THR 69 2HG2 THR 69 12.524 -7.953 2.565 490 H GLY 70 H GLY 70 15.242 -4.166 2.200 491 HA2 GLY 70 1HA GLY 70 18.001 -3.824 3.062 492 HA3 GLY 70 2HA GLY 70 17.780 -4.588 1.486 493 H LYS 71 H LYS 71 18.930 -2.658 0.861 494 HA LYS 71 HA LYS 71 18.077 0.003 1.184 495 HB2 LYS 71 1HB LYS 71 20.317 -1.105 0.280 496 HB3 LYS 71 2HB LYS 71 19.516 -0.972 -1.293 497 HG2 LYS 71 1HG LYS 71 19.183 1.554 -0.627 498 HG3 LYS 71 2HG LYS 71 20.391 1.204 0.623 499 HD2 LYS 71 1HD LYS 71 21.724 1.885 -1.211 500 HD3 LYS 71 2HD LYS 71 21.770 0.128 -1.328 501 HE2 LYS 71 1HE LYS 71 19.703 0.329 -2.872 502 HE3 LYS 71 2HE LYS 71 19.974 2.071 -2.823 503 HZ1 LYS 71 3HZ LYS 71 21.433 -0.057 -4.184 504 HZ2 LYS 71 1HZ LYS 71 22.406 1.073 -3.540 505 HZ3 LYS 71 2HZ LYS 71 21.275 1.490 -4.677 506 H ALA 72 H ALA 72 16.335 1.016 0.355 507 HA ALA 72 HA ALA 72 14.940 -0.185 -1.975 508 HB1 ALA 72 1HB ALA 72 13.651 -0.432 0.128 509 HB2 ALA 72 2HB ALA 72 13.629 1.337 0.295 510 HB3 ALA 72 3HB ALA 72 12.840 0.561 -1.094 511 H ILE 73 H ILE 73 14.508 1.310 -3.616 512 HA ILE 73 HA ILE 73 15.127 4.190 -2.987 513 HB ILE 73 HB ILE 73 15.704 3.069 -5.717 514 HG12 ILE 73 1HG1 ILE 73 17.429 2.682 -3.248 515 HG13 ILE 73 2HG1 ILE 73 16.840 1.455 -4.368 516 HG21 ILE 73 1HG2 ILE 73 16.982 5.283 -4.066 517 HG22 ILE 73 2HG2 ILE 73 17.372 4.850 -5.750 518 HG23 ILE 73 3HG2 ILE 73 15.801 5.498 -5.379 519 HD11 ILE 73 3HD1 ILE 73 19.057 1.664 -4.866 520 HD12 ILE 73 1HD1 ILE 73 18.256 2.595 -6.155 521 HD13 ILE 73 2HD1 ILE 73 19.052 3.441 -4.806 522 H GLU 74 H GLU 74 12.583 2.144 -4.093 523 HA GLU 74 HA GLU 74 11.119 4.535 -4.855 524 HB2 GLU 74 1HB GLU 74 11.214 2.041 -6.620 525 HB3 GLU 74 2HB GLU 74 10.129 3.409 -6.848 526 HG2 GLU 74 1HG GLU 74 12.050 4.880 -7.314 527 HG3 GLU 74 2HG GLU 74 13.173 3.559 -7.033 528 H PHE 75 H PHE 75 8.998 4.286 -4.115 529 HA PHE 75 HA PHE 75 7.920 1.625 -3.427 530 HB2 PHE 75 1HB PHE 75 8.130 3.882 -1.475 531 HB3 PHE 75 2HB PHE 75 6.515 3.238 -1.679 532 HD1 PHE 75 2HD PHE 75 9.662 1.294 -1.812 533 HD2 PHE 75 1HD PHE 75 6.080 2.173 0.539 534 HE1 PHE 75 2HE PHE 75 10.287 -0.433 -0.236 535 HE2 PHE 75 1HE PHE 75 6.958 0.585 2.228 536 HZ PHE 75 HZ PHE 75 8.935 -0.781 1.840 537 H ALA 76 H ALA 76 6.703 1.550 -5.223 538 HA ALA 76 HA ALA 76 4.860 3.833 -5.747 539 HB1 ALA 76 1HB ALA 76 5.951 2.852 -7.722 540 HB2 ALA 76 2HB ALA 76 5.206 1.279 -7.340 541 HB3 ALA 76 3HB ALA 76 4.184 2.672 -7.752 542 H VAL 77 H VAL 77 2.657 3.504 -5.573 543 HA VAL 77 HA VAL 77 1.610 0.948 -4.579 544 HB VAL 77 HB VAL 77 0.634 3.544 -3.331 545 HG11 VAL 77 1HG1 VAL 77 -0.795 1.516 -3.276 546 HG12 VAL 77 2HG1 VAL 77 0.509 0.626 -2.456 547 HG13 VAL 77 3HG1 VAL 77 -0.273 1.996 -1.653 548 HG21 VAL 77 3HG2 VAL 77 2.725 1.757 -2.064 549 HG22 VAL 77 1HG2 VAL 77 2.988 3.434 -2.588 550 HG23 VAL 77 2HG2 VAL 77 1.867 3.084 -1.269 551 H SER 78 H SER 78 -0.085 0.460 -6.038 552 HA SER 78 HA SER 78 -1.929 2.601 -6.549 553 HB2 SER 78 1HB SER 78 -2.173 2.047 -8.988 554 HB3 SER 78 2HB SER 78 -0.801 3.043 -8.508 555 HG SER 78 HG SER 78 -0.400 1.370 -10.053 556 H GLY 79 H GLY 79 -4.046 1.674 -7.602 557 HA2 GLY 79 1HA GLY 79 -4.903 -0.745 -8.063 558 HA3 GLY 79 2HA GLY 79 -4.590 -0.964 -6.336 559 H GLY 80 H GLY 80 -5.692 0.537 -4.840 560 HA2 GLY 80 1HA GLY 80 -7.533 1.711 -4.048 561 HA3 GLY 80 2HA GLY 80 -8.005 2.120 -5.694 562 H VAL 81 H VAL 81 -10.222 1.444 -5.437 563 HA VAL 81 HA VAL 81 -10.764 -1.360 -5.577 564 HB VAL 81 HB VAL 81 -10.409 -1.195 -3.187 565 HG11 VAL 81 1HG1 VAL 81 -12.537 0.962 -3.087 566 HG12 VAL 81 2HG1 VAL 81 -11.946 0.063 -1.682 567 HG13 VAL 81 3HG1 VAL 81 -10.832 1.081 -2.603 568 HG21 VAL 81 3HG2 VAL 81 -12.295 -2.623 -4.093 569 HG22 VAL 81 1HG2 VAL 81 -12.294 -2.223 -2.368 570 HG23 VAL 81 2HG2 VAL 81 -13.380 -1.371 -3.489 571 H VAL 82 H VAL 82 -13.037 -1.781 -6.058 572 HA VAL 82 HA VAL 82 -15.010 0.225 -5.830 573 HB VAL 82 HB VAL 82 -14.119 0.496 -8.216 574 HG11 VAL 82 1HG1 VAL 82 -14.603 -1.214 -9.891 575 HG12 VAL 82 2HG1 VAL 82 -13.495 -1.867 -8.664 576 HG13 VAL 82 3HG1 VAL 82 -15.212 -2.319 -8.652 577 HG21 VAL 82 3HG2 VAL 82 -16.922 -0.626 -8.195 578 HG22 VAL 82 1HG2 VAL 82 -16.510 0.952 -7.528 579 HG23 VAL 82 2HG2 VAL 82 -16.243 0.623 -9.257 580 H ASP 83 H ASP 83 -17.204 -1.158 -6.178 581 HA ASP 83 HA ASP 83 -16.590 -3.970 -5.509 582 HB2 ASP 83 1HB ASP 83 -17.836 -2.525 -3.748 583 HB3 ASP 83 2HB ASP 83 -19.225 -2.687 -4.837 584 H GLY 84 H GLY 84 -17.674 -5.531 -6.695 585 HA2 GLY 84 1HA GLY 84 -18.439 -4.628 -9.396 586 HA3 GLY 84 2HA GLY 84 -18.042 -6.255 -8.846 587 H GLU 85 H GLU 85 -20.014 -5.694 -6.420 588 HA GLU 85 HA GLU 85 -22.038 -7.290 -7.695 589 HB2 GLU 85 1HB GLU 85 -21.977 -5.970 -4.939 590 HB3 GLU 85 2HB GLU 85 -23.155 -7.161 -5.476 591 HG2 GLU 85 1HG GLU 85 -20.159 -7.649 -5.133 592 HG3 GLU 85 2HG GLU 85 -21.481 -8.200 -4.088 593 H ASP 86 H ASP 86 -24.173 -6.792 -8.005 594 HA ASP 86 HA ASP 86 -24.864 -3.890 -8.295 595 HB2 ASP 86 1HB ASP 86 -24.272 -5.588 -10.331 596 HB3 ASP 86 2HB ASP 86 -26.004 -5.867 -10.216 597 H GLY 87 H GLY 87 -25.512 -6.282 -6.368 598 HA2 GLY 87 1HA GLY 87 -28.421 -5.721 -6.007 599 HA3 GLY 87 2HA GLY 87 -27.788 -7.371 -5.999 600 H VAL 88 H VAL 88 -25.753 -4.841 -4.632 601 HA VAL 88 HA VAL 88 -26.588 -5.432 -1.874 602 HB VAL 88 HB VAL 88 -23.673 -5.480 -2.717 603 HG11 VAL 88 1HG1 VAL 88 -23.315 -6.390 -0.477 604 HG12 VAL 88 2HG1 VAL 88 -24.254 -4.900 -0.328 605 HG13 VAL 88 3HG1 VAL 88 -25.061 -6.460 -0.169 606 HG21 VAL 88 3HG2 VAL 88 -24.672 -7.502 -3.717 607 HG22 VAL 88 1HG2 VAL 88 -23.693 -7.921 -2.318 608 HG23 VAL 88 2HG2 VAL 88 -25.464 -7.899 -2.178 609 H VAL 89 H VAL 89 -26.503 -3.551 -0.630 610 HA VAL 89 HA VAL 89 -25.013 -1.221 -1.582 611 HB VAL 89 HB VAL 89 -27.320 -0.959 -2.401 612 HG11 VAL 89 1HG1 VAL 89 -28.585 -2.269 -0.759 613 HG12 VAL 89 2HG1 VAL 89 -28.227 -1.070 0.500 614 HG13 VAL 89 3HG1 VAL 89 -29.222 -0.632 -0.906 615 HG21 VAL 89 3HG2 VAL 89 -26.011 1.039 -1.729 616 HG22 VAL 89 1HG2 VAL 89 -27.746 1.274 -1.521 617 HG23 VAL 89 2HG2 VAL 89 -26.726 0.961 -0.106 618 H ASN 90 H ASN 90 -24.392 0.145 0.300 619 HA ASN 90 HA ASN 90 -24.523 -1.237 2.912 620 HB2 ASN 90 1HB ASN 90 -21.991 -0.842 1.274 621 HB3 ASN 90 2HB ASN 90 -22.038 -1.414 2.934 622 HD21 ASN 90 1HD2 ASN 90 -22.862 -3.536 3.408 623 HD22 ASN 90 2HD2 ASN 90 -22.941 -4.767 2.150 624 H GLU 91 H GLU 91 -22.445 0.032 4.107 625 HA GLU 91 HA GLU 91 -22.790 2.928 3.703 626 HB2 GLU 91 1HB GLU 91 -21.940 1.174 6.025 627 HB3 GLU 91 2HB GLU 91 -21.077 2.696 5.832 628 HG2 GLU 91 1HG GLU 91 -23.431 3.780 5.516 629 HG3 GLU 91 2HG GLU 91 -24.058 2.280 6.179 630 HA PRO 92 HA PRO 92 -18.953 3.103 1.620 631 HB2 PRO 92 1HB PRO 92 -17.900 5.499 2.275 632 HB3 PRO 92 2HB PRO 92 -19.540 5.383 1.552 633 HG2 PRO 92 1HG PRO 92 -18.909 5.585 4.507 634 HG3 PRO 92 2HG PRO 92 -19.956 6.670 3.529 635 HD2 PRO 92 1HD PRO 92 -21.006 4.581 4.853 636 HD3 PRO 92 2HD PRO 92 -21.575 4.975 3.214 637 H MET 93 H MET 93 -16.452 3.523 1.883 638 HA MET 93 HA MET 93 -15.515 2.627 4.555 639 HB2 MET 93 1HB MET 93 -14.037 1.092 3.747 640 HB3 MET 93 2HB MET 93 -15.542 0.697 2.927 641 HG2 MET 93 1HG MET 93 -14.724 1.774 0.872 642 HG3 MET 93 2HG MET 93 -13.270 2.326 1.701 643 HE1 MET 93 3HE MET 93 -12.105 -0.148 3.271 644 HE2 MET 93 1HE MET 93 -13.622 -1.016 3.090 645 HE3 MET 93 2HE MET 93 -12.147 -1.710 2.405 646 H GLN 94 H GLN 94 -13.182 3.061 4.940 647 HA GLN 94 HA GLN 94 -12.050 5.322 3.421 648 HB2 GLN 94 1HB GLN 94 -12.821 5.363 6.378 649 HB3 GLN 94 2HB GLN 94 -11.620 6.461 5.681 650 HG2 GLN 94 1HG GLN 94 -13.239 7.348 4.105 651 HG3 GLN 94 2HG GLN 94 -14.484 6.221 4.670 652 HE21 GLN 94 1HE2 GLN 94 -15.546 8.396 4.696 653 HE22 GLN 94 2HE2 GLN 94 -15.462 9.387 6.137 654 H TRP 95 H TRP 95 -9.750 5.416 3.688 655 HA TRP 95 HA TRP 95 -8.516 3.158 5.204 656 HB2 TRP 95 1HB TRP 95 -7.667 4.136 2.460 657 HB3 TRP 95 2HB TRP 95 -6.788 2.985 3.428 658 HD1 TRP 95 HD TRP 95 -9.979 1.607 3.910 659 HE1 TRP 95 1HE TRP 95 -10.668 -0.112 2.125 660 HE3 TRP 95 3HE TRP 95 -6.456 2.594 0.315 661 HZ2 TRP 95 2HZ TRP 95 -9.998 -0.802 -0.495 662 HZ3 TRP 95 3HZ TRP 95 -6.609 1.459 -1.877 663 HH2 TRP 95 HH TRP 95 -8.384 -0.226 -2.312 664 H VAL 96 H VAL 96 -6.329 3.663 5.898 665 HA VAL 96 HA VAL 96 -5.563 6.533 5.721 666 HB VAL 96 HB VAL 96 -5.320 5.064 8.352 667 HG11 VAL 96 1HG1 VAL 96 -5.020 7.309 9.246 668 HG12 VAL 96 2HG1 VAL 96 -3.900 7.099 7.891 669 HG13 VAL 96 3HG1 VAL 96 -5.383 8.039 7.670 670 HG21 VAL 96 3HG2 VAL 96 -7.733 5.150 7.988 671 HG22 VAL 96 1HG2 VAL 96 -7.265 6.361 9.179 672 HG23 VAL 96 2HG2 VAL 96 -7.635 6.863 7.518 673 H VAL 97 H VAL 97 -3.522 6.634 4.847 674 HA VAL 97 HA VAL 97 -1.863 4.185 4.960 675 HB VAL 97 HB VAL 97 -1.479 4.694 2.550 676 HG11 VAL 97 1HG1 VAL 97 -4.307 3.901 3.309 677 HG12 VAL 97 2HG1 VAL 97 -3.521 3.599 1.741 678 HG13 VAL 97 3HG1 VAL 97 -2.872 2.855 3.194 679 HG21 VAL 97 3HG2 VAL 97 -2.401 7.004 2.394 680 HG22 VAL 97 1HG2 VAL 97 -3.138 5.903 1.233 681 HG23 VAL 97 2HG2 VAL 97 -4.023 6.362 2.694 682 H THR 98 H THR 98 0.307 4.608 5.459 683 HA THR 98 HA THR 98 1.071 7.471 5.662 684 HB THR 98 HB THR 98 1.457 5.338 7.793 685 HG1 THR 98 1HG THR 98 -0.609 6.113 7.928 686 HG21 THR 98 3HG2 THR 98 2.353 7.102 9.209 687 HG22 THR 98 1HG2 THR 98 2.232 8.272 7.872 688 HG23 THR 98 2HG2 THR 98 3.361 6.902 7.788 689 H VAL 99 H VAL 99 3.295 7.751 5.465 690 HA VAL 99 HA VAL 99 4.843 5.423 4.373 691 HB VAL 99 HB VAL 99 4.979 8.253 3.333 692 HG11 VAL 99 1HG1 VAL 99 7.008 6.854 2.961 693 HG12 VAL 99 2HG1 VAL 99 6.003 5.756 1.988 694 HG13 VAL 99 3HG1 VAL 99 6.237 7.435 1.487 695 HG21 VAL 99 3HG2 VAL 99 3.593 5.922 1.927 696 HG22 VAL 99 1HG2 VAL 99 2.730 7.249 2.744 697 HG23 VAL 99 2HG2 VAL 99 3.730 7.586 1.353 698 H TYR 100 H TYR 100 6.743 5.103 5.210 699 HA TYR 100 HA TYR 100 8.107 7.252 6.712 700 HB2 TYR 100 1HB TYR 100 8.186 4.236 7.100 701 HB3 TYR 100 2HB TYR 100 9.181 5.393 7.958 702 HD1 TYR 100 1HD TYR 100 5.663 4.236 7.468 703 HD2 TYR 100 2HD TYR 100 8.396 6.521 9.899 704 HE1 TYR 100 1HE TYR 100 3.881 4.559 9.170 705 HE2 TYR 100 2HE TYR 100 6.627 6.862 11.587 706 HH TYR 100 HH TYR 100 4.381 6.500 12.154 707 H LYS 101 H LYS 101 10.528 6.990 6.571 708 HA LYS 101 HA LYS 101 11.455 5.840 4.011 709 HB2 LYS 101 1HB LYS 101 11.134 8.488 4.438 710 HB3 LYS 101 2HB LYS 101 12.693 8.343 5.225 711 HG2 LYS 101 1HG LYS 101 12.646 6.931 2.670 712 HG3 LYS 101 2HG LYS 101 12.039 8.577 2.456 713 HD2 LYS 101 1HD LYS 101 14.336 9.052 3.852 714 HD3 LYS 101 2HD LYS 101 14.773 7.558 3.025 715 HE2 LYS 101 1HE LYS 101 14.046 10.248 1.861 716 HE3 LYS 101 2HE LYS 101 15.531 9.331 1.659 717 HZ1 LYS 101 3HZ LYS 101 14.514 9.025 -0.301 718 HZ2 LYS 101 1HZ LYS 101 12.993 9.094 0.262 719 HZ3 LYS 101 2HZ LYS 101 13.879 7.703 0.422 720 H ASN 102 H ASN 102 14.192 6.522 4.628 721 HA ASN 102 HA ASN 102 14.989 4.557 6.595 722 HB2 ASN 102 1HB ASN 102 17.262 5.470 6.281 723 HB3 ASN 102 2HB ASN 102 16.495 4.889 4.825 724 HD21 ASN 102 1HD2 ASN 102 17.731 6.084 3.341 725 HD22 ASN 102 2HD2 ASN 102 17.841 7.827 3.355 726 H GLY 103 H GLY 103 13.402 5.482 8.212 727 HA2 GLY 103 1HA GLY 103 13.645 5.785 10.474 728 HA3 GLY 103 2HA GLY 103 15.115 6.716 10.221 729 H LYS 104 H LYS 104 11.843 7.257 8.848 730 HA LYS 104 HA LYS 104 11.048 9.096 10.741 731 HB2 LYS 104 1HB LYS 104 12.684 10.353 8.644 732 HB3 LYS 104 2HB LYS 104 11.036 10.948 8.524 733 HG2 LYS 104 1HG LYS 104 12.691 10.971 11.080 734 HG3 LYS 104 2HG LYS 104 12.493 12.348 10.005 735 HD2 LYS 104 1HD LYS 104 10.053 10.944 11.148 736 HD3 LYS 104 2HD LYS 104 10.945 12.035 12.137 737 HE2 LYS 104 1HE LYS 104 10.007 12.895 9.370 738 HE3 LYS 104 2HE LYS 104 8.896 12.869 10.743 739 HZ1 LYS 104 3HZ LYS 104 10.648 14.250 11.918 740 HZ2 LYS 104 1HZ LYS 104 9.716 14.972 10.754 741 HZ3 LYS 104 2HZ LYS 104 11.276 14.556 10.436 742 H GLU 105 H GLU 105 8.858 9.820 10.326 743 HA GLU 105 HA GLU 105 7.235 8.580 8.232 744 HB2 GLU 105 1HB GLU 105 6.299 9.302 10.477 745 HB3 GLU 105 2HB GLU 105 6.754 10.953 10.072 746 HG2 GLU 105 1HG GLU 105 5.199 10.720 8.009 747 HG3 GLU 105 2HG GLU 105 4.597 9.252 8.774 748 H ILE 106 H ILE 106 6.917 9.556 6.201 749 HA ILE 106 HA ILE 106 7.863 12.354 5.839 750 HB ILE 106 HB ILE 106 8.398 11.738 3.487 751 HG12 ILE 106 1HG1 ILE 106 8.474 8.837 4.427 752 HG13 ILE 106 2HG1 ILE 106 7.092 9.512 3.559 753 HG21 ILE 106 1HG2 ILE 106 10.629 10.924 4.023 754 HG22 ILE 106 2HG2 ILE 106 10.102 12.068 5.264 755 HG23 ILE 106 3HG2 ILE 106 10.073 10.328 5.608 756 HD11 ILE 106 3HD1 ILE 106 8.600 8.354 2.031 757 HD12 ILE 106 1HD1 ILE 106 8.488 10.084 1.643 758 HD13 ILE 106 2HD1 ILE 106 9.922 9.441 2.475 759 H GLU 107 H GLU 107 5.219 10.004 5.312 760 HA GLU 107 HA GLU 107 3.661 12.220 4.155 761 HB2 GLU 107 1HB GLU 107 4.676 10.526 2.329 762 HB3 GLU 107 2HB GLU 107 3.360 9.505 2.903 763 HG2 GLU 107 1HG GLU 107 2.306 10.494 1.165 764 HG3 GLU 107 2HG GLU 107 1.822 11.561 2.444 765 H LYS 108 H LYS 108 1.453 12.023 4.538 766 HA LYS 108 HA LYS 108 0.346 9.807 6.125 767 HB2 LYS 108 1HB LYS 108 -0.383 11.492 7.835 768 HB3 LYS 108 2HB LYS 108 1.344 11.141 7.836 769 HG2 LYS 108 1HG LYS 108 1.680 13.289 6.453 770 HG3 LYS 108 2HG LYS 108 -0.014 13.673 6.790 771 HD2 LYS 108 1HD LYS 108 2.175 13.250 8.849 772 HD3 LYS 108 2HD LYS 108 1.562 14.807 8.258 773 HE2 LYS 108 1HE LYS 108 -0.789 13.902 8.998 774 HE3 LYS 108 2HE LYS 108 0.143 12.719 9.944 775 HZ1 LYS 108 3HZ LYS 108 1.318 14.709 10.893 776 HZ2 LYS 108 1HZ LYS 108 -0.294 14.617 11.292 777 HZ3 LYS 108 2HZ LYS 108 0.188 15.658 10.138 778 H LYS 109 H LYS 109 -1.397 9.397 4.781 779 HA LYS 109 HA LYS 109 -3.268 11.630 4.594 780 HB2 LYS 109 1HB LYS 109 -3.736 11.433 2.174 781 HB3 LYS 109 2HB LYS 109 -2.135 12.066 2.519 782 HG2 LYS 109 1HG LYS 109 -1.085 10.420 1.400 783 HG3 LYS 109 2HG LYS 109 -1.992 9.186 2.250 784 HD2 LYS 109 1HD LYS 109 -2.536 8.762 0.083 785 HD3 LYS 109 2HD LYS 109 -3.940 9.651 0.656 786 HE2 LYS 109 1HE LYS 109 -1.625 10.893 -0.938 787 HE3 LYS 109 2HE LYS 109 -3.078 10.211 -1.675 788 HZ1 LYS 109 3HZ LYS 109 -3.475 12.440 -1.540 789 HZ2 LYS 109 1HZ LYS 109 -2.950 12.627 0.007 790 HZ3 LYS 109 2HZ LYS 109 -4.360 11.834 -0.315 791 H SER 110 H SER 110 -5.498 11.022 4.437 792 HA SER 110 HA SER 110 -6.047 8.194 4.466 793 HB2 SER 110 1HB SER 110 -8.004 10.147 5.484 794 HB3 SER 110 2HB SER 110 -7.300 8.705 6.185 795 HG SER 110 HG SER 110 -6.734 11.193 6.849 796 H LEU 111 H LEU 111 -8.245 7.631 3.619 797 HA LEU 111 HA LEU 111 -8.632 8.977 0.986 798 HB2 LEU 111 1HB LEU 111 -8.453 5.993 1.540 799 HB3 LEU 111 2HB LEU 111 -8.699 6.745 -0.027 800 HG LEU 111 HG LEU 111 -6.155 6.907 1.657 801 HD11 LEU 111 1HD1 LEU 111 -6.814 5.395 -0.899 802 HD12 LEU 111 2HD1 LEU 111 -6.464 4.724 0.704 803 HD13 LEU 111 3HD1 LEU 111 -5.190 5.550 -0.185 804 HD21 LEU 111 3HD2 LEU 111 -6.846 8.149 -1.031 805 HD22 LEU 111 1HD2 LEU 111 -5.177 7.883 -0.488 806 HD23 LEU 111 2HD2 LEU 111 -6.253 8.939 0.429 807 H VAL 112 H VAL 112 -10.727 8.720 0.098 808 HA VAL 112 HA VAL 112 -12.779 7.782 2.032 809 HB VAL 112 HB VAL 112 -12.431 10.127 2.352 810 HG11 VAL 112 1HG1 VAL 112 -11.605 10.812 0.106 811 HG12 VAL 112 2HG1 VAL 112 -13.268 10.672 -0.511 812 HG13 VAL 112 3HG1 VAL 112 -12.894 11.847 0.749 813 HG21 VAL 112 3HG2 VAL 112 -15.086 9.539 0.993 814 HG22 VAL 112 1HG2 VAL 112 -14.634 9.138 2.661 815 HG23 VAL 112 2HG2 VAL 112 -14.761 10.826 2.176 816 H PHE 113 H PHE 113 -13.615 6.059 1.125 817 HA PHE 113 HA PHE 113 -14.413 6.162 -1.727 818 HB2 PHE 113 1HB PHE 113 -14.250 3.823 0.191 819 HB3 PHE 113 2HB PHE 113 -14.829 3.737 -1.459 820 HD1 PHE 113 2HD PHE 113 -13.295 4.135 -3.394 821 HD2 PHE 113 1HD PHE 113 -11.847 3.888 0.667 822 HE1 PHE 113 2HE PHE 113 -11.010 3.726 -4.233 823 HE2 PHE 113 1HE PHE 113 -9.556 3.490 -0.180 824 HZ PHE 113 HZ PHE 113 -9.144 3.335 -2.623 825 H ARG 114 H ARG 114 -16.564 4.724 -1.739 826 HA ARG 114 HA ARG 114 -18.569 6.120 -0.090 827 HB2 ARG 114 1HB ARG 114 -18.560 5.950 -3.087 828 HB3 ARG 114 2HB ARG 114 -19.755 6.755 -2.091 829 HG2 ARG 114 1HG ARG 114 -17.895 8.274 -1.243 830 HG3 ARG 114 2HG ARG 114 -16.844 7.601 -2.490 831 HD2 ARG 114 1HD ARG 114 -19.541 8.859 -3.117 832 HD3 ARG 114 2HD ARG 114 -18.025 9.759 -3.070 833 HE ARG 114 HE ARG 114 -18.018 7.348 -4.744 834 HH11 ARG 114 1HH1 ARG 114 -18.630 10.836 -4.652 835 HH12 ARG 114 2HH1 ARG 114 -18.782 11.007 -6.372 836 HH21 ARG 114 1HH2 ARG 114 -17.762 7.679 -7.045 837 HH22 ARG 114 2HH2 ARG 114 -17.984 9.249 -7.737 838 H ASP 115 H ASP 115 -20.738 5.053 -1.492 839 HA ASP 115 HA ASP 115 -21.100 2.330 -0.861 840 HB2 ASP 115 1HB ASP 115 -22.178 4.064 -3.122 841 HB3 ASP 115 2HB ASP 115 -22.772 2.436 -2.762 842 H GLY 116 H GLY 116 -20.750 0.361 -2.180 843 HA2 GLY 116 1HA GLY 116 -18.311 0.259 -3.379 844 HA3 GLY 116 2HA GLY 116 -19.601 -0.943 -3.541 845 H LYS 117 H LYS 117 -21.428 0.849 -4.932 846 HA LYS 117 HA LYS 117 -20.223 0.344 -7.466 847 HB2 LYS 117 1HB LYS 117 -22.937 0.310 -6.391 848 HB3 LYS 117 2HB LYS 117 -22.947 1.170 -7.922 849 HG2 LYS 117 1HG LYS 117 -21.677 -1.542 -7.433 850 HG3 LYS 117 2HG LYS 117 -23.238 -1.278 -8.227 851 HD2 LYS 117 1HD LYS 117 -22.241 -0.301 -10.147 852 HD3 LYS 117 2HD LYS 117 -20.721 0.092 -9.308 853 HE2 LYS 117 1HE LYS 117 -20.583 -1.891 -10.922 854 HE3 LYS 117 2HE LYS 117 -20.070 -2.235 -9.262 855 HZ1 LYS 117 3HZ LYS 117 -22.155 -3.288 -8.840 856 HZ2 LYS 117 1HZ LYS 117 -21.471 -4.014 -10.113 857 HZ3 LYS 117 2HZ LYS 117 -22.752 -2.961 -10.315 858 H GLU 118 H GLU 118 -19.480 2.633 -6.176 859 HA GLU 118 HA GLU 118 -19.613 4.811 -8.107 860 HB2 GLU 118 1HB GLU 118 -21.686 5.288 -7.236 861 HB3 GLU 118 2HB GLU 118 -21.335 4.629 -5.633 862 HG2 GLU 118 1HG GLU 118 -20.235 6.455 -4.917 863 HG3 GLU 118 2HG GLU 118 -19.959 7.117 -6.550 864 H ILE 119 H ILE 119 -17.335 4.859 -8.256 865 HA ILE 119 HA ILE 119 -16.032 6.160 -5.914 866 HB ILE 119 HB ILE 119 -14.151 4.725 -5.978 867 HG12 ILE 119 1HG1 ILE 119 -14.946 2.467 -7.364 868 HG13 ILE 119 2HG1 ILE 119 -15.431 3.706 -8.471 869 HG21 ILE 119 1HG2 ILE 119 -15.016 2.728 -4.948 870 HG22 ILE 119 2HG2 ILE 119 -15.982 4.118 -4.430 871 HG23 ILE 119 3HG2 ILE 119 -16.631 2.994 -5.633 872 HD11 ILE 119 3HD1 ILE 119 -12.673 3.436 -7.230 873 HD12 ILE 119 1HD1 ILE 119 -13.104 2.991 -8.888 874 HD13 ILE 119 2HD1 ILE 119 -13.178 4.715 -8.372 875 H SER 120 H SER 120 -14.044 7.160 -6.405 876 HA SER 120 HA SER 120 -12.974 7.608 -8.968 877 HB2 SER 120 1HB SER 120 -13.839 9.876 -9.278 878 HB3 SER 120 2HB SER 120 -15.017 8.639 -9.622 879 HG SER 120 HG SER 120 -16.129 10.056 -8.416 880 H THR 121 H THR 121 -11.067 7.362 -7.453 881 HA THR 121 HA THR 121 -10.517 9.901 -5.994 882 HB THR 121 HB THR 121 -9.594 8.104 -4.194 883 HG1 THR 121 1HG THR 121 -10.436 6.260 -5.165 884 HG21 THR 121 3HG2 THR 121 -11.019 10.030 -3.707 885 HG22 THR 121 1HG2 THR 121 -11.603 8.575 -2.881 886 HG23 THR 121 2HG2 THR 121 -12.435 9.174 -4.331 887 H ASP 122 H ASP 122 -8.518 10.517 -5.564 888 HA ASP 122 HA ASP 122 -6.253 9.175 -6.832 889 HB2 ASP 122 1HB ASP 122 -6.227 11.411 -4.750 890 HB3 ASP 122 2HB ASP 122 -4.921 10.926 -5.838 891 H ASP 123 H ASP 123 -7.399 7.274 -5.603 892 HA ASP 123 HA ASP 123 -6.926 6.951 -2.760 893 HB2 ASP 123 1HB ASP 123 -7.219 4.412 -3.388 894 HB3 ASP 123 2HB ASP 123 -8.595 5.514 -3.296 895 H LEU 124 H LEU 124 -5.569 4.759 -5.257 896 HA LEU 124 HA LEU 124 -3.006 4.820 -3.716 897 HB2 LEU 124 1HB LEU 124 -4.237 2.561 -5.303 898 HB3 LEU 124 2HB LEU 124 -2.661 2.571 -4.497 899 HG LEU 124 HG LEU 124 -5.378 2.535 -3.230 900 HD11 LEU 124 1HD1 LEU 124 -2.934 0.756 -2.809 901 HD12 LEU 124 2HD1 LEU 124 -4.224 0.356 -3.944 902 HD13 LEU 124 3HD1 LEU 124 -4.561 0.474 -2.204 903 HD21 LEU 124 3HD2 LEU 124 -4.174 4.111 -1.868 904 HD22 LEU 124 1HD2 LEU 124 -2.705 3.137 -1.918 905 HD23 LEU 124 2HD2 LEU 124 -4.126 2.573 -1.006 906 H ASN 125 H ASN 125 -2.076 6.366 -4.703 907 HA ASN 125 HA ASN 125 -1.015 5.820 -7.357 908 HB2 ASN 125 1HB ASN 125 -3.218 7.098 -7.748 909 HB3 ASN 125 2HB ASN 125 -2.399 8.517 -7.096 910 HD21 ASN 125 1HD2 ASN 125 -0.181 9.006 -8.194 911 HD22 ASN 125 2HD2 ASN 125 -0.027 8.633 -9.888 912 H LEU 126 H LEU 126 0.528 5.550 -5.388 913 HA LEU 126 HA LEU 126 1.922 8.133 -4.783 914 HB2 LEU 126 1HB LEU 126 2.032 5.549 -3.206 915 HB3 LEU 126 2HB LEU 126 2.896 7.041 -2.848 916 HG LEU 126 HG LEU 126 -0.127 6.667 -2.763 917 HD11 LEU 126 1HD1 LEU 126 1.863 7.085 -0.494 918 HD12 LEU 126 2HD1 LEU 126 1.115 5.528 -0.928 919 HD13 LEU 126 3HD1 LEU 126 0.118 6.869 -0.338 920 HD21 LEU 126 3HD2 LEU 126 0.404 9.008 -3.346 921 HD22 LEU 126 1HD2 LEU 126 1.547 9.086 -1.991 922 HD23 LEU 126 2HD2 LEU 126 -0.188 8.907 -1.686 923 H TYR 127 H TYR 127 4.173 8.165 -5.204 924 HA TYR 127 HA TYR 127 5.465 5.775 -6.296 925 HB2 TYR 127 1HB TYR 127 4.013 7.034 -8.123 926 HB3 TYR 127 2HB TYR 127 5.380 8.118 -8.190 927 HD1 TYR 127 2HD TYR 127 7.774 6.913 -8.492 928 HD2 TYR 127 1HD TYR 127 3.980 5.017 -9.291 929 HE1 TYR 127 2HE TYR 127 8.912 5.256 -9.932 930 HE2 TYR 127 1HE TYR 127 5.102 3.342 -10.695 931 HH TYR 127 HH TYR 127 8.620 3.457 -11.440 932 H TYR 128 H TYR 128 6.593 6.226 -4.332 933 HA TYR 128 HA TYR 128 8.338 8.572 -4.077 934 HB2 TYR 128 1HB TYR 128 8.369 5.849 -2.693 935 HB3 TYR 128 2HB TYR 128 9.391 7.219 -2.271 936 HD1 TYR 128 1HD TYR 128 8.307 9.422 -1.594 937 HD2 TYR 128 2HD TYR 128 6.124 5.689 -1.724 938 HE1 TYR 128 1HE TYR 128 6.339 10.565 -0.629 939 HE2 TYR 128 2HE TYR 128 4.118 6.869 -0.859 940 HH TYR 128 HH TYR 128 4.112 10.404 -0.188 941 H ASN 129 H ASN 129 10.457 8.732 -4.924 942 HA ASN 129 HA ASN 129 11.848 6.464 -5.884 943 HB2 ASN 129 1HB ASN 129 12.164 7.094 -8.163 944 HB3 ASN 129 2HB ASN 129 10.462 6.832 -7.885 945 HD21 ASN 129 1HD2 ASN 129 9.042 8.547 -8.383 946 HD22 ASN 129 2HD2 ASN 129 9.640 9.939 -9.255 Start of MODEL 7 1 H1 GLY 1 H GLY 1 32.813 -15.795 -3.010 2 HA2 GLY 1 1HA GLY 1 35.282 -14.306 -2.267 3 HA3 GLY 1 2HA GLY 1 34.215 -13.829 -3.614 4 H ASP 2 H ASP 2 31.978 -13.357 -3.091 5 HA ASP 2 HA ASP 2 30.055 -13.301 -1.916 6 HB2 ASP 2 1HB ASP 2 31.549 -14.217 0.569 7 HB3 ASP 2 2HB ASP 2 29.808 -14.064 0.384 8 H ASP 3 H ASP 3 30.410 -11.226 -2.736 9 HA ASP 3 HA ASP 3 32.084 -9.291 -1.408 10 HB2 ASP 3 1HB ASP 3 33.395 -9.327 -3.559 11 HB3 ASP 3 2HB ASP 3 33.622 -10.767 -2.556 12 H ASP 4 H ASP 4 31.876 -7.376 -2.423 13 HA ASP 4 HA ASP 4 30.307 -6.638 -4.696 14 HB2 ASP 4 1HB ASP 4 29.065 -6.428 -1.934 15 HB3 ASP 4 2HB ASP 4 28.697 -5.193 -3.138 16 H GLU 5 H GLU 5 30.275 -4.148 -4.786 17 HA GLU 5 HA GLU 5 31.929 -2.654 -2.899 18 HB2 GLU 5 1HB GLU 5 32.879 -3.210 -5.730 19 HB3 GLU 5 2HB GLU 5 33.275 -1.726 -4.864 20 HG2 GLU 5 1HG GLU 5 34.198 -3.187 -2.983 21 HG3 GLU 5 2HG GLU 5 34.121 -4.536 -4.131 22 HA PRO 6 HA PRO 6 28.530 -0.352 -4.992 23 HB2 PRO 6 1HB PRO 6 27.222 0.616 -2.841 24 HB3 PRO 6 2HB PRO 6 27.096 -1.109 -3.341 25 HG2 PRO 6 1HG PRO 6 28.905 0.049 -1.191 26 HG3 PRO 6 2HG PRO 6 27.768 -1.332 -1.062 27 HD2 PRO 6 1HD PRO 6 30.444 -1.640 -1.626 28 HD3 PRO 6 2HD PRO 6 29.189 -2.748 -2.270 29 H GLY 7 H GLY 7 28.180 1.988 -5.056 30 HA2 GLY 7 1HA GLY 7 30.211 3.747 -3.825 31 HA3 GLY 7 2HA GLY 7 30.350 3.462 -5.571 32 H GLY 8 H GLY 8 27.296 3.632 -3.755 33 HA2 GLY 8 1HA GLY 8 26.529 6.168 -5.100 34 HA3 GLY 8 2HA GLY 8 25.593 4.671 -5.347 35 H LYS 9 H LYS 9 23.901 6.364 -4.387 36 HA LYS 9 HA LYS 9 23.554 5.719 -1.604 37 HB2 LYS 9 1HB LYS 9 24.888 7.971 -1.843 38 HB3 LYS 9 2HB LYS 9 23.346 8.637 -2.393 39 HG2 LYS 9 1HG LYS 9 22.290 7.897 -0.280 40 HG3 LYS 9 2HG LYS 9 23.819 7.165 0.244 41 HD2 LYS 9 1HD LYS 9 24.860 9.428 0.283 42 HD3 LYS 9 2HD LYS 9 23.322 10.120 -0.270 43 HE2 LYS 9 1HE LYS 9 22.295 8.841 1.789 44 HE3 LYS 9 2HE LYS 9 23.960 8.737 2.371 45 HZ1 LYS 9 3HZ LYS 9 22.840 10.619 3.295 46 HZ2 LYS 9 1HZ LYS 9 22.430 11.220 1.817 47 HZ3 LYS 9 2HZ LYS 9 24.004 11.206 2.304 48 H GLY 10 H GLY 10 21.336 6.469 -1.080 49 HA2 GLY 10 1HA GLY 10 19.303 7.234 -2.844 50 HA3 GLY 10 2HA GLY 10 19.296 5.462 -2.779 51 H ALA 11 H ALA 11 17.644 4.914 -1.333 52 HA ALA 11 HA ALA 11 17.762 6.000 1.414 53 HB1 ALA 11 1HB ALA 11 15.246 6.226 -0.318 54 HB2 ALA 11 2HB ALA 11 15.461 6.864 1.320 55 HB3 ALA 11 3HB ALA 11 16.357 7.575 0.008 56 H MET 12 H MET 12 15.869 4.737 2.700 57 HA MET 12 HA MET 12 15.446 1.961 1.658 58 HB2 MET 12 1HB MET 12 15.016 3.369 4.336 59 HB3 MET 12 2HB MET 12 14.174 1.895 3.969 60 HG2 MET 12 1HG MET 12 16.645 1.121 3.229 61 HG3 MET 12 2HG MET 12 17.070 2.398 4.325 62 HE1 MET 12 3HE MET 12 15.736 -1.184 3.806 63 HE2 MET 12 1HE MET 12 14.916 -1.549 5.342 64 HE3 MET 12 2HE MET 12 14.246 -0.329 4.255 65 H TYR 13 H TYR 13 12.960 1.454 2.281 66 HA TYR 13 HA TYR 13 11.278 3.735 2.584 67 HB2 TYR 13 1HB TYR 13 10.774 2.089 0.072 68 HB3 TYR 13 2HB TYR 13 9.589 3.127 0.837 69 HD1 TYR 13 1HD TYR 13 10.471 5.599 1.410 70 HD2 TYR 13 2HD TYR 13 11.903 3.098 -1.795 71 HE1 TYR 13 1HE TYR 13 11.457 7.575 0.309 72 HE2 TYR 13 2HE TYR 13 12.802 5.102 -2.975 73 HH TYR 13 HH TYR 13 13.177 7.444 -2.846 74 H GLU 14 H GLU 14 9.300 3.220 3.624 75 HA GLU 14 HA GLU 14 8.454 0.440 3.892 76 HB2 GLU 14 1HB GLU 14 9.797 0.551 5.813 77 HB3 GLU 14 2HB GLU 14 9.363 2.213 6.180 78 HG2 GLU 14 1HG GLU 14 7.161 1.573 6.902 79 HG3 GLU 14 2HG GLU 14 7.381 -0.088 6.312 80 H VAL 15 H VAL 15 6.204 0.340 4.086 81 HA VAL 15 HA VAL 15 4.642 2.788 4.517 82 HB VAL 15 HB VAL 15 4.928 2.393 2.076 83 HG11 VAL 15 1HG1 VAL 15 3.441 -0.242 2.527 84 HG12 VAL 15 2HG1 VAL 15 3.863 0.469 0.969 85 HG13 VAL 15 3HG1 VAL 15 5.138 -0.100 2.064 86 HG21 VAL 15 3HG2 VAL 15 2.803 3.403 2.984 87 HG22 VAL 15 1HG2 VAL 15 2.676 2.653 1.382 88 HG23 VAL 15 2HG2 VAL 15 2.050 1.811 2.807 89 H THR 16 H THR 16 2.610 2.392 5.461 90 HA THR 16 HA THR 16 1.879 -0.417 6.163 91 HB THR 16 HB THR 16 0.318 1.114 7.802 92 HG1 THR 16 1HG THR 16 1.080 2.974 8.204 93 HG21 THR 16 3HG2 THR 16 3.130 0.129 8.368 94 HG22 THR 16 1HG2 THR 16 1.594 -0.646 8.759 95 HG23 THR 16 2HG2 THR 16 2.068 0.817 9.622 96 H ILE 17 H ILE 17 -0.296 -1.008 6.003 97 HA ILE 17 HA ILE 17 -2.076 0.950 4.623 98 HB ILE 17 HB ILE 17 -1.638 -1.375 3.488 99 HG12 ILE 17 1HG1 ILE 17 -4.124 -1.631 2.797 100 HG13 ILE 17 2HG1 ILE 17 -4.473 -0.306 3.911 101 HG21 ILE 17 1HG2 ILE 17 -3.935 -2.225 5.350 102 HG22 ILE 17 2HG2 ILE 17 -3.103 -3.219 4.128 103 HG23 ILE 17 3HG2 ILE 17 -2.270 -2.693 5.582 104 HD11 ILE 17 3HD1 ILE 17 -2.826 1.064 2.622 105 HD12 ILE 17 1HD1 ILE 17 -2.640 -0.286 1.482 106 HD13 ILE 17 2HD1 ILE 17 -4.216 0.525 1.669 107 H GLU 18 H GLU 18 -3.936 1.393 5.782 108 HA GLU 18 HA GLU 18 -4.653 -0.159 8.170 109 HB2 GLU 18 1HB GLU 18 -4.464 2.879 8.056 110 HB3 GLU 18 2HB GLU 18 -5.229 1.946 9.338 111 HG2 GLU 18 1HG GLU 18 -2.962 0.807 9.686 112 HG3 GLU 18 2HG GLU 18 -2.264 2.011 8.613 113 H GLN 19 H GLN 19 -6.580 -0.887 7.566 114 HA GLN 19 HA GLN 19 -8.322 0.618 5.683 115 HB2 GLN 19 1HB GLN 19 -8.483 -2.308 6.549 116 HB3 GLN 19 2HB GLN 19 -9.363 -1.508 5.250 117 HG2 GLN 19 1HG GLN 19 -6.958 -1.030 4.278 118 HG3 GLN 19 2HG GLN 19 -6.436 -2.284 5.394 119 HE21 GLN 19 1HE2 GLN 19 -6.733 -4.423 4.810 120 HE22 GLN 19 2HE2 GLN 19 -7.575 -4.957 3.394 121 H SER 20 H SER 20 -10.174 1.534 6.556 122 HA SER 20 HA SER 20 -11.167 0.471 9.131 123 HB2 SER 20 1HB SER 20 -10.927 3.435 8.580 124 HB3 SER 20 2HB SER 20 -11.176 2.639 10.134 125 HG SER 20 HG SER 20 -8.976 1.965 10.065 126 H GLY 21 H GLY 21 -13.333 1.721 9.676 127 HA2 GLY 21 1HA GLY 21 -15.469 2.244 9.073 128 HA3 GLY 21 2HA GLY 21 -15.021 2.324 7.371 129 H ASP 22 H ASP 22 -14.750 0.217 6.213 130 HA ASP 22 HA ASP 22 -15.281 -2.253 7.517 131 HB2 ASP 22 1HB ASP 22 -17.638 -1.219 7.365 132 HB3 ASP 22 2HB ASP 22 -17.544 -1.463 5.619 133 H PHE 23 H PHE 23 -13.729 -3.407 6.389 134 HA PHE 23 HA PHE 23 -13.526 -3.002 3.444 135 HB2 PHE 23 1HB PHE 23 -11.283 -4.022 3.672 136 HB3 PHE 23 2HB PHE 23 -11.506 -2.520 4.548 137 HD1 PHE 23 1HD PHE 23 -11.057 -6.174 4.926 138 HD2 PHE 23 2HD PHE 23 -11.422 -2.407 6.993 139 HE1 PHE 23 1HE PHE 23 -10.546 -7.297 7.050 140 HE2 PHE 23 2HE PHE 23 -10.763 -3.510 9.110 141 HZ PHE 23 HZ PHE 23 -10.322 -5.954 9.154 142 H ARG 24 H ARG 24 -15.664 -4.677 4.798 143 HA ARG 24 HA ARG 24 -14.963 -7.422 4.527 144 HB2 ARG 24 1HB ARG 24 -17.554 -5.924 4.906 145 HB3 ARG 24 2HB ARG 24 -17.570 -7.667 4.600 146 HG2 ARG 24 1HG ARG 24 -16.182 -8.150 6.501 147 HG3 ARG 24 2HG ARG 24 -15.860 -6.469 6.798 148 HD2 ARG 24 1HD ARG 24 -18.345 -6.094 7.197 149 HD3 ARG 24 2HD ARG 24 -18.583 -7.830 6.982 150 HE ARG 24 HE ARG 24 -17.580 -8.299 8.988 151 HH11 ARG 24 1HH1 ARG 24 -17.261 -4.829 8.373 152 HH12 ARG 24 2HH1 ARG 24 -16.638 -4.425 9.933 153 HH21 ARG 24 1HH2 ARG 24 -16.892 -7.824 11.075 154 HH22 ARG 24 2HH2 ARG 24 -16.296 -6.261 11.519 155 H SER 25 H SER 25 -16.870 -5.419 2.169 156 HA SER 25 HA SER 25 -16.466 -7.621 0.202 157 HB2 SER 25 1HB SER 25 -18.949 -5.939 0.642 158 HB3 SER 25 2HB SER 25 -18.660 -6.917 -0.785 159 HG SER 25 HG SER 25 -19.962 -7.878 0.676 160 H PHE 26 H PHE 26 -14.501 -6.258 -0.181 161 HA PHE 26 HA PHE 26 -15.072 -4.178 -2.219 162 HB2 PHE 26 1HB PHE 26 -13.421 -3.709 0.308 163 HB3 PHE 26 2HB PHE 26 -13.294 -2.723 -1.123 164 HD1 PHE 26 2HD PHE 26 -15.245 -1.478 -2.039 165 HD2 PHE 26 1HD PHE 26 -15.262 -3.350 1.846 166 HE1 PHE 26 2HE PHE 26 -17.440 -0.401 -1.501 167 HE2 PHE 26 1HE PHE 26 -17.339 -2.156 2.436 168 HZ PHE 26 HZ PHE 26 -18.455 -0.714 0.767 169 H ILE 27 H ILE 27 -13.921 -4.889 -3.999 170 HA ILE 27 HA ILE 27 -11.562 -6.605 -3.562 171 HB ILE 27 HB ILE 27 -12.858 -5.678 -6.124 172 HG12 ILE 27 1HG1 ILE 27 -14.526 -6.976 -4.988 173 HG13 ILE 27 2HG1 ILE 27 -13.869 -7.917 -6.307 174 HG21 ILE 27 1HG2 ILE 27 -10.536 -6.403 -6.474 175 HG22 ILE 27 2HG2 ILE 27 -10.829 -7.897 -5.579 176 HG23 ILE 27 3HG2 ILE 27 -11.635 -7.619 -7.137 177 HD11 ILE 27 3HD1 ILE 27 -14.214 -9.293 -4.328 178 HD12 ILE 27 1HD1 ILE 27 -12.477 -9.202 -4.699 179 HD13 ILE 27 2HD1 ILE 27 -13.160 -8.237 -3.367 180 H LYS 28 H LYS 28 -10.418 -5.032 -2.476 181 HA LYS 28 HA LYS 28 -9.279 -2.717 -3.926 182 HB2 LYS 28 1HB LYS 28 -7.917 -2.364 -1.923 183 HB3 LYS 28 2HB LYS 28 -9.621 -2.328 -1.565 184 HG2 LYS 28 1HG LYS 28 -7.724 -4.631 -0.908 185 HG3 LYS 28 2HG LYS 28 -8.319 -3.394 0.221 186 HD2 LYS 28 1HD LYS 28 -10.647 -4.192 -0.387 187 HD3 LYS 28 2HD LYS 28 -9.832 -5.621 -1.090 188 HE2 LYS 28 1HE LYS 28 -8.933 -6.169 1.104 189 HE3 LYS 28 2HE LYS 28 -9.825 -4.806 1.830 190 HZ1 LYS 28 3HZ LYS 28 -11.104 -6.912 1.947 191 HZ2 LYS 28 1HZ LYS 28 -10.970 -7.134 0.339 192 HZ3 LYS 28 2HZ LYS 28 -11.850 -5.909 0.884 193 H SER 29 H SER 29 -7.136 -2.698 -4.762 194 HA SER 29 HA SER 29 -5.487 -5.108 -4.326 195 HB2 SER 29 1HB SER 29 -5.972 -3.802 -7.030 196 HB3 SER 29 2HB SER 29 -4.806 -5.085 -6.698 197 HG SER 29 HG SER 29 -6.332 -6.421 -7.047 198 H VAL 30 H VAL 30 -3.148 -4.413 -5.230 199 HA VAL 30 HA VAL 30 -2.633 -1.519 -5.001 200 HB VAL 30 HB VAL 30 -1.393 -3.607 -3.156 201 HG11 VAL 30 1HG1 VAL 30 0.457 -2.279 -3.732 202 HG12 VAL 30 2HG1 VAL 30 -0.480 -0.755 -3.592 203 HG13 VAL 30 3HG1 VAL 30 -0.074 -1.734 -2.160 204 HG21 VAL 30 3HG2 VAL 30 -3.499 -2.691 -2.260 205 HG22 VAL 30 1HG2 VAL 30 -2.136 -2.117 -1.318 206 HG23 VAL 30 2HG2 VAL 30 -2.900 -1.040 -2.509 207 H VAL 31 H VAL 31 -0.426 -1.053 -5.916 208 HA VAL 31 HA VAL 31 0.928 -3.328 -7.265 209 HB VAL 31 HB VAL 31 0.132 -1.832 -9.018 210 HG11 VAL 31 1HG1 VAL 31 1.402 0.439 -7.469 211 HG12 VAL 31 2HG1 VAL 31 0.979 0.543 -9.168 212 HG13 VAL 31 3HG1 VAL 31 -0.297 0.228 -7.976 213 HG21 VAL 31 3HG2 VAL 31 2.490 -2.775 -9.194 214 HG22 VAL 31 1HG2 VAL 31 2.200 -1.310 -10.136 215 HG23 VAL 31 2HG2 VAL 31 3.087 -1.213 -8.613 216 H VAL 32 H VAL 32 3.244 -3.343 -6.648 217 HA VAL 32 HA VAL 32 4.264 -0.859 -5.506 218 HB VAL 32 HB VAL 32 3.786 -2.029 -3.573 219 HG11 VAL 32 1HG1 VAL 32 5.247 -4.408 -4.704 220 HG12 VAL 32 2HG1 VAL 32 4.674 -4.264 -3.028 221 HG13 VAL 32 3HG1 VAL 32 3.510 -4.282 -4.354 222 HG21 VAL 32 3HG2 VAL 32 5.991 -2.230 -2.533 223 HG22 VAL 32 1HG2 VAL 32 6.778 -2.387 -4.104 224 HG23 VAL 32 2HG2 VAL 32 5.991 -0.858 -3.653 225 H VAL 33 H VAL 33 6.303 -0.330 -6.146 226 HA VAL 33 HA VAL 33 7.950 -2.285 -7.619 227 HB VAL 33 HB VAL 33 7.729 0.643 -8.420 228 HG11 VAL 33 1HG1 VAL 33 9.881 -0.362 -8.994 229 HG12 VAL 33 2HG1 VAL 33 9.068 -1.778 -9.728 230 HG13 VAL 33 3HG1 VAL 33 8.941 -0.174 -10.458 231 HG21 VAL 33 3HG2 VAL 33 6.565 -0.138 -10.489 232 HG22 VAL 33 1HG2 VAL 33 6.350 -1.732 -9.748 233 HG23 VAL 33 2HG2 VAL 33 5.581 -0.307 -9.041 234 H ALA 34 H ALA 34 10.198 -1.998 -7.087 235 HA ALA 34 HA ALA 34 10.963 0.032 -5.100 236 HB1 ALA 34 1HB ALA 34 10.981 -2.970 -4.583 237 HB2 ALA 34 2HB ALA 34 11.910 -1.783 -3.638 238 HB3 ALA 34 3HB ALA 34 10.138 -1.691 -3.665 239 H ASN 35 H ASN 35 12.392 0.861 -6.547 240 HA ASN 35 HA ASN 35 14.078 -0.542 -8.354 241 HB2 ASN 35 1HB ASN 35 13.392 1.865 -8.457 242 HB3 ASN 35 2HB ASN 35 14.422 2.190 -7.067 243 HD21 ASN 35 1HD2 ASN 35 14.718 3.672 -9.295 244 HD22 ASN 35 2HD2 ASN 35 16.295 3.379 -9.971 245 H GLY 36 H GLY 36 15.383 -2.170 -7.421 246 HA2 GLY 36 1HA GLY 36 17.706 -2.364 -7.182 247 HA3 GLY 36 2HA GLY 36 17.749 -1.006 -6.084 248 H THR 37 H THR 37 15.326 -3.199 -4.904 249 HA THR 37 HA THR 37 17.116 -5.133 -3.802 250 HB THR 37 HB THR 37 17.563 -3.041 -2.421 251 HG1 THR 37 1HG THR 37 18.259 -4.398 -1.118 252 HG21 THR 37 3HG2 THR 37 16.026 -2.266 -0.854 253 HG22 THR 37 1HG2 THR 37 15.031 -3.732 -0.944 254 HG23 THR 37 2HG2 THR 37 15.006 -2.562 -2.273 255 H GLN 38 H GLN 38 15.608 -6.278 -1.847 256 HA GLN 38 HA GLN 38 13.034 -6.817 -3.247 257 HB2 GLN 38 1HB GLN 38 14.870 -8.588 -1.735 258 HB3 GLN 38 2HB GLN 38 13.169 -8.748 -1.334 259 HG2 GLN 38 1HG GLN 38 12.664 -8.888 -3.826 260 HG3 GLN 38 2HG GLN 38 14.341 -8.953 -4.146 261 HE21 GLN 38 1HE2 GLN 38 13.947 -11.129 -5.108 262 HE22 GLN 38 2HE2 GLN 38 13.354 -12.479 -4.119 263 H LEU 39 H LEU 39 11.211 -7.307 -1.797 264 HA LEU 39 HA LEU 39 10.905 -5.082 0.127 265 HB2 LEU 39 1HB LEU 39 8.847 -7.070 -0.768 266 HB3 LEU 39 2HB LEU 39 8.539 -5.617 0.141 267 HG LEU 39 HG LEU 39 9.399 -5.751 -2.778 268 HD11 LEU 39 1HD1 LEU 39 7.132 -4.799 -3.142 269 HD12 LEU 39 2HD1 LEU 39 6.787 -4.932 -1.409 270 HD13 LEU 39 3HD1 LEU 39 7.051 -6.387 -2.389 271 HD21 LEU 39 3HD2 LEU 39 10.385 -3.753 -1.845 272 HD22 LEU 39 1HD2 LEU 39 8.912 -3.382 -0.928 273 HD23 LEU 39 2HD2 LEU 39 8.904 -3.269 -2.699 274 H LYS 40 H LYS 40 9.559 -5.755 2.115 275 HA LYS 40 HA LYS 40 10.003 -8.535 3.025 276 HB2 LYS 40 1HB LYS 40 11.787 -7.001 3.981 277 HB3 LYS 40 2HB LYS 40 10.504 -6.105 4.804 278 HG2 LYS 40 1HG LYS 40 9.802 -8.248 5.930 279 HG3 LYS 40 2HG LYS 40 11.149 -9.075 5.128 280 HD2 LYS 40 1HD LYS 40 12.753 -7.564 6.310 281 HD3 LYS 40 2HD LYS 40 11.375 -6.765 7.115 282 HE2 LYS 40 1HE LYS 40 10.666 -8.972 8.024 283 HE3 LYS 40 2HE LYS 40 12.083 -9.735 7.295 284 HZ1 LYS 40 3HZ LYS 40 12.327 -9.235 9.624 285 HZ2 LYS 40 1HZ LYS 40 12.142 -7.625 9.361 286 HZ3 LYS 40 2HZ LYS 40 13.473 -8.404 8.765 287 H ASP 41 H ASP 41 8.133 -9.335 3.779 288 HA ASP 41 HA ASP 41 5.813 -7.555 4.254 289 HB2 ASP 41 1HB ASP 41 5.680 -9.756 2.862 290 HB3 ASP 41 2HB ASP 41 5.701 -10.569 4.415 291 H GLY 42 H GLY 42 5.483 -6.816 6.214 292 HA2 GLY 42 1HA GLY 42 6.712 -7.910 8.573 293 HA3 GLY 42 2HA GLY 42 5.578 -6.558 8.491 294 H ALA 43 H ALA 43 4.204 -9.320 6.919 295 HA ALA 43 HA ALA 43 2.421 -9.985 9.090 296 HB1 ALA 43 1HB ALA 43 3.129 -11.449 6.491 297 HB2 ALA 43 2HB ALA 43 1.777 -11.858 7.560 298 HB3 ALA 43 3HB ALA 43 1.800 -10.297 6.716 299 H THR 44 H THR 44 5.184 -11.610 7.566 300 HA THR 44 HA THR 44 5.740 -13.218 10.003 301 HB THR 44 HB THR 44 6.063 -15.033 8.021 302 HG1 THR 44 1HG THR 44 4.734 -14.715 6.354 303 HG21 THR 44 3HG2 THR 44 4.540 -15.292 9.976 304 HG22 THR 44 1HG2 THR 44 3.768 -15.824 8.471 305 HG23 THR 44 2HG2 THR 44 3.331 -14.270 9.165 306 H GLY 45 H GLY 45 7.069 -11.142 7.610 307 HA2 GLY 45 1HA GLY 45 9.198 -10.349 7.643 308 HA3 GLY 45 2HA GLY 45 9.804 -11.813 8.421 309 H GLU 46 H GLU 46 7.683 -12.254 5.653 310 HA GLU 46 HA GLU 46 9.687 -13.826 4.335 311 HB2 GLU 46 1HB GLU 46 6.993 -12.979 3.195 312 HB3 GLU 46 2HB GLU 46 7.965 -14.404 2.789 313 HG2 GLU 46 1HG GLU 46 7.662 -15.083 5.288 314 HG3 GLU 46 2HG GLU 46 6.497 -13.772 5.350 315 H SER 47 H SER 47 10.831 -13.282 2.483 316 HA SER 47 HA SER 47 11.126 -10.443 1.806 317 HB2 SER 47 1HB SER 47 12.195 -12.842 0.265 318 HB3 SER 47 2HB SER 47 12.823 -11.176 0.317 319 HG SER 47 HG SER 47 14.024 -12.656 1.588 320 H LEU 48 H LEU 48 10.286 -9.488 -0.179 321 HA LEU 48 HA LEU 48 8.712 -11.301 -1.934 322 HB2 LEU 48 1HB LEU 48 7.795 -8.484 -1.754 323 HB3 LEU 48 2HB LEU 48 6.917 -9.903 -2.128 324 HG LEU 48 HG LEU 48 7.806 -9.270 0.723 325 HD11 LEU 48 1HD1 LEU 48 5.461 -8.536 1.005 326 HD12 LEU 48 2HD1 LEU 48 5.252 -8.634 -0.756 327 HD13 LEU 48 3HD1 LEU 48 6.436 -7.502 -0.054 328 HD21 LEU 48 3HD2 LEU 48 7.114 -11.392 1.089 329 HD22 LEU 48 1HD2 LEU 48 6.690 -11.579 -0.631 330 HD23 LEU 48 2HD2 LEU 48 5.498 -10.940 0.536 331 H ALA 49 H ALA 49 8.416 -10.389 -3.998 332 HA ALA 49 HA ALA 49 10.867 -8.999 -5.026 333 HB1 ALA 49 1HB ALA 49 9.409 -11.368 -6.256 334 HB2 ALA 49 2HB ALA 49 10.772 -10.492 -6.982 335 HB3 ALA 49 3HB ALA 49 11.002 -11.402 -5.471 336 H SER 50 H SER 50 10.194 -7.067 -5.527 337 HA SER 50 HA SER 50 7.575 -6.571 -6.777 338 HB2 SER 50 1HB SER 50 9.733 -4.926 -5.617 339 HB3 SER 50 2HB SER 50 9.143 -4.285 -7.129 340 HG SER 50 HG SER 50 7.072 -4.166 -6.219 341 HA PRO 51 HA PRO 51 7.139 -4.629 -8.239 342 HB2 PRO 51 1HB PRO 51 5.842 -4.314 -10.591 343 HB3 PRO 51 2HB PRO 51 7.410 -3.513 -10.232 344 HG2 PRO 51 1HG PRO 51 6.970 -6.024 -11.810 345 HG3 PRO 51 2HG PRO 51 7.965 -4.604 -12.243 346 HD2 PRO 51 1HD PRO 51 9.016 -6.865 -11.051 347 HD3 PRO 51 2HD PRO 51 9.679 -5.225 -10.764 348 H VAL 52 H VAL 52 5.037 -5.310 -7.436 349 HA VAL 52 HA VAL 52 3.859 -7.764 -8.519 350 HB VAL 52 HB VAL 52 5.444 -8.449 -6.839 351 HG11 VAL 52 1HG1 VAL 52 5.132 -7.926 -4.436 352 HG12 VAL 52 2HG1 VAL 52 5.613 -6.532 -5.405 353 HG13 VAL 52 3HG1 VAL 52 3.919 -6.715 -4.886 354 HG21 VAL 52 3HG2 VAL 52 3.274 -9.709 -7.091 355 HG22 VAL 52 1HG2 VAL 52 4.018 -9.866 -5.496 356 HG23 VAL 52 2HG2 VAL 52 2.635 -8.793 -5.696 357 H ILE 53 H ILE 53 1.670 -8.172 -7.658 358 HA ILE 53 HA ILE 53 0.219 -5.701 -7.028 359 HB ILE 53 HB ILE 53 -0.572 -8.025 -8.830 360 HG12 ILE 53 1HG1 ILE 53 0.952 -6.781 -10.133 361 HG13 ILE 53 2HG1 ILE 53 -0.650 -6.293 -10.646 362 HG21 ILE 53 1HG2 ILE 53 -2.540 -7.128 -7.690 363 HG22 ILE 53 2HG2 ILE 53 -2.166 -5.498 -8.276 364 HG23 ILE 53 3HG2 ILE 53 -2.581 -6.785 -9.415 365 HD11 ILE 53 3HD1 ILE 53 1.277 -4.678 -9.031 366 HD12 ILE 53 1HD1 ILE 53 0.636 -4.340 -10.633 367 HD13 ILE 53 2HD1 ILE 53 -0.436 -4.228 -9.224 368 H LEU 54 H LEU 54 -0.890 -5.878 -5.224 369 HA LEU 54 HA LEU 54 -1.340 -8.489 -3.825 370 HB2 LEU 54 1HB LEU 54 -2.076 -5.631 -3.057 371 HB3 LEU 54 2HB LEU 54 -2.470 -7.055 -2.119 372 HG LEU 54 HG LEU 54 0.352 -6.046 -2.665 373 HD11 LEU 54 1HD1 LEU 54 0.315 -5.590 -0.207 374 HD12 LEU 54 2HD1 LEU 54 -1.387 -6.071 -0.152 375 HD13 LEU 54 3HD1 LEU 54 -0.892 -4.634 -1.078 376 HD21 LEU 54 3HD2 LEU 54 -0.686 -8.439 -1.095 377 HD22 LEU 54 1HD2 LEU 54 0.927 -7.785 -0.899 378 HD23 LEU 54 2HD2 LEU 54 0.450 -8.450 -2.470 379 H SER 55 H SER 55 -3.314 -9.352 -3.632 380 HA SER 55 HA SER 55 -5.600 -8.206 -5.108 381 HB2 SER 55 1HB SER 55 -6.028 -10.958 -4.616 382 HB3 SER 55 2HB SER 55 -5.622 -10.175 -6.150 383 HG SER 55 HG SER 55 -4.161 -11.896 -4.664 384 H ASP 56 H ASP 56 -7.724 -9.188 -4.115 385 HA ASP 56 HA ASP 56 -8.175 -7.931 -1.684 386 HB2 ASP 56 1HB ASP 56 -9.961 -8.276 -3.187 387 HB3 ASP 56 2HB ASP 56 -9.692 -10.010 -3.269 388 H GLU 57 H GLU 57 -7.357 -11.408 -2.174 389 HA GLU 57 HA GLU 57 -7.997 -12.170 0.540 390 HB2 GLU 57 1HB GLU 57 -6.368 -13.457 -1.688 391 HB3 GLU 57 2HB GLU 57 -6.395 -14.105 -0.051 392 HG2 GLU 57 1HG GLU 57 -9.058 -13.870 -0.356 393 HG3 GLU 57 2HG GLU 57 -8.620 -13.973 -2.063 394 H GLU 58 H GLU 58 -5.140 -10.773 -0.950 395 HA GLU 58 HA GLU 58 -3.355 -11.273 1.279 396 HB2 GLU 58 1HB GLU 58 -3.049 -8.878 -0.536 397 HB3 GLU 58 2HB GLU 58 -1.822 -9.931 0.157 398 HG2 GLU 58 1HG GLU 58 -3.667 -10.654 -2.171 399 HG3 GLU 58 2HG GLU 58 -2.039 -10.034 -2.330 400 H LEU 59 H LEU 59 -5.261 -8.560 0.055 401 HA LEU 59 HA LEU 59 -4.796 -6.801 2.308 402 HB2 LEU 59 1HB LEU 59 -6.568 -6.670 -0.155 403 HB3 LEU 59 2HB LEU 59 -6.426 -5.339 0.995 404 HG LEU 59 HG LEU 59 -3.949 -6.493 -0.339 405 HD11 LEU 59 1HD1 LEU 59 -5.570 -5.819 -2.098 406 HD12 LEU 59 2HD1 LEU 59 -4.082 -4.881 -2.085 407 HD13 LEU 59 3HD1 LEU 59 -5.570 -4.165 -1.427 408 HD21 LEU 59 3HD2 LEU 59 -3.545 -5.034 1.588 409 HD22 LEU 59 1HD2 LEU 59 -4.601 -3.775 0.903 410 HD23 LEU 59 2HD2 LEU 59 -3.071 -4.203 0.108 411 H ALA 60 H ALA 60 -6.181 -9.417 2.835 412 HA ALA 60 HA ALA 60 -8.902 -8.735 3.668 413 HB1 ALA 60 1HB ALA 60 -8.077 -11.014 2.881 414 HB2 ALA 60 2HB ALA 60 -7.180 -11.126 4.412 415 HB3 ALA 60 3HB ALA 60 -8.957 -11.018 4.404 416 H VAL 61 H VAL 61 -5.777 -8.148 4.938 417 HA VAL 61 HA VAL 61 -6.484 -8.386 7.764 418 HB VAL 61 HB VAL 61 -4.187 -7.517 8.114 419 HG11 VAL 61 1HG1 VAL 61 -4.567 -9.935 7.903 420 HG12 VAL 61 2HG1 VAL 61 -4.316 -9.844 6.146 421 HG13 VAL 61 3HG1 VAL 61 -2.983 -9.478 7.260 422 HG21 VAL 61 3HG2 VAL 61 -3.920 -6.092 6.116 423 HG22 VAL 61 1HG2 VAL 61 -2.612 -7.270 6.258 424 HG23 VAL 61 2HG2 VAL 61 -3.899 -7.532 5.072 425 H GLU 62 H GLU 62 -6.731 -6.644 9.209 426 HA GLU 62 HA GLU 62 -7.871 -4.207 8.283 427 HB2 GLU 62 1HB GLU 62 -7.438 -3.397 10.623 428 HB3 GLU 62 2HB GLU 62 -8.415 -4.855 10.497 429 HG2 GLU 62 1HG GLU 62 -6.822 -6.229 11.390 430 HG3 GLU 62 2HG GLU 62 -5.457 -5.288 10.843 431 H LYS 63 H LYS 63 -4.481 -5.094 8.907 432 HA LYS 63 HA LYS 63 -3.472 -2.485 8.094 433 HB2 LYS 63 1HB LYS 63 -4.102 -2.278 10.501 434 HB3 LYS 63 2HB LYS 63 -3.114 -3.671 10.897 435 HG2 LYS 63 1HG LYS 63 -1.990 -1.066 9.776 436 HG3 LYS 63 2HG LYS 63 -2.250 -1.367 11.481 437 HD2 LYS 63 1HD LYS 63 -0.757 -3.501 10.988 438 HD3 LYS 63 2HD LYS 63 -0.197 -2.501 9.628 439 HE2 LYS 63 1HE LYS 63 0.444 -0.699 11.169 440 HE3 LYS 63 2HE LYS 63 -0.218 -1.603 12.532 441 HZ1 LYS 63 3HZ LYS 63 2.169 -1.880 12.428 442 HZ2 LYS 63 1HZ LYS 63 2.126 -2.410 10.904 443 HZ3 LYS 63 2HZ LYS 63 1.453 -3.331 12.081 444 H VAL 64 H VAL 64 -1.347 -2.712 7.315 445 HA VAL 64 HA VAL 64 -0.080 -5.332 7.655 446 HB VAL 64 HB VAL 64 -1.598 -5.113 5.481 447 HG11 VAL 64 1HG1 VAL 64 -0.344 -2.967 4.697 448 HG12 VAL 64 2HG1 VAL 64 0.931 -4.064 4.218 449 HG13 VAL 64 3HG1 VAL 64 -0.681 -4.247 3.509 450 HG21 VAL 64 3HG2 VAL 64 1.151 -6.255 5.013 451 HG22 VAL 64 1HG2 VAL 64 -0.090 -7.043 6.027 452 HG23 VAL 64 2HG2 VAL 64 -0.389 -6.739 4.318 453 H THR 65 H THR 65 2.216 -5.124 6.999 454 HA THR 65 HA THR 65 3.260 -2.331 7.086 455 HB THR 65 HB THR 65 4.463 -4.611 8.693 456 HG1 THR 65 1HG THR 65 2.614 -4.570 9.675 457 HG21 THR 65 3HG2 THR 65 4.543 -1.581 8.983 458 HG22 THR 65 1HG2 THR 65 5.816 -2.577 8.278 459 HG23 THR 65 2HG2 THR 65 5.412 -2.759 9.996 460 H LEU 66 H LEU 66 4.654 -2.092 5.303 461 HA LEU 66 HA LEU 66 6.039 -4.520 4.305 462 HB2 LEU 66 1HB LEU 66 4.107 -2.705 2.858 463 HB3 LEU 66 2HB LEU 66 5.395 -3.526 1.982 464 HG LEU 66 HG LEU 66 3.554 -5.126 3.784 465 HD11 LEU 66 1HD1 LEU 66 2.174 -3.862 2.193 466 HD12 LEU 66 2HD1 LEU 66 2.173 -5.608 1.846 467 HD13 LEU 66 3HD1 LEU 66 3.169 -4.501 0.864 468 HD21 LEU 66 3HD2 LEU 66 4.243 -6.972 2.401 469 HD22 LEU 66 1HD2 LEU 66 5.726 -6.096 2.817 470 HD23 LEU 66 2HD2 LEU 66 5.025 -5.892 1.219 471 H SER 67 H SER 67 7.953 -4.179 3.436 472 HA SER 67 HA SER 67 9.087 -1.428 3.395 473 HB2 SER 67 1HB SER 67 9.071 -2.126 5.774 474 HB3 SER 67 2HB SER 67 10.068 -3.536 5.358 475 HG SER 67 HG SER 67 11.598 -2.188 5.870 476 H THR 68 H THR 68 11.710 -2.081 3.459 477 HA THR 68 HA THR 68 12.186 -3.825 1.098 478 HB THR 68 HB THR 68 14.209 -2.160 0.898 479 HG1 THR 68 1HG THR 68 12.187 -0.537 2.108 480 HG21 THR 68 3HG2 THR 68 11.399 -1.427 -0.038 481 HG22 THR 68 1HG2 THR 68 12.517 -2.554 -0.844 482 HG23 THR 68 2HG2 THR 68 12.931 -0.838 -0.722 483 H THR 69 H THR 69 14.084 -5.163 1.227 484 HA THR 69 HA THR 69 14.960 -5.600 3.943 485 HB THR 69 HB THR 69 16.424 -7.302 2.965 486 HG1 THR 69 1HG THR 69 16.343 -7.749 0.815 487 HG21 THR 69 3HG2 THR 69 13.603 -7.427 1.812 488 HG22 THR 69 1HG2 THR 69 14.059 -7.860 3.474 489 HG23 THR 69 2HG2 THR 69 14.677 -8.802 2.107 490 H GLY 70 H GLY 70 16.025 -3.509 1.390 491 HA2 GLY 70 1HA GLY 70 18.215 -2.505 3.053 492 HA3 GLY 70 2HA GLY 70 18.680 -3.243 1.508 493 H LYS 71 H LYS 71 19.459 -1.195 0.826 494 HA LYS 71 HA LYS 71 17.837 1.167 0.716 495 HB2 LYS 71 1HB LYS 71 20.443 0.876 0.631 496 HB3 LYS 71 2HB LYS 71 20.204 0.537 -1.088 497 HG2 LYS 71 1HG LYS 71 18.970 2.807 -1.206 498 HG3 LYS 71 2HG LYS 71 19.549 3.075 0.452 499 HD2 LYS 71 1HD LYS 71 21.292 4.050 -0.666 500 HD3 LYS 71 2HD LYS 71 21.881 2.374 -0.665 501 HE2 LYS 71 1HE LYS 71 20.557 2.147 -2.903 502 HE3 LYS 71 2HE LYS 71 20.480 3.935 -2.856 503 HZ1 LYS 71 3HZ LYS 71 22.398 2.926 -4.149 504 HZ2 LYS 71 1HZ LYS 71 22.975 2.311 -2.760 505 HZ3 LYS 71 2HZ LYS 71 22.917 3.932 -2.945 506 H ALA 72 H ALA 72 16.548 1.952 -0.933 507 HA ALA 72 HA ALA 72 16.524 0.650 -3.522 508 HB1 ALA 72 1HB ALA 72 14.010 1.192 -1.895 509 HB2 ALA 72 2HB ALA 72 14.048 0.573 -3.563 510 HB3 ALA 72 3HB ALA 72 14.672 -0.415 -2.235 511 H ILE 73 H ILE 73 15.170 2.082 -5.040 512 HA ILE 73 HA ILE 73 15.325 4.974 -4.299 513 HB ILE 73 HB ILE 73 15.876 4.126 -7.106 514 HG12 ILE 73 1HG1 ILE 73 17.294 2.460 -5.942 515 HG13 ILE 73 2HG1 ILE 73 18.047 3.564 -7.027 516 HG21 ILE 73 1HG2 ILE 73 15.880 6.488 -6.336 517 HG22 ILE 73 2HG2 ILE 73 17.219 6.134 -5.258 518 HG23 ILE 73 3HG2 ILE 73 17.440 6.007 -7.020 519 HD11 ILE 73 3HD1 ILE 73 19.385 3.055 -4.962 520 HD12 ILE 73 1HD1 ILE 73 19.138 4.785 -5.254 521 HD13 ILE 73 2HD1 ILE 73 18.188 3.940 -4.014 522 H GLU 74 H GLU 74 12.838 2.996 -4.516 523 HA GLU 74 HA GLU 74 11.229 5.035 -5.715 524 HB2 GLU 74 1HB GLU 74 11.446 2.374 -7.170 525 HB3 GLU 74 2HB GLU 74 9.894 3.179 -7.037 526 HG2 GLU 74 1HG GLU 74 11.394 5.287 -7.847 527 HG3 GLU 74 2HG GLU 74 12.266 3.977 -8.653 528 H PHE 75 H PHE 75 8.975 4.695 -5.124 529 HA PHE 75 HA PHE 75 8.103 2.183 -4.106 530 HB2 PHE 75 1HB PHE 75 8.906 3.994 -2.067 531 HB3 PHE 75 2HB PHE 75 7.172 4.117 -2.090 532 HD1 PHE 75 2HD PHE 75 8.964 0.867 -2.815 533 HD2 PHE 75 1HD PHE 75 6.846 3.214 0.166 534 HE1 PHE 75 2HE PHE 75 9.148 -0.971 -1.222 535 HE2 PHE 75 1HE PHE 75 7.026 1.348 1.705 536 HZ PHE 75 HZ PHE 75 8.241 -0.708 1.100 537 H ALA 76 H ALA 76 6.978 2.263 -5.974 538 HA ALA 76 HA ALA 76 4.941 4.351 -6.417 539 HB1 ALA 76 1HB ALA 76 5.508 1.765 -7.915 540 HB2 ALA 76 2HB ALA 76 4.340 3.018 -8.388 541 HB3 ALA 76 3HB ALA 76 6.078 3.390 -8.381 542 H VAL 77 H VAL 77 2.801 4.115 -5.945 543 HA VAL 77 HA VAL 77 1.726 1.635 -4.808 544 HB VAL 77 HB VAL 77 1.825 4.267 -3.263 545 HG11 VAL 77 1HG1 VAL 77 0.801 2.864 -1.435 546 HG12 VAL 77 2HG1 VAL 77 -0.232 3.187 -2.819 547 HG13 VAL 77 3HG1 VAL 77 0.532 1.591 -2.645 548 HG21 VAL 77 3HG2 VAL 77 4.003 3.344 -3.028 549 HG22 VAL 77 1HG2 VAL 77 3.120 2.934 -1.552 550 HG23 VAL 77 2HG2 VAL 77 3.367 1.713 -2.825 551 H SER 78 H SER 78 0.040 1.475 -6.278 552 HA SER 78 HA SER 78 -1.886 3.675 -6.415 553 HB2 SER 78 1HB SER 78 -0.752 2.305 -8.894 554 HB3 SER 78 2HB SER 78 -2.100 3.451 -8.858 555 HG SER 78 HG SER 78 -0.303 4.627 -9.337 556 H GLY 79 H GLY 79 -4.007 2.835 -7.569 557 HA2 GLY 79 1HA GLY 79 -4.557 0.359 -8.421 558 HA3 GLY 79 2HA GLY 79 -4.684 0.097 -6.686 559 H GLY 80 H GLY 80 -6.454 1.021 -5.555 560 HA2 GLY 80 1HA GLY 80 -8.187 2.711 -5.262 561 HA3 GLY 80 2HA GLY 80 -8.356 2.835 -6.997 562 H VAL 81 H VAL 81 -10.230 1.895 -4.658 563 HA VAL 81 HA VAL 81 -10.842 -0.873 -5.569 564 HB VAL 81 HB VAL 81 -10.387 -0.633 -3.184 565 HG11 VAL 81 1HG1 VAL 81 -12.695 1.292 -3.018 566 HG12 VAL 81 2HG1 VAL 81 -11.894 0.512 -1.645 567 HG13 VAL 81 3HG1 VAL 81 -10.997 1.638 -2.683 568 HG21 VAL 81 3HG2 VAL 81 -11.860 -2.017 -2.431 569 HG22 VAL 81 1HG2 VAL 81 -13.262 -1.198 -3.140 570 HG23 VAL 81 2HG2 VAL 81 -12.204 -2.196 -4.150 571 H VAL 82 H VAL 82 -13.345 -1.291 -5.604 572 HA VAL 82 HA VAL 82 -14.806 1.074 -6.594 573 HB VAL 82 HB VAL 82 -14.000 -0.047 -8.529 574 HG11 VAL 82 1HG1 VAL 82 -14.497 -2.392 -9.093 575 HG12 VAL 82 2HG1 VAL 82 -13.441 -2.254 -7.682 576 HG13 VAL 82 3HG1 VAL 82 -15.164 -2.637 -7.461 577 HG21 VAL 82 3HG2 VAL 82 -16.405 0.744 -8.491 578 HG22 VAL 82 1HG2 VAL 82 -15.943 -0.383 -9.760 579 HG23 VAL 82 2HG2 VAL 82 -16.871 -0.970 -8.378 580 H ASP 83 H ASP 83 -17.326 0.038 -6.724 581 HA ASP 83 HA ASP 83 -17.790 -1.241 -4.086 582 HB2 ASP 83 1HB ASP 83 -18.515 1.278 -4.726 583 HB3 ASP 83 2HB ASP 83 -19.921 0.411 -5.361 584 H GLY 84 H GLY 84 -18.090 -3.341 -4.621 585 HA2 GLY 84 1HA GLY 84 -18.707 -4.046 -7.415 586 HA3 GLY 84 2HA GLY 84 -17.986 -5.070 -6.172 587 H GLU 85 H GLU 85 -20.752 -3.395 -4.997 588 HA GLU 85 HA GLU 85 -22.566 -5.641 -5.588 589 HB2 GLU 85 1HB GLU 85 -22.347 -4.297 -2.873 590 HB3 GLU 85 2HB GLU 85 -23.383 -5.638 -3.367 591 HG2 GLU 85 1HG GLU 85 -21.119 -6.875 -3.863 592 HG3 GLU 85 2HG GLU 85 -20.416 -5.667 -2.798 593 H ASP 86 H ASP 86 -24.934 -4.672 -4.823 594 HA ASP 86 HA ASP 86 -25.361 -1.906 -5.000 595 HB2 ASP 86 1HB ASP 86 -24.907 -2.232 -7.443 596 HB3 ASP 86 2HB ASP 86 -26.179 -3.453 -7.504 597 H GLY 87 H GLY 87 -27.150 -1.773 -3.783 598 HA2 GLY 87 1HA GLY 87 -29.247 -2.172 -2.885 599 HA3 GLY 87 2HA GLY 87 -29.517 -3.399 -4.136 600 H VAL 88 H VAL 88 -26.743 -3.477 -1.886 601 HA VAL 88 HA VAL 88 -27.764 -5.975 -0.669 602 HB VAL 88 HB VAL 88 -25.359 -6.317 -0.163 603 HG11 VAL 88 1HG1 VAL 88 -25.920 -5.956 -3.126 604 HG12 VAL 88 2HG1 VAL 88 -24.735 -7.046 -2.367 605 HG13 VAL 88 3HG1 VAL 88 -26.459 -7.327 -2.133 606 HG21 VAL 88 3HG2 VAL 88 -24.719 -4.023 -2.028 607 HG22 VAL 88 1HG2 VAL 88 -24.724 -3.852 -0.266 608 HG23 VAL 88 2HG2 VAL 88 -23.622 -4.994 -1.014 609 H VAL 89 H VAL 89 -26.150 -5.992 1.616 610 HA VAL 89 HA VAL 89 -26.359 -3.346 2.852 611 HB VAL 89 HB VAL 89 -28.153 -4.595 3.772 612 HG11 VAL 89 1HG1 VAL 89 -27.992 -6.592 5.094 613 HG12 VAL 89 2HG1 VAL 89 -27.355 -6.896 3.468 614 HG13 VAL 89 3HG1 VAL 89 -26.242 -6.686 4.843 615 HG21 VAL 89 3HG2 VAL 89 -26.874 -3.045 5.225 616 HG22 VAL 89 1HG2 VAL 89 -27.645 -4.344 6.156 617 HG23 VAL 89 2HG2 VAL 89 -25.901 -4.402 5.815 618 H ASN 90 H ASN 90 -24.356 -2.684 2.921 619 HA ASN 90 HA ASN 90 -22.406 -4.193 4.368 620 HB2 ASN 90 1HB ASN 90 -22.073 -3.945 1.463 621 HB3 ASN 90 2HB ASN 90 -20.816 -3.030 2.298 622 HD21 ASN 90 1HD2 ASN 90 -21.630 -6.217 1.257 623 HD22 ASN 90 2HD2 ASN 90 -20.897 -7.084 2.615 624 H GLU 91 H GLU 91 -20.393 -2.366 4.567 625 HA GLU 91 HA GLU 91 -21.656 0.309 4.888 626 HB2 GLU 91 1HB GLU 91 -19.796 -1.286 6.651 627 HB3 GLU 91 2HB GLU 91 -19.785 0.473 6.732 628 HG2 GLU 91 1HG GLU 91 -22.462 -0.860 6.891 629 HG3 GLU 91 2HG GLU 91 -21.350 -1.161 8.211 630 HA PRO 92 HA PRO 92 -18.098 1.422 2.482 631 HB2 PRO 92 1HB PRO 92 -17.942 4.149 2.902 632 HB3 PRO 92 2HB PRO 92 -19.361 3.416 2.100 633 HG2 PRO 92 1HG PRO 92 -19.058 4.218 5.002 634 HG3 PRO 92 2HG PRO 92 -20.419 4.551 3.892 635 HD2 PRO 92 1HD PRO 92 -20.392 2.448 5.685 636 HD3 PRO 92 2HD PRO 92 -21.278 2.408 4.133 637 H MET 93 H MET 93 -15.918 3.020 2.726 638 HA MET 93 HA MET 93 -14.720 2.422 5.315 639 HB2 MET 93 1HB MET 93 -12.938 1.045 4.226 640 HB3 MET 93 2HB MET 93 -14.499 0.285 4.409 641 HG2 MET 93 1HG MET 93 -14.972 0.440 2.081 642 HG3 MET 93 2HG MET 93 -13.635 1.546 1.814 643 HE1 MET 93 3HE MET 93 -10.548 -1.020 2.353 644 HE2 MET 93 1HE MET 93 -10.995 0.703 2.350 645 HE3 MET 93 2HE MET 93 -11.342 -0.314 3.772 646 H GLN 94 H GLN 94 -12.323 2.850 5.216 647 HA GLN 94 HA GLN 94 -11.529 5.068 3.449 648 HB2 GLN 94 1HB GLN 94 -11.956 5.195 6.464 649 HB3 GLN 94 2HB GLN 94 -10.624 6.106 5.740 650 HG2 GLN 94 1HG GLN 94 -12.019 7.417 4.418 651 HG3 GLN 94 2HG GLN 94 -13.387 6.302 4.553 652 HE21 GLN 94 1HE2 GLN 94 -15.008 7.391 5.495 653 HE22 GLN 94 2HE2 GLN 94 -14.862 8.313 6.980 654 H TRP 95 H TRP 95 -9.228 5.422 3.611 655 HA TRP 95 HA TRP 95 -7.674 3.116 4.635 656 HB2 TRP 95 1HB TRP 95 -7.748 4.256 1.822 657 HB3 TRP 95 2HB TRP 95 -6.233 3.771 2.505 658 HD1 TRP 95 HD TRP 95 -8.769 1.342 3.674 659 HE1 TRP 95 1HE TRP 95 -8.412 -0.900 2.465 660 HE3 TRP 95 3HE TRP 95 -5.959 2.920 -0.319 661 HZ2 TRP 95 2HZ TRP 95 -6.721 -1.932 0.446 662 HZ3 TRP 95 3HZ TRP 95 -4.863 1.225 -1.764 663 HH2 TRP 95 HH TRP 95 -5.243 -1.183 -1.416 664 H VAL 96 H VAL 96 -5.821 3.732 5.628 665 HA VAL 96 HA VAL 96 -4.707 6.436 5.116 666 HB VAL 96 HB VAL 96 -4.315 5.000 7.776 667 HG11 VAL 96 1HG1 VAL 96 -3.804 7.244 8.583 668 HG12 VAL 96 2HG1 VAL 96 -2.802 6.807 7.200 669 HG13 VAL 96 3HG1 VAL 96 -4.171 7.925 6.977 670 HG21 VAL 96 3HG2 VAL 96 -6.713 5.194 7.794 671 HG22 VAL 96 1HG2 VAL 96 -6.031 6.433 8.845 672 HG23 VAL 96 2HG2 VAL 96 -6.627 6.883 7.232 673 H VAL 97 H VAL 97 -3.019 5.818 3.681 674 HA VAL 97 HA VAL 97 -1.325 3.551 4.591 675 HB VAL 97 HB VAL 97 0.133 4.288 2.703 676 HG11 VAL 97 1HG1 VAL 97 -1.229 3.213 0.900 677 HG12 VAL 97 2HG1 VAL 97 -1.054 2.303 2.410 678 HG13 VAL 97 3HG1 VAL 97 -2.575 3.166 2.074 679 HG21 VAL 97 3HG2 VAL 97 -0.430 5.827 1.118 680 HG22 VAL 97 1HG2 VAL 97 -2.148 5.494 1.257 681 HG23 VAL 97 2HG2 VAL 97 -1.409 6.541 2.439 682 H THR 98 H THR 98 0.895 4.241 5.280 683 HA THR 98 HA THR 98 1.363 7.152 5.563 684 HB THR 98 HB THR 98 1.846 5.128 7.799 685 HG1 THR 98 1HG THR 98 -0.087 5.433 8.316 686 HG21 THR 98 3HG2 THR 98 2.018 8.166 7.685 687 HG22 THR 98 1HG2 THR 98 3.394 7.059 7.764 688 HG23 THR 98 2HG2 THR 98 2.275 7.169 9.140 689 H VAL 99 H VAL 99 3.473 7.528 4.874 690 HA VAL 99 HA VAL 99 5.081 5.067 4.275 691 HB VAL 99 HB VAL 99 5.395 7.638 2.734 692 HG11 VAL 99 1HG1 VAL 99 6.311 6.094 1.027 693 HG12 VAL 99 2HG1 VAL 99 7.206 5.989 2.541 694 HG13 VAL 99 3HG1 VAL 99 6.039 4.720 2.117 695 HG21 VAL 99 3HG2 VAL 99 3.559 5.310 1.995 696 HG22 VAL 99 1HG2 VAL 99 3.017 6.955 2.370 697 HG23 VAL 99 2HG2 VAL 99 3.991 6.656 0.935 698 H TYR 100 H TYR 100 7.186 5.024 4.836 699 HA TYR 100 HA TYR 100 8.227 7.173 6.605 700 HB2 TYR 100 1HB TYR 100 8.372 4.148 6.933 701 HB3 TYR 100 2HB TYR 100 9.249 5.324 7.896 702 HD1 TYR 100 2HD TYR 100 5.708 4.402 6.923 703 HD2 TYR 100 1HD TYR 100 8.331 5.900 9.993 704 HE1 TYR 100 2HE TYR 100 3.809 4.564 8.451 705 HE2 TYR 100 1HE TYR 100 6.409 6.102 11.540 706 HH TYR 100 HH TYR 100 3.055 5.251 10.550 707 H LYS 101 H LYS 101 10.358 7.622 6.397 708 HA LYS 101 HA LYS 101 11.832 6.385 4.162 709 HB2 LYS 101 1HB LYS 101 11.167 8.920 4.264 710 HB3 LYS 101 2HB LYS 101 12.513 9.077 5.385 711 HG2 LYS 101 1HG LYS 101 14.089 8.503 3.686 712 HG3 LYS 101 2HG LYS 101 12.813 7.737 2.711 713 HD2 LYS 101 1HD LYS 101 12.476 9.497 1.517 714 HD3 LYS 101 2HD LYS 101 12.161 10.478 2.981 715 HE2 LYS 101 1HE LYS 101 14.617 10.875 3.182 716 HE3 LYS 101 2HE LYS 101 14.831 10.087 1.609 717 HZ1 LYS 101 3HZ LYS 101 13.681 11.778 0.544 718 HZ2 LYS 101 1HZ LYS 101 14.504 12.640 1.649 719 HZ3 LYS 101 2HZ LYS 101 12.916 12.301 1.900 720 H ASN 102 H ASN 102 14.333 6.905 4.836 721 HA ASN 102 HA ASN 102 15.004 4.973 6.768 722 HB2 ASN 102 1HB ASN 102 17.328 5.572 6.365 723 HB3 ASN 102 2HB ASN 102 16.427 5.177 4.931 724 HD21 ASN 102 1HD2 ASN 102 15.748 7.082 3.492 725 HD22 ASN 102 2HD2 ASN 102 16.966 8.358 3.392 726 H GLY 103 H GLY 103 13.608 6.199 8.499 727 HA2 GLY 103 1HA GLY 103 15.044 7.266 10.610 728 HA3 GLY 103 2HA GLY 103 14.558 8.660 9.624 729 H LYS 104 H LYS 104 12.057 8.478 8.903 730 HA LYS 104 HA LYS 104 10.326 7.432 10.945 731 HB2 LYS 104 1HB LYS 104 9.675 9.330 12.027 732 HB3 LYS 104 2HB LYS 104 11.427 9.398 11.996 733 HG2 LYS 104 1HG LYS 104 11.412 11.358 11.026 734 HG3 LYS 104 2HG LYS 104 10.539 10.786 9.638 735 HD2 LYS 104 1HD LYS 104 9.146 12.515 10.505 736 HD3 LYS 104 2HD LYS 104 8.394 10.990 11.026 737 HE2 LYS 104 1HE LYS 104 9.607 11.242 13.216 738 HE3 LYS 104 2HE LYS 104 10.148 12.842 12.683 739 HZ1 LYS 104 3HZ LYS 104 7.811 13.491 12.552 740 HZ2 LYS 104 1HZ LYS 104 8.187 12.969 14.045 741 HZ3 LYS 104 2HZ LYS 104 7.331 11.980 13.039 742 H GLU 105 H GLU 105 8.092 8.633 10.604 743 HA GLU 105 HA GLU 105 6.922 8.196 8.118 744 HB2 GLU 105 1HB GLU 105 5.761 8.650 10.303 745 HB3 GLU 105 2HB GLU 105 6.280 10.330 10.179 746 HG2 GLU 105 1HG GLU 105 4.914 9.851 7.736 747 HG3 GLU 105 2HG GLU 105 4.009 8.982 8.957 748 H ILE 106 H ILE 106 6.788 9.356 6.250 749 HA ILE 106 HA ILE 106 7.621 12.214 6.245 750 HB ILE 106 HB ILE 106 8.454 11.796 3.934 751 HG12 ILE 106 1HG1 ILE 106 8.753 8.882 4.667 752 HG13 ILE 106 2HG1 ILE 106 7.315 9.434 3.815 753 HG21 ILE 106 1HG2 ILE 106 9.889 12.131 5.964 754 HG22 ILE 106 2HG2 ILE 106 10.005 10.372 6.138 755 HG23 ILE 106 3HG2 ILE 106 10.666 11.183 4.699 756 HD11 ILE 106 3HD1 ILE 106 9.972 10.236 2.681 757 HD12 ILE 106 1HD1 ILE 106 9.397 8.580 2.485 758 HD13 ILE 106 2HD1 ILE 106 8.426 9.950 1.874 759 H GLU 107 H GLU 107 5.235 9.781 5.244 760 HA GLU 107 HA GLU 107 3.835 11.948 3.736 761 HB2 GLU 107 1HB GLU 107 4.760 10.031 2.332 762 HB3 GLU 107 2HB GLU 107 3.686 8.983 3.230 763 HG2 GLU 107 1HG GLU 107 2.587 9.451 1.181 764 HG3 GLU 107 2HG GLU 107 1.715 10.305 2.442 765 H LYS 108 H LYS 108 1.921 12.442 4.423 766 HA LYS 108 HA LYS 108 0.285 10.569 6.033 767 HB2 LYS 108 1HB LYS 108 1.305 12.215 7.562 768 HB3 LYS 108 2HB LYS 108 0.711 13.537 6.565 769 HG2 LYS 108 1HG LYS 108 -1.541 11.845 7.217 770 HG3 LYS 108 2HG LYS 108 -0.638 12.101 8.696 771 HD2 LYS 108 1HD LYS 108 -1.519 14.359 6.864 772 HD3 LYS 108 2HD LYS 108 -2.497 13.757 8.192 773 HE2 LYS 108 1HE LYS 108 0.303 14.889 8.575 774 HE3 LYS 108 2HE LYS 108 -1.196 15.821 8.718 775 HZ1 LYS 108 3HZ LYS 108 -0.353 13.576 10.406 776 HZ2 LYS 108 1HZ LYS 108 -1.905 14.169 10.427 777 HZ3 LYS 108 2HZ LYS 108 -0.649 15.115 10.873 778 H LYS 109 H LYS 109 -0.814 10.001 4.099 779 HA LYS 109 HA LYS 109 -2.853 12.035 3.414 780 HB2 LYS 109 1HB LYS 109 -1.079 11.652 1.546 781 HB3 LYS 109 2HB LYS 109 -1.788 10.073 1.389 782 HG2 LYS 109 1HG LYS 109 -3.805 12.249 1.175 783 HG3 LYS 109 2HG LYS 109 -2.462 12.426 0.034 784 HD2 LYS 109 1HD LYS 109 -2.838 9.926 -0.457 785 HD3 LYS 109 2HD LYS 109 -4.436 10.146 0.244 786 HE2 LYS 109 1HE LYS 109 -3.174 11.382 -2.258 787 HE3 LYS 109 2HE LYS 109 -4.380 10.145 -2.174 788 HZ1 LYS 109 3HZ LYS 109 -4.879 12.981 -1.610 789 HZ2 LYS 109 1HZ LYS 109 -5.930 11.796 -1.142 790 HZ3 LYS 109 2HZ LYS 109 -5.556 11.957 -2.716 791 H SER 110 H SER 110 -4.910 10.920 2.732 792 HA SER 110 HA SER 110 -5.277 8.126 3.520 793 HB2 SER 110 1HB SER 110 -5.317 9.349 5.584 794 HB3 SER 110 2HB SER 110 -6.496 10.517 4.967 795 HG SER 110 HG SER 110 -7.185 7.762 4.956 796 H LEU 111 H LEU 111 -7.318 7.352 2.701 797 HA LEU 111 HA LEU 111 -8.588 9.054 0.628 798 HB2 LEU 111 1HB LEU 111 -8.229 6.047 0.502 799 HB3 LEU 111 2HB LEU 111 -8.862 7.107 -0.747 800 HG LEU 111 HG LEU 111 -5.971 6.897 0.166 801 HD11 LEU 111 1HD1 LEU 111 -5.710 6.186 -2.265 802 HD12 LEU 111 2HD1 LEU 111 -7.463 6.116 -2.351 803 HD13 LEU 111 3HD1 LEU 111 -6.595 5.060 -1.196 804 HD21 LEU 111 3HD2 LEU 111 -6.454 9.244 -0.480 805 HD22 LEU 111 1HD2 LEU 111 -7.079 8.661 -2.035 806 HD23 LEU 111 2HD2 LEU 111 -5.382 8.412 -1.631 807 H VAL 112 H VAL 112 -10.814 8.319 0.123 808 HA VAL 112 HA VAL 112 -12.181 6.926 2.323 809 HB VAL 112 HB VAL 112 -12.205 9.253 2.932 810 HG11 VAL 112 1HG1 VAL 112 -13.330 9.916 0.184 811 HG12 VAL 112 2HG1 VAL 112 -13.178 11.034 1.538 812 HG13 VAL 112 3HG1 VAL 112 -11.727 10.363 0.808 813 HG21 VAL 112 3HG2 VAL 112 -14.343 7.826 3.103 814 HG22 VAL 112 1HG2 VAL 112 -14.514 9.576 3.247 815 HG23 VAL 112 2HG2 VAL 112 -14.933 8.764 1.720 816 H PHE 113 H PHE 113 -13.761 5.584 1.601 817 HA PHE 113 HA PHE 113 -14.331 5.651 -1.303 818 HB2 PHE 113 1HB PHE 113 -14.038 3.222 0.478 819 HB3 PHE 113 2HB PHE 113 -14.246 3.251 -1.265 820 HD1 PHE 113 2HD PHE 113 -12.179 5.363 -2.040 821 HD2 PHE 113 1HD PHE 113 -11.977 2.063 0.728 822 HE1 PHE 113 2HE PHE 113 -9.745 5.276 -2.317 823 HE2 PHE 113 1HE PHE 113 -9.547 1.956 0.422 824 HZ PHE 113 HZ PHE 113 -8.400 3.565 -1.090 825 H ARG 114 H ARG 114 -16.283 6.272 -1.572 826 HA ARG 114 HA ARG 114 -18.472 5.525 0.250 827 HB2 ARG 114 1HB ARG 114 -17.479 8.357 -0.233 828 HB3 ARG 114 2HB ARG 114 -19.116 7.981 0.297 829 HG2 ARG 114 1HG ARG 114 -16.636 7.067 1.829 830 HG3 ARG 114 2HG ARG 114 -17.327 8.664 2.080 831 HD2 ARG 114 1HD ARG 114 -18.959 6.129 2.402 832 HD3 ARG 114 2HD ARG 114 -18.103 6.941 3.732 833 HE ARG 114 HE ARG 114 -19.811 8.717 2.215 834 HH11 ARG 114 1HH1 ARG 114 -19.858 6.388 4.870 835 HH12 ARG 114 2HH1 ARG 114 -21.122 7.179 5.745 836 HH21 ARG 114 1HH2 ARG 114 -21.456 9.726 3.259 837 HH22 ARG 114 2HH2 ARG 114 -22.295 8.985 4.609 838 H ASP 115 H ASP 115 -19.589 4.657 -1.280 839 HA ASP 115 HA ASP 115 -21.019 6.125 -3.287 840 HB2 ASP 115 1HB ASP 115 -18.586 5.639 -4.227 841 HB3 ASP 115 2HB ASP 115 -19.221 4.007 -4.492 842 H GLY 116 H GLY 116 -21.873 3.960 -4.810 843 HA2 GLY 116 1HA GLY 116 -22.165 1.632 -3.138 844 HA3 GLY 116 2HA GLY 116 -23.695 2.487 -3.349 845 H LYS 117 H LYS 117 -21.419 2.737 -6.057 846 HA LYS 117 HA LYS 117 -22.882 0.692 -7.585 847 HB2 LYS 117 1HB LYS 117 -22.756 3.698 -8.092 848 HB3 LYS 117 2HB LYS 117 -23.186 2.553 -9.356 849 HG2 LYS 117 1HG LYS 117 -24.714 2.760 -6.719 850 HG3 LYS 117 2HG LYS 117 -25.111 3.698 -8.112 851 HD2 LYS 117 1HD LYS 117 -25.007 0.652 -8.182 852 HD3 LYS 117 2HD LYS 117 -26.450 1.555 -7.766 853 HE2 LYS 117 1HE LYS 117 -24.936 1.825 -10.404 854 HE3 LYS 117 2HE LYS 117 -26.402 0.865 -10.153 855 HZ1 LYS 117 3HZ LYS 117 -26.233 3.803 -9.830 856 HZ2 LYS 117 1HZ LYS 117 -27.553 2.880 -9.506 857 HZ3 LYS 117 2HZ LYS 117 -26.988 3.014 -11.039 858 H GLU 118 H GLU 118 -21.909 0.752 -9.904 859 HA GLU 118 HA GLU 118 -19.104 0.289 -9.725 860 HB2 GLU 118 1HB GLU 118 -19.181 -0.187 -12.056 861 HB3 GLU 118 2HB GLU 118 -20.774 -0.661 -11.455 862 HG2 GLU 118 1HG GLU 118 -21.518 1.721 -12.146 863 HG3 GLU 118 2HG GLU 118 -20.005 1.813 -13.055 864 H ILE 119 H ILE 119 -17.365 1.587 -10.072 865 HA ILE 119 HA ILE 119 -17.490 4.170 -11.293 866 HB ILE 119 HB ILE 119 -16.465 5.387 -9.419 867 HG12 ILE 119 1HG1 ILE 119 -17.200 4.421 -7.084 868 HG13 ILE 119 2HG1 ILE 119 -17.128 2.871 -7.881 869 HG21 ILE 119 1HG2 ILE 119 -18.448 6.050 -8.332 870 HG22 ILE 119 2HG2 ILE 119 -18.890 5.623 -9.992 871 HG23 ILE 119 3HG2 ILE 119 -19.252 4.510 -8.648 872 HD11 ILE 119 3HD1 ILE 119 -14.819 4.840 -7.852 873 HD12 ILE 119 1HD1 ILE 119 -15.020 3.507 -6.688 874 HD13 ILE 119 2HD1 ILE 119 -14.787 3.156 -8.408 875 H SER 120 H SER 120 -15.153 5.073 -11.057 876 HA SER 120 HA SER 120 -13.047 3.288 -10.399 877 HB2 SER 120 1HB SER 120 -13.600 3.775 -13.334 878 HB3 SER 120 2HB SER 120 -11.943 3.546 -12.733 879 HG SER 120 HG SER 120 -14.075 1.798 -12.072 880 H THR 121 H THR 121 -12.573 4.974 -8.979 881 HA THR 121 HA THR 121 -11.475 7.497 -10.036 882 HB THR 121 HB THR 121 -10.601 7.121 -7.438 883 HG1 THR 121 1HG THR 121 -12.228 6.435 -6.233 884 HG21 THR 121 3HG2 THR 121 -13.067 8.618 -8.410 885 HG22 THR 121 1HG2 THR 121 -11.395 9.215 -8.495 886 HG23 THR 121 2HG2 THR 121 -12.151 8.951 -6.922 887 H ASP 122 H ASP 122 -9.268 7.934 -9.629 888 HA ASP 122 HA ASP 122 -7.566 5.533 -9.567 889 HB2 ASP 122 1HB ASP 122 -7.392 6.679 -11.814 890 HB3 ASP 122 2HB ASP 122 -6.772 8.105 -10.998 891 H ASP 123 H ASP 123 -8.547 6.247 -7.429 892 HA ASP 123 HA ASP 123 -7.639 8.573 -6.134 893 HB2 ASP 123 1HB ASP 123 -9.395 6.608 -5.478 894 HB3 ASP 123 2HB ASP 123 -8.124 6.172 -4.421 895 H LEU 124 H LEU 124 -5.742 5.788 -6.725 896 HA LEU 124 HA LEU 124 -3.782 6.684 -4.665 897 HB2 LEU 124 1HB LEU 124 -5.029 4.396 -4.324 898 HB3 LEU 124 2HB LEU 124 -3.949 3.882 -5.599 899 HG LEU 124 HG LEU 124 -1.971 4.519 -4.248 900 HD11 LEU 124 1HD1 LEU 124 -3.889 5.013 -1.940 901 HD12 LEU 124 2HD1 LEU 124 -2.966 6.283 -2.774 902 HD13 LEU 124 3HD1 LEU 124 -2.121 5.027 -1.881 903 HD21 LEU 124 3HD2 LEU 124 -4.037 2.675 -3.033 904 HD22 LEU 124 1HD2 LEU 124 -2.359 2.707 -2.456 905 HD23 LEU 124 2HD2 LEU 124 -2.709 2.230 -4.123 906 H ASN 125 H ASN 125 -2.199 7.584 -5.582 907 HA ASN 125 HA ASN 125 -1.123 6.865 -8.232 908 HB2 ASN 125 1HB ASN 125 -1.610 9.144 -8.939 909 HB3 ASN 125 2HB ASN 125 -3.090 8.248 -8.623 910 HD21 ASN 125 1HD2 ASN 125 -1.256 11.105 -7.798 911 HD22 ASN 125 2HD2 ASN 125 -2.396 11.696 -6.574 912 H LEU 126 H LEU 126 0.500 6.345 -6.231 913 HA LEU 126 HA LEU 126 2.088 8.816 -5.620 914 HB2 LEU 126 1HB LEU 126 1.787 6.279 -4.017 915 HB3 LEU 126 2HB LEU 126 2.644 7.739 -3.516 916 HG LEU 126 HG LEU 126 -0.413 7.711 -3.946 917 HD11 LEU 126 1HD1 LEU 126 1.197 7.250 -1.412 918 HD12 LEU 126 2HD1 LEU 126 0.314 5.984 -2.304 919 HD13 LEU 126 3HD1 LEU 126 -0.580 7.310 -1.578 920 HD21 LEU 126 3HD2 LEU 126 -0.354 9.648 -2.487 921 HD22 LEU 126 1HD2 LEU 126 0.609 9.908 -3.937 922 HD23 LEU 126 2HD2 LEU 126 1.421 9.559 -2.384 923 H TYR 127 H TYR 127 4.313 8.627 -5.923 924 HA TYR 127 HA TYR 127 5.506 6.125 -6.958 925 HB2 TYR 127 1HB TYR 127 5.308 8.631 -8.644 926 HB3 TYR 127 2HB TYR 127 6.152 7.153 -9.045 927 HD1 TYR 127 2HD TYR 127 4.935 5.110 -9.634 928 HD2 TYR 127 1HD TYR 127 2.858 8.806 -8.851 929 HE1 TYR 127 2HE TYR 127 2.913 4.206 -10.757 930 HE2 TYR 127 1HE TYR 127 0.829 7.905 -9.962 931 HH TYR 127 HH TYR 127 0.733 4.634 -11.437 932 H TYR 128 H TYR 128 6.528 6.602 -4.837 933 HA TYR 128 HA TYR 128 8.315 8.905 -4.620 934 HB2 TYR 128 1HB TYR 128 7.919 6.388 -3.005 935 HB3 TYR 128 2HB TYR 128 9.369 7.336 -2.776 936 HD1 TYR 128 1HD TYR 128 8.942 10.005 -2.699 937 HD2 TYR 128 2HD TYR 128 6.184 6.912 -1.438 938 HE1 TYR 128 1HE TYR 128 7.840 11.625 -1.194 939 HE2 TYR 128 2HE TYR 128 5.004 8.582 0.011 940 HH TYR 128 HH TYR 128 5.794 11.997 0.014 941 H ASN 129 H ASN 129 10.660 8.744 -4.485 942 HA ASN 129 HA ASN 129 12.215 6.699 -5.748 943 HB2 ASN 129 1HB ASN 129 11.390 7.501 -7.806 944 HB3 ASN 129 2HB ASN 129 11.277 9.121 -7.185 945 HD21 ASN 129 1HD2 ASN 129 12.287 9.455 -9.407 946 HD22 ASN 129 2HD2 ASN 129 14.045 9.460 -9.466 Start of MODEL 8 1 H1 GLY 1 H GLY 1 32.899 -14.796 4.932 2 HA2 GLY 1 1HA GLY 1 31.398 -12.495 6.047 3 HA3 GLY 1 2HA GLY 1 32.854 -13.181 6.834 4 H ASP 2 H ASP 2 31.860 -10.738 4.857 5 HA ASP 2 HA ASP 2 34.180 -10.231 3.223 6 HB2 ASP 2 1HB ASP 2 33.295 -12.201 2.058 7 HB3 ASP 2 2HB ASP 2 31.638 -11.618 2.229 8 H ASP 3 H ASP 3 33.957 -8.007 2.879 9 HA ASP 3 HA ASP 3 31.410 -6.795 3.757 10 HB2 ASP 3 1HB ASP 3 32.474 -5.514 5.410 11 HB3 ASP 3 2HB ASP 3 32.847 -7.211 5.662 12 H ASP 4 H ASP 4 33.812 -6.470 1.301 13 HA ASP 4 HA ASP 4 33.090 -3.614 0.952 14 HB2 ASP 4 1HB ASP 4 35.387 -4.247 0.366 15 HB3 ASP 4 2HB ASP 4 34.777 -5.352 -0.870 16 H GLU 5 H GLU 5 31.040 -3.344 0.284 17 HA GLU 5 HA GLU 5 30.546 -4.095 -2.380 18 HB2 GLU 5 1HB GLU 5 29.632 -6.174 -1.382 19 HB3 GLU 5 2HB GLU 5 28.384 -5.230 -0.573 20 HG2 GLU 5 1HG GLU 5 27.417 -4.546 -2.674 21 HG3 GLU 5 2HG GLU 5 28.861 -5.006 -3.575 22 HA PRO 6 HA PRO 6 28.812 -0.067 -0.965 23 HB2 PRO 6 1HB PRO 6 30.055 1.552 -2.783 24 HB3 PRO 6 2HB PRO 6 30.836 0.977 -1.284 25 HG2 PRO 6 1HG PRO 6 31.109 -0.157 -4.089 26 HG3 PRO 6 2HG PRO 6 32.414 0.198 -2.911 27 HD2 PRO 6 1HD PRO 6 31.371 -2.310 -3.240 28 HD3 PRO 6 2HD PRO 6 31.928 -1.717 -1.656 29 H GLY 7 H GLY 7 27.011 0.908 -1.836 30 HA2 GLY 7 1HA GLY 7 26.098 -0.041 -4.510 31 HA3 GLY 7 2HA GLY 7 25.065 0.395 -3.143 32 H GLY 8 H GLY 8 25.686 2.828 -2.293 33 HA2 GLY 8 1HA GLY 8 26.332 4.989 -3.781 34 HA3 GLY 8 2HA GLY 8 24.923 4.395 -4.664 35 H LYS 9 H LYS 9 23.590 6.167 -4.155 36 HA LYS 9 HA LYS 9 22.758 6.431 -1.364 37 HB2 LYS 9 1HB LYS 9 22.551 8.917 -1.907 38 HB3 LYS 9 2HB LYS 9 24.186 8.291 -1.674 39 HG2 LYS 9 1HG LYS 9 24.584 8.214 -4.065 40 HG3 LYS 9 2HG LYS 9 22.913 8.698 -4.399 41 HD2 LYS 9 1HD LYS 9 23.277 10.900 -3.711 42 HD3 LYS 9 2HD LYS 9 24.731 10.483 -2.776 43 HE2 LYS 9 1HE LYS 9 26.092 10.329 -4.648 44 HE3 LYS 9 2HE LYS 9 24.752 9.915 -5.721 45 HZ1 LYS 9 3HZ LYS 9 25.208 12.639 -4.643 46 HZ2 LYS 9 1HZ LYS 9 24.041 12.140 -5.719 47 HZ3 LYS 9 2HZ LYS 9 25.596 12.112 -6.155 48 H GLY 10 H GLY 10 20.803 6.892 -1.106 49 HA2 GLY 10 1HA GLY 10 18.785 7.950 -2.757 50 HA3 GLY 10 2HA GLY 10 18.612 6.183 -2.749 51 H ALA 11 H ALA 11 17.093 5.653 -1.272 52 HA ALA 11 HA ALA 11 17.366 6.397 1.555 53 HB1 ALA 11 1HB ALA 11 15.880 8.173 0.567 54 HB2 ALA 11 2HB ALA 11 14.803 6.906 -0.064 55 HB3 ALA 11 3HB ALA 11 14.982 7.130 1.686 56 H MET 12 H MET 12 15.138 5.211 2.521 57 HA MET 12 HA MET 12 14.680 2.605 1.227 58 HB2 MET 12 1HB MET 12 14.164 3.317 4.152 59 HB3 MET 12 2HB MET 12 13.886 1.776 3.336 60 HG2 MET 12 1HG MET 12 16.385 1.692 2.935 61 HG3 MET 12 2HG MET 12 16.554 3.066 3.999 62 HE1 MET 12 3HE MET 12 15.437 -0.663 3.652 63 HE2 MET 12 1HE MET 12 15.140 -1.156 5.339 64 HE3 MET 12 2HE MET 12 14.018 -0.051 4.530 65 H TYR 13 H TYR 13 12.229 2.090 1.588 66 HA TYR 13 HA TYR 13 10.553 4.419 2.119 67 HB2 TYR 13 1HB TYR 13 10.264 2.624 -0.326 68 HB3 TYR 13 2HB TYR 13 9.047 3.742 0.273 69 HD1 TYR 13 2HD TYR 13 9.945 6.271 0.632 70 HD2 TYR 13 1HD TYR 13 11.403 3.405 -2.240 71 HE1 TYR 13 2HE TYR 13 10.586 8.120 -0.895 72 HE2 TYR 13 1HE TYR 13 11.999 5.253 -3.797 73 HH TYR 13 HH TYR 13 12.011 7.583 -4.153 74 H GLU 14 H GLU 14 8.458 3.741 2.928 75 HA GLU 14 HA GLU 14 7.997 0.899 3.542 76 HB2 GLU 14 1HB GLU 14 9.409 1.514 5.337 77 HB3 GLU 14 2HB GLU 14 8.720 3.119 5.471 78 HG2 GLU 14 1HG GLU 14 6.654 2.097 6.428 79 HG3 GLU 14 2HG GLU 14 7.400 0.497 6.240 80 H VAL 15 H VAL 15 5.691 0.633 3.690 81 HA VAL 15 HA VAL 15 3.864 3.002 3.730 82 HB VAL 15 HB VAL 15 4.312 2.220 1.344 83 HG11 VAL 15 1HG1 VAL 15 4.607 -0.217 1.782 84 HG12 VAL 15 2HG1 VAL 15 2.881 -0.341 2.139 85 HG13 VAL 15 3HG1 VAL 15 3.398 0.125 0.529 86 HG21 VAL 15 3HG2 VAL 15 1.986 2.221 0.668 87 HG22 VAL 15 1HG2 VAL 15 1.464 1.718 2.280 88 HG23 VAL 15 2HG2 VAL 15 2.165 3.321 2.045 89 H THR 16 H THR 16 2.101 2.573 4.987 90 HA THR 16 HA THR 16 1.998 -0.099 6.325 91 HB THR 16 HB THR 16 0.505 1.295 7.971 92 HG1 THR 16 1HG THR 16 1.949 3.299 6.562 93 HG21 THR 16 3HG2 THR 16 2.813 0.381 8.503 94 HG22 THR 16 1HG2 THR 16 2.421 1.904 9.313 95 HG23 THR 16 2HG2 THR 16 3.496 1.896 7.900 96 H ILE 17 H ILE 17 -0.343 -0.797 6.881 97 HA ILE 17 HA ILE 17 -2.272 0.418 5.073 98 HB ILE 17 HB ILE 17 -1.506 -1.794 4.049 99 HG12 ILE 17 1HG1 ILE 17 -3.784 -2.772 3.670 100 HG13 ILE 17 2HG1 ILE 17 -4.440 -1.718 4.919 101 HG21 ILE 17 1HG2 ILE 17 -2.130 -3.906 5.013 102 HG22 ILE 17 2HG2 ILE 17 -1.228 -2.982 6.205 103 HG23 ILE 17 3HG2 ILE 17 -2.991 -3.126 6.354 104 HD11 ILE 17 3HD1 ILE 17 -3.026 -0.772 2.408 105 HD12 ILE 17 1HD1 ILE 17 -4.793 -0.865 2.609 106 HD13 ILE 17 2HD1 ILE 17 -3.845 0.242 3.618 107 H GLU 18 H GLU 18 -4.296 0.654 6.195 108 HA GLU 18 HA GLU 18 -4.687 -1.024 8.598 109 HB2 GLU 18 1HB GLU 18 -5.382 1.939 8.415 110 HB3 GLU 18 2HB GLU 18 -5.863 0.851 9.696 111 HG2 GLU 18 1HG GLU 18 -3.632 0.706 10.554 112 HG3 GLU 18 2HG GLU 18 -2.948 1.486 9.128 113 H GLN 19 H GLN 19 -6.477 -2.212 8.038 114 HA GLN 19 HA GLN 19 -8.545 -0.964 6.281 115 HB2 GLN 19 1HB GLN 19 -7.960 -3.909 6.834 116 HB3 GLN 19 2HB GLN 19 -9.251 -3.248 5.826 117 HG2 GLN 19 1HG GLN 19 -7.383 -2.108 4.461 118 HG3 GLN 19 2HG GLN 19 -6.268 -3.187 5.302 119 HE21 GLN 19 1HE2 GLN 19 -6.976 -5.609 5.261 120 HE22 GLN 19 2HE2 GLN 19 -7.326 -6.192 3.692 121 H SER 20 H SER 20 -10.433 -0.433 7.335 122 HA SER 20 HA SER 20 -11.359 -2.300 9.380 123 HB2 SER 20 1HB SER 20 -11.878 -0.472 10.988 124 HB3 SER 20 2HB SER 20 -10.158 -0.709 10.762 125 HG SER 20 HG SER 20 -10.156 1.109 9.332 126 H GLY 21 H GLY 21 -13.548 -1.775 10.084 127 HA2 GLY 21 1HA GLY 21 -15.783 -1.331 9.626 128 HA3 GLY 21 2HA GLY 21 -15.337 -0.404 8.176 129 H ASP 22 H ASP 22 -15.751 -1.462 6.273 130 HA ASP 22 HA ASP 22 -15.974 -4.432 6.336 131 HB2 ASP 22 1HB ASP 22 -17.969 -3.015 6.000 132 HB3 ASP 22 2HB ASP 22 -17.342 -2.524 4.432 133 H PHE 23 H PHE 23 -13.854 -4.953 5.874 134 HA PHE 23 HA PHE 23 -12.788 -3.974 3.289 135 HB2 PHE 23 1HB PHE 23 -10.614 -4.665 4.117 136 HB3 PHE 23 2HB PHE 23 -11.413 -3.484 5.138 137 HD1 PHE 23 1HD PHE 23 -10.315 -7.047 4.923 138 HD2 PHE 23 2HD PHE 23 -12.025 -3.975 7.433 139 HE1 PHE 23 1HE PHE 23 -9.866 -8.424 6.915 140 HE2 PHE 23 2HE PHE 23 -11.558 -5.363 9.433 141 HZ PHE 23 HZ PHE 23 -10.455 -7.577 9.180 142 H ARG 24 H ARG 24 -14.910 -6.223 3.689 143 HA ARG 24 HA ARG 24 -13.486 -8.408 2.350 144 HB2 ARG 24 1HB ARG 24 -14.958 -9.796 3.783 145 HB3 ARG 24 2HB ARG 24 -13.583 -9.013 4.538 146 HG2 ARG 24 1HG ARG 24 -15.247 -8.864 6.088 147 HG3 ARG 24 2HG ARG 24 -15.246 -7.254 5.399 148 HD2 ARG 24 1HD ARG 24 -17.108 -8.195 3.795 149 HD3 ARG 24 2HD ARG 24 -17.233 -9.511 4.957 150 HE ARG 24 HE ARG 24 -18.073 -6.757 5.132 151 HH11 ARG 24 1HH1 ARG 24 -17.244 -9.536 7.197 152 HH12 ARG 24 2HH1 ARG 24 -18.184 -8.996 8.552 153 HH21 ARG 24 1HH2 ARG 24 -19.157 -5.992 6.773 154 HH22 ARG 24 2HH2 ARG 24 -19.376 -6.805 8.309 155 H SER 25 H SER 25 -15.274 -6.120 1.349 156 HA SER 25 HA SER 25 -17.350 -7.759 -0.037 157 HB2 SER 25 1HB SER 25 -17.608 -4.978 1.201 158 HB3 SER 25 2HB SER 25 -18.838 -5.799 0.238 159 HG SER 25 HG SER 25 -18.008 -6.179 2.836 160 H PHE 26 H PHE 26 -14.573 -6.030 -0.671 161 HA PHE 26 HA PHE 26 -15.698 -4.618 -3.031 162 HB2 PHE 26 1HB PHE 26 -13.536 -3.611 -1.137 163 HB3 PHE 26 2HB PHE 26 -14.065 -2.822 -2.610 164 HD1 PHE 26 2HD PHE 26 -16.266 -1.665 -2.749 165 HD2 PHE 26 1HD PHE 26 -14.934 -3.484 0.925 166 HE1 PHE 26 2HE PHE 26 -18.126 -0.584 -1.539 167 HE2 PHE 26 1HE PHE 26 -16.783 -2.350 2.131 168 HZ PHE 26 HZ PHE 26 -18.380 -0.931 0.907 169 H ILE 27 H ILE 27 -13.457 -3.969 -4.374 170 HA ILE 27 HA ILE 27 -11.843 -6.466 -4.530 171 HB ILE 27 HB ILE 27 -12.938 -4.908 -6.906 172 HG12 ILE 27 1HG1 ILE 27 -14.030 -7.341 -7.282 173 HG13 ILE 27 2HG1 ILE 27 -13.984 -7.402 -5.526 174 HG21 ILE 27 1HG2 ILE 27 -10.747 -5.999 -7.309 175 HG22 ILE 27 2HG2 ILE 27 -11.345 -7.518 -6.614 176 HG23 ILE 27 3HG2 ILE 27 -11.997 -6.919 -8.145 177 HD11 ILE 27 3HD1 ILE 27 -16.142 -6.613 -6.522 178 HD12 ILE 27 1HD1 ILE 27 -15.452 -5.422 -5.413 179 HD13 ILE 27 2HD1 ILE 27 -15.307 -5.198 -7.169 180 H LYS 28 H LYS 28 -10.325 -5.338 -3.252 181 HA LYS 28 HA LYS 28 -9.215 -2.800 -4.302 182 HB2 LYS 28 1HB LYS 28 -7.821 -2.752 -2.333 183 HB3 LYS 28 2HB LYS 28 -9.484 -3.102 -1.888 184 HG2 LYS 28 1HG LYS 28 -8.618 -5.627 -2.103 185 HG3 LYS 28 2HG LYS 28 -7.064 -4.895 -1.765 186 HD2 LYS 28 1HD LYS 28 -7.600 -4.587 0.435 187 HD3 LYS 28 2HD LYS 28 -9.214 -3.965 0.077 188 HE2 LYS 28 1HE LYS 28 -10.004 -6.281 -0.341 189 HE3 LYS 28 2HE LYS 28 -8.405 -6.906 0.043 190 HZ1 LYS 28 3HZ LYS 28 -10.436 -5.742 1.770 191 HZ2 LYS 28 1HZ LYS 28 -8.874 -5.602 2.244 192 HZ3 LYS 28 2HZ LYS 28 -9.574 -7.110 1.973 193 H SER 29 H SER 29 -6.863 -2.597 -4.677 194 HA SER 29 HA SER 29 -5.425 -5.084 -5.274 195 HB2 SER 29 1HB SER 29 -5.669 -2.945 -7.426 196 HB3 SER 29 2HB SER 29 -4.836 -4.504 -7.532 197 HG SER 29 HG SER 29 -7.065 -5.403 -7.095 198 H VAL 30 H VAL 30 -3.056 -4.687 -5.358 199 HA VAL 30 HA VAL 30 -2.134 -1.948 -4.739 200 HB VAL 30 HB VAL 30 -1.450 -4.431 -3.110 201 HG11 VAL 30 1HG1 VAL 30 -0.458 -1.563 -2.828 202 HG12 VAL 30 2HG1 VAL 30 -0.087 -2.925 -1.737 203 HG13 VAL 30 3HG1 VAL 30 0.492 -2.958 -3.395 204 HG21 VAL 30 3HG2 VAL 30 -2.356 -3.170 -1.173 205 HG22 VAL 30 1HG2 VAL 30 -2.898 -1.896 -2.267 206 HG23 VAL 30 2HG2 VAL 30 -3.605 -3.532 -2.364 207 H VAL 31 H VAL 31 -0.948 -1.612 -6.572 208 HA VAL 31 HA VAL 31 0.964 -3.627 -7.536 209 HB VAL 31 HB VAL 31 0.258 -2.092 -9.202 210 HG11 VAL 31 1HG1 VAL 31 0.564 0.372 -9.072 211 HG12 VAL 31 2HG1 VAL 31 -0.646 -0.269 -7.970 212 HG13 VAL 31 3HG1 VAL 31 0.973 0.196 -7.354 213 HG21 VAL 31 3HG2 VAL 31 2.974 -0.976 -8.397 214 HG22 VAL 31 1HG2 VAL 31 2.764 -2.529 -9.209 215 HG23 VAL 31 2HG2 VAL 31 2.267 -1.043 -10.018 216 H VAL 32 H VAL 32 3.198 -3.681 -7.002 217 HA VAL 32 HA VAL 32 4.209 -1.671 -5.135 218 HB VAL 32 HB VAL 32 4.942 -4.592 -4.798 219 HG11 VAL 32 1HG1 VAL 32 5.516 -3.772 -2.538 220 HG12 VAL 32 2HG1 VAL 32 6.369 -2.853 -3.770 221 HG13 VAL 32 3HG1 VAL 32 4.940 -2.169 -2.955 222 HG21 VAL 32 3HG2 VAL 32 2.489 -4.613 -4.410 223 HG22 VAL 32 1HG2 VAL 32 3.415 -4.875 -2.937 224 HG23 VAL 32 2HG2 VAL 32 2.695 -3.282 -3.238 225 H VAL 33 H VAL 33 6.428 -1.198 -5.560 226 HA VAL 33 HA VAL 33 7.918 -2.962 -7.385 227 HB VAL 33 HB VAL 33 7.713 0.054 -7.802 228 HG11 VAL 33 1HG1 VAL 33 9.056 -0.475 -9.874 229 HG12 VAL 33 2HG1 VAL 33 9.941 -0.704 -8.382 230 HG13 VAL 33 3HG1 VAL 33 9.299 -2.113 -9.264 231 HG21 VAL 33 3HG2 VAL 33 6.657 -2.208 -9.565 232 HG22 VAL 33 1HG2 VAL 33 5.671 -1.037 -8.676 233 HG23 VAL 33 2HG2 VAL 33 6.693 -0.491 -9.993 234 H ALA 34 H ALA 34 10.217 -2.833 -6.934 235 HA ALA 34 HA ALA 34 11.074 -0.916 -4.923 236 HB1 ALA 34 1HB ALA 34 11.454 -3.920 -4.507 237 HB2 ALA 34 2HB ALA 34 12.191 -2.635 -3.538 238 HB3 ALA 34 3HB ALA 34 10.434 -2.850 -3.524 239 H ASN 35 H ASN 35 12.283 0.113 -6.444 240 HA ASN 35 HA ASN 35 14.038 -1.314 -8.261 241 HB2 ASN 35 1HB ASN 35 13.187 0.966 -8.768 242 HB3 ASN 35 2HB ASN 35 14.134 1.604 -7.410 243 HD21 ASN 35 1HD2 ASN 35 14.621 2.747 -9.917 244 HD22 ASN 35 2HD2 ASN 35 16.123 2.108 -10.537 245 H GLY 36 H GLY 36 15.507 -2.620 -7.249 246 HA2 GLY 36 1HA GLY 36 17.857 -2.588 -6.889 247 HA3 GLY 36 2HA GLY 36 17.703 -1.119 -5.928 248 H THR 37 H THR 37 15.306 -3.461 -5.032 249 HA THR 37 HA THR 37 16.866 -4.893 -3.100 250 HB THR 37 HB THR 37 16.926 -2.644 -2.128 251 HG1 THR 37 1HG THR 37 16.840 -4.395 -0.734 252 HG21 THR 37 3HG2 THR 37 14.937 -1.596 -1.279 253 HG22 THR 37 1HG2 THR 37 13.906 -2.872 -1.970 254 HG23 THR 37 2HG2 THR 37 14.806 -1.764 -3.041 255 H GLN 38 H GLN 38 14.980 -5.811 -1.407 256 HA GLN 38 HA GLN 38 12.707 -6.765 -3.102 257 HB2 GLN 38 1HB GLN 38 14.306 -8.066 -0.892 258 HB3 GLN 38 2HB GLN 38 12.634 -8.529 -1.119 259 HG2 GLN 38 1HG GLN 38 12.955 -9.575 -3.095 260 HG3 GLN 38 2HG GLN 38 14.222 -8.502 -3.630 261 HE21 GLN 38 1HE2 GLN 38 14.888 -10.802 -4.332 262 HE22 GLN 38 2HE2 GLN 38 15.950 -11.670 -3.244 263 H LEU 39 H LEU 39 10.783 -7.226 -1.638 264 HA LEU 39 HA LEU 39 10.281 -4.990 0.228 265 HB2 LEU 39 1HB LEU 39 8.673 -6.509 -1.617 266 HB3 LEU 39 2HB LEU 39 8.227 -7.040 -0.005 267 HG LEU 39 HG LEU 39 7.862 -4.690 0.667 268 HD11 LEU 39 1HD1 LEU 39 8.340 -4.130 -2.305 269 HD12 LEU 39 2HD1 LEU 39 9.286 -3.490 -0.949 270 HD13 LEU 39 3HD1 LEU 39 7.604 -2.990 -1.175 271 HD21 LEU 39 3HD2 LEU 39 6.071 -6.241 -0.085 272 HD22 LEU 39 1HD2 LEU 39 6.287 -5.686 -1.746 273 HD23 LEU 39 2HD2 LEU 39 5.709 -4.569 -0.475 274 H LYS 40 H LYS 40 9.223 -5.677 2.275 275 HA LYS 40 HA LYS 40 9.926 -8.402 3.222 276 HB2 LYS 40 1HB LYS 40 11.573 -6.755 4.036 277 HB3 LYS 40 2HB LYS 40 10.258 -5.810 4.743 278 HG2 LYS 40 1HG LYS 40 9.652 -7.922 6.098 279 HG3 LYS 40 2HG LYS 40 11.183 -8.624 5.508 280 HD2 LYS 40 1HD LYS 40 12.428 -6.731 6.507 281 HD3 LYS 40 2HD LYS 40 10.888 -5.943 6.911 282 HE2 LYS 40 1HE LYS 40 10.487 -8.253 8.217 283 HE3 LYS 40 2HE LYS 40 12.268 -8.233 8.245 284 HZ1 LYS 40 3HZ LYS 40 11.609 -7.007 10.147 285 HZ2 LYS 40 1HZ LYS 40 10.346 -6.304 9.374 286 HZ3 LYS 40 2HZ LYS 40 11.844 -5.795 9.040 287 H ASP 41 H ASP 41 8.101 -9.353 3.744 288 HA ASP 41 HA ASP 41 5.549 -8.012 4.038 289 HB2 ASP 41 1HB ASP 41 6.069 -10.506 3.349 290 HB3 ASP 41 2HB ASP 41 6.020 -10.824 5.070 291 H GLY 42 H GLY 42 4.658 -7.156 5.962 292 HA2 GLY 42 1HA GLY 42 6.174 -7.443 8.460 293 HA3 GLY 42 2HA GLY 42 4.758 -6.427 8.196 294 H ALA 43 H ALA 43 3.661 -9.245 6.898 295 HA ALA 43 HA ALA 43 2.145 -10.063 9.193 296 HB1 ALA 43 1HB ALA 43 1.382 -10.494 6.889 297 HB2 ALA 43 2HB ALA 43 2.803 -11.518 6.583 298 HB3 ALA 43 3HB ALA 43 1.595 -12.021 7.767 299 H THR 44 H THR 44 5.036 -11.396 7.542 300 HA THR 44 HA THR 44 5.567 -13.179 9.836 301 HB THR 44 HB THR 44 6.243 -14.632 7.673 302 HG1 THR 44 1HG THR 44 5.026 -14.166 5.929 303 HG21 THR 44 3HG2 THR 44 3.381 -14.240 8.634 304 HG22 THR 44 1HG2 THR 44 4.630 -15.275 9.381 305 HG23 THR 44 2HG2 THR 44 4.022 -15.655 7.762 306 H GLY 45 H GLY 45 7.011 -10.788 7.713 307 HA2 GLY 45 1HA GLY 45 9.125 -10.062 7.595 308 HA3 GLY 45 2HA GLY 45 9.644 -11.259 8.806 309 H GLU 46 H GLU 46 8.311 -11.181 5.434 310 HA GLU 46 HA GLU 46 10.263 -13.306 4.648 311 HB2 GLU 46 1HB GLU 46 7.410 -12.920 3.616 312 HB3 GLU 46 2HB GLU 46 8.572 -14.176 3.131 313 HG2 GLU 46 1HG GLU 46 8.625 -14.903 5.557 314 HG3 GLU 46 2HG GLU 46 7.310 -13.799 5.873 315 H SER 47 H SER 47 11.323 -12.943 2.652 316 HA SER 47 HA SER 47 11.281 -10.155 1.806 317 HB2 SER 47 1HB SER 47 13.048 -11.163 0.113 318 HB3 SER 47 2HB SER 47 13.415 -10.732 1.769 319 HG SER 47 HG SER 47 13.216 -12.922 2.359 320 H LEU 48 H LEU 48 9.855 -9.471 0.340 321 HA LEU 48 HA LEU 48 8.596 -11.518 -1.411 322 HB2 LEU 48 1HB LEU 48 7.542 -8.731 -1.069 323 HB3 LEU 48 2HB LEU 48 6.747 -10.143 -1.724 324 HG LEU 48 HG LEU 48 7.544 -9.730 1.196 325 HD11 LEU 48 1HD1 LEU 48 5.600 -8.434 0.316 326 HD12 LEU 48 2HD1 LEU 48 5.174 -9.579 1.582 327 HD13 LEU 48 3HD1 LEU 48 4.821 -9.982 -0.098 328 HD21 LEU 48 3HD2 LEU 48 7.743 -12.122 0.740 329 HD22 LEU 48 1HD2 LEU 48 6.242 -12.116 -0.194 330 HD23 LEU 48 2HD2 LEU 48 6.199 -11.872 1.555 331 H ALA 49 H ALA 49 8.811 -11.571 -3.456 332 HA ALA 49 HA ALA 49 11.086 -10.157 -4.611 333 HB1 ALA 49 1HB ALA 49 9.269 -12.294 -5.830 334 HB2 ALA 49 2HB ALA 49 10.907 -11.817 -6.341 335 HB3 ALA 49 3HB ALA 49 10.656 -12.624 -4.790 336 H SER 50 H SER 50 10.113 -7.985 -4.654 337 HA SER 50 HA SER 50 7.886 -7.309 -6.264 338 HB2 SER 50 1HB SER 50 10.347 -5.926 -5.123 339 HB3 SER 50 2HB SER 50 9.120 -5.056 -6.034 340 HG SER 50 HG SER 50 8.538 -6.697 -3.796 341 HA PRO 51 HA PRO 51 7.609 -5.212 -7.641 342 HB2 PRO 51 1HB PRO 51 6.577 -4.840 -10.117 343 HB3 PRO 51 2HB PRO 51 8.067 -4.018 -9.571 344 HG2 PRO 51 1HG PRO 51 7.870 -6.523 -11.259 345 HG3 PRO 51 2HG PRO 51 8.868 -5.063 -11.551 346 HD2 PRO 51 1HD PRO 51 9.868 -7.306 -10.330 347 HD3 PRO 51 2HD PRO 51 10.412 -5.667 -9.875 348 H VAL 52 H VAL 52 5.443 -5.783 -7.183 349 HA VAL 52 HA VAL 52 4.391 -8.310 -8.208 350 HB VAL 52 HB VAL 52 5.912 -8.866 -6.390 351 HG11 VAL 52 1HG1 VAL 52 5.424 -8.292 -4.060 352 HG12 VAL 52 2HG1 VAL 52 5.791 -6.849 -5.022 353 HG13 VAL 52 3HG1 VAL 52 4.109 -7.221 -4.590 354 HG21 VAL 52 3HG2 VAL 52 4.397 -10.314 -5.157 355 HG22 VAL 52 1HG2 VAL 52 2.996 -9.299 -5.603 356 HG23 VAL 52 2HG2 VAL 52 3.872 -10.233 -6.843 357 H ILE 53 H ILE 53 2.144 -8.520 -7.932 358 HA ILE 53 HA ILE 53 0.793 -6.009 -7.144 359 HB ILE 53 HB ILE 53 -0.092 -7.840 -9.353 360 HG12 ILE 53 1HG1 ILE 53 2.036 -7.008 -10.107 361 HG13 ILE 53 2HG1 ILE 53 0.690 -6.298 -10.972 362 HG21 ILE 53 1HG2 ILE 53 -0.851 -4.999 -8.501 363 HG22 ILE 53 2HG2 ILE 53 -1.420 -5.812 -9.964 364 HG23 ILE 53 3HG2 ILE 53 -1.863 -6.448 -8.375 365 HD11 ILE 53 3HD1 ILE 53 0.937 -4.189 -9.900 366 HD12 ILE 53 1HD1 ILE 53 2.216 -4.829 -8.831 367 HD13 ILE 53 2HD1 ILE 53 2.496 -4.704 -10.561 368 H LEU 54 H LEU 54 -0.102 -6.531 -5.168 369 HA LEU 54 HA LEU 54 -1.243 -9.205 -4.644 370 HB2 LEU 54 1HB LEU 54 -1.426 -6.606 -3.075 371 HB3 LEU 54 2HB LEU 54 -2.117 -8.131 -2.579 372 HG LEU 54 HG LEU 54 0.841 -7.475 -2.834 373 HD11 LEU 54 1HD1 LEU 54 0.743 -7.856 -0.369 374 HD12 LEU 54 2HD1 LEU 54 -0.997 -8.151 -0.490 375 HD13 LEU 54 3HD1 LEU 54 -0.327 -6.546 -0.888 376 HD21 LEU 54 3HD2 LEU 54 -0.497 -10.133 -2.145 377 HD22 LEU 54 1HD2 LEU 54 1.196 -9.759 -1.820 378 HD23 LEU 54 2HD2 LEU 54 0.614 -9.814 -3.494 379 H SER 55 H SER 55 -3.317 -9.806 -5.055 380 HA SER 55 HA SER 55 -5.251 -7.891 -6.111 381 HB2 SER 55 1HB SER 55 -5.516 -10.875 -5.624 382 HB3 SER 55 2HB SER 55 -6.427 -9.844 -6.752 383 HG SER 55 HG SER 55 -4.863 -11.122 -7.761 384 H ASP 56 H ASP 56 -7.601 -8.622 -5.190 385 HA ASP 56 HA ASP 56 -7.791 -7.420 -2.732 386 HB2 ASP 56 1HB ASP 56 -9.632 -7.548 -4.375 387 HB3 ASP 56 2HB ASP 56 -9.818 -9.272 -4.053 388 H GLU 57 H GLU 57 -7.745 -10.933 -3.401 389 HA GLU 57 HA GLU 57 -8.663 -11.703 -0.764 390 HB2 GLU 57 1HB GLU 57 -7.138 -13.222 -2.922 391 HB3 GLU 57 2HB GLU 57 -7.712 -13.928 -1.405 392 HG2 GLU 57 1HG GLU 57 -10.065 -13.163 -2.188 393 HG3 GLU 57 2HG GLU 57 -9.322 -13.008 -3.790 394 H GLU 58 H GLU 58 -5.499 -11.258 -2.333 395 HA GLU 58 HA GLU 58 -3.951 -12.422 -0.263 396 HB2 GLU 58 1HB GLU 58 -2.818 -10.143 -1.814 397 HB3 GLU 58 2HB GLU 58 -2.101 -11.695 -1.419 398 HG2 GLU 58 1HG GLU 58 -4.069 -11.037 -3.641 399 HG3 GLU 58 2HG GLU 58 -2.377 -11.458 -3.819 400 H LEU 59 H LEU 59 -5.333 -9.121 -0.704 401 HA LEU 59 HA LEU 59 -4.050 -7.977 1.568 402 HB2 LEU 59 1HB LEU 59 -5.692 -7.275 -0.719 403 HB3 LEU 59 2HB LEU 59 -6.492 -6.665 0.687 404 HG LEU 59 HG LEU 59 -4.964 -5.181 -0.505 405 HD11 LEU 59 1HD1 LEU 59 -5.704 -4.688 1.794 406 HD12 LEU 59 2HD1 LEU 59 -4.081 -4.061 1.511 407 HD13 LEU 59 3HD1 LEU 59 -4.324 -5.574 2.453 408 HD21 LEU 59 3HD2 LEU 59 -2.637 -6.660 0.786 409 HD22 LEU 59 1HD2 LEU 59 -2.570 -5.210 -0.226 410 HD23 LEU 59 2HD2 LEU 59 -3.103 -6.742 -0.923 411 H ALA 60 H ALA 60 -5.764 -10.499 2.138 412 HA ALA 60 HA ALA 60 -8.030 -9.554 3.657 413 HB1 ALA 60 1HB ALA 60 -8.004 -11.723 2.561 414 HB2 ALA 60 2HB ALA 60 -6.620 -12.237 3.562 415 HB3 ALA 60 3HB ALA 60 -8.214 -11.935 4.309 416 H VAL 61 H VAL 61 -5.291 -8.472 4.579 417 HA VAL 61 HA VAL 61 -5.307 -9.479 7.382 418 HB VAL 61 HB VAL 61 -3.236 -8.185 7.654 419 HG11 VAL 61 1HG1 VAL 61 -3.219 -10.542 7.221 420 HG12 VAL 61 2HG1 VAL 61 -3.170 -10.276 5.457 421 HG13 VAL 61 3HG1 VAL 61 -1.811 -9.774 6.501 422 HG21 VAL 61 3HG2 VAL 61 -1.921 -7.428 5.722 423 HG22 VAL 61 1HG2 VAL 61 -3.283 -7.755 4.632 424 HG23 VAL 61 2HG2 VAL 61 -3.399 -6.488 5.887 425 H GLU 62 H GLU 62 -5.409 -8.018 9.151 426 HA GLU 62 HA GLU 62 -7.134 -5.721 8.649 427 HB2 GLU 62 1HB GLU 62 -7.314 -5.507 10.942 428 HB3 GLU 62 2HB GLU 62 -7.312 -7.240 10.611 429 HG2 GLU 62 1HG GLU 62 -4.824 -7.205 11.227 430 HG3 GLU 62 2HG GLU 62 -5.085 -5.546 11.766 431 H LYS 63 H LYS 63 -3.672 -6.151 9.415 432 HA LYS 63 HA LYS 63 -3.046 -3.362 8.782 433 HB2 LYS 63 1HB LYS 63 -4.131 -3.469 11.154 434 HB3 LYS 63 2HB LYS 63 -2.634 -4.210 11.691 435 HG2 LYS 63 1HG LYS 63 -2.928 -1.513 10.317 436 HG3 LYS 63 2HG LYS 63 -2.808 -1.737 12.062 437 HD2 LYS 63 1HD LYS 63 -0.479 -2.580 11.800 438 HD3 LYS 63 2HD LYS 63 -0.647 -2.421 10.051 439 HE2 LYS 63 1HE LYS 63 0.333 -0.418 10.380 440 HE3 LYS 63 2HE LYS 63 -1.341 0.074 10.625 441 HZ1 LYS 63 3HZ LYS 63 0.699 -0.520 12.691 442 HZ2 LYS 63 1HZ LYS 63 -0.883 -0.222 13.063 443 HZ3 LYS 63 2HZ LYS 63 -0.001 0.942 12.356 444 H VAL 64 H VAL 64 -1.252 -3.799 7.651 445 HA VAL 64 HA VAL 64 0.873 -5.402 8.880 446 HB VAL 64 HB VAL 64 -0.155 -6.176 6.169 447 HG11 VAL 64 1HG1 VAL 64 2.256 -6.227 6.023 448 HG12 VAL 64 2HG1 VAL 64 2.401 -6.846 7.677 449 HG13 VAL 64 3HG1 VAL 64 1.760 -7.874 6.380 450 HG21 VAL 64 3HG2 VAL 64 0.264 -7.684 8.821 451 HG22 VAL 64 1HG2 VAL 64 -1.306 -7.251 8.123 452 HG23 VAL 64 2HG2 VAL 64 -0.263 -8.418 7.307 453 H THR 65 H THR 65 2.578 -4.217 8.927 454 HA THR 65 HA THR 65 3.227 -1.876 7.389 455 HB THR 65 HB THR 65 4.841 -3.775 9.114 456 HG1 THR 65 1HG THR 65 3.917 -3.067 10.789 457 HG21 THR 65 3HG2 THR 65 6.218 -1.972 8.060 458 HG22 THR 65 1HG2 THR 65 6.259 -2.032 9.827 459 HG23 THR 65 2HG2 THR 65 5.272 -0.799 9.032 460 H LEU 66 H LEU 66 4.156 -1.840 5.297 461 HA LEU 66 HA LEU 66 5.865 -4.158 4.518 462 HB2 LEU 66 1HB LEU 66 4.057 -2.374 2.873 463 HB3 LEU 66 2HB LEU 66 5.460 -3.131 2.163 464 HG LEU 66 HG LEU 66 3.520 -4.437 1.652 465 HD11 LEU 66 1HD1 LEU 66 5.078 -5.994 3.703 466 HD12 LEU 66 2HD1 LEU 66 5.711 -5.584 2.095 467 HD13 LEU 66 3HD1 LEU 66 4.265 -6.609 2.245 468 HD21 LEU 66 3HD2 LEU 66 2.075 -3.856 3.565 469 HD22 LEU 66 1HD2 LEU 66 3.084 -4.888 4.596 470 HD23 LEU 66 2HD2 LEU 66 2.161 -5.605 3.271 471 H SER 67 H SER 67 7.914 -3.685 3.814 472 HA SER 67 HA SER 67 8.787 -0.963 3.362 473 HB2 SER 67 1HB SER 67 8.916 -1.293 5.897 474 HB3 SER 67 2HB SER 67 10.074 -2.591 5.576 475 HG SER 67 HG SER 67 11.478 -1.045 5.629 476 H THR 68 H THR 68 11.355 -1.218 2.982 477 HA THR 68 HA THR 68 11.640 -3.441 1.076 478 HB THR 68 HB THR 68 13.705 -2.185 0.469 479 HG1 THR 68 1HG THR 68 14.304 -0.488 1.485 480 HG21 THR 68 3HG2 THR 68 11.105 -0.567 0.466 481 HG22 THR 68 1HG2 THR 68 11.600 -1.782 -0.740 482 HG23 THR 68 2HG2 THR 68 12.501 -0.265 -0.558 483 H THR 69 H THR 69 13.717 -4.681 1.072 484 HA THR 69 HA THR 69 14.715 -5.283 3.768 485 HB THR 69 HB THR 69 16.233 -6.828 2.462 486 HG1 THR 69 1HG THR 69 15.971 -7.043 0.339 487 HG21 THR 69 3HG2 THR 69 14.108 -7.631 3.451 488 HG22 THR 69 1HG2 THR 69 14.432 -8.431 1.900 489 HG23 THR 69 2HG2 THR 69 13.234 -7.128 1.990 490 H GLY 70 H GLY 70 15.453 -2.956 1.282 491 HA2 GLY 70 1HA GLY 70 17.937 -2.136 2.613 492 HA3 GLY 70 2HA GLY 70 18.054 -2.871 1.014 493 H LYS 71 H LYS 71 19.086 -0.719 0.655 494 HA LYS 71 HA LYS 71 17.564 1.726 0.513 495 HB2 LYS 71 1HB LYS 71 20.157 1.369 0.527 496 HB3 LYS 71 2HB LYS 71 19.976 0.968 -1.171 497 HG2 LYS 71 1HG LYS 71 18.688 3.375 -1.148 498 HG3 LYS 71 2HG LYS 71 19.749 3.605 0.233 499 HD2 LYS 71 1HD LYS 71 21.293 4.286 -1.314 500 HD3 LYS 71 2HD LYS 71 21.513 2.568 -1.666 501 HE2 LYS 71 1HE LYS 71 19.477 2.812 -3.219 502 HE3 LYS 71 2HE LYS 71 19.715 4.581 -3.070 503 HZ1 LYS 71 3HZ LYS 71 20.744 3.199 -5.010 504 HZ2 LYS 71 1HZ LYS 71 21.892 2.763 -3.997 505 HZ3 LYS 71 2HZ LYS 71 21.655 4.392 -4.337 506 H ALA 72 H ALA 72 16.240 2.508 -1.124 507 HA ALA 72 HA ALA 72 15.927 0.852 -3.556 508 HB1 ALA 72 1HB ALA 72 14.170 0.309 -1.842 509 HB2 ALA 72 2HB ALA 72 13.665 2.002 -1.869 510 HB3 ALA 72 3HB ALA 72 13.534 1.007 -3.338 511 H ILE 73 H ILE 73 15.001 1.998 -5.353 512 HA ILE 73 HA ILE 73 14.853 4.974 -5.070 513 HB ILE 73 HB ILE 73 15.480 3.770 -7.732 514 HG12 ILE 73 1HG1 ILE 73 16.971 2.381 -6.414 515 HG13 ILE 73 2HG1 ILE 73 17.819 3.525 -7.391 516 HG21 ILE 73 1HG2 ILE 73 16.955 5.743 -7.877 517 HG22 ILE 73 2HG2 ILE 73 15.337 6.222 -7.348 518 HG23 ILE 73 3HG2 ILE 73 16.662 6.129 -6.168 519 HD11 ILE 73 3HD1 ILE 73 17.440 4.643 -4.705 520 HD12 ILE 73 1HD1 ILE 73 18.200 3.045 -4.682 521 HD13 ILE 73 2HD1 ILE 73 18.925 4.377 -5.634 522 H GLU 74 H GLU 74 12.605 2.684 -5.058 523 HA GLU 74 HA GLU 74 10.788 4.380 -6.476 524 HB2 GLU 74 1HB GLU 74 11.278 1.560 -7.507 525 HB3 GLU 74 2HB GLU 74 9.668 2.289 -7.560 526 HG2 GLU 74 1HG GLU 74 10.903 4.330 -8.653 527 HG3 GLU 74 2HG GLU 74 12.176 3.151 -8.999 528 H PHE 75 H PHE 75 8.600 3.977 -5.921 529 HA PHE 75 HA PHE 75 7.808 1.656 -4.488 530 HB2 PHE 75 1HB PHE 75 8.828 3.634 -2.775 531 HB3 PHE 75 2HB PHE 75 7.159 3.982 -2.714 532 HD1 PHE 75 2HD PHE 75 8.879 0.647 -3.005 533 HD2 PHE 75 1HD PHE 75 6.495 3.191 -0.417 534 HE1 PHE 75 2HE PHE 75 9.072 -0.996 -1.176 535 HE2 PHE 75 1HE PHE 75 6.617 1.506 1.290 536 HZ PHE 75 HZ PHE 75 7.999 -0.541 1.033 537 H ALA 76 H ALA 76 6.170 1.376 -5.889 538 HA ALA 76 HA ALA 76 4.412 3.615 -6.739 539 HB1 ALA 76 1HB ALA 76 5.405 2.057 -8.460 540 HB2 ALA 76 2HB ALA 76 4.507 0.732 -7.698 541 HB3 ALA 76 3HB ALA 76 3.627 2.079 -8.449 542 H VAL 77 H VAL 77 2.157 3.659 -6.127 543 HA VAL 77 HA VAL 77 0.999 1.264 -4.884 544 HB VAL 77 HB VAL 77 0.775 3.981 -3.518 545 HG11 VAL 77 1HG1 VAL 77 -0.012 1.179 -2.598 546 HG12 VAL 77 2HG1 VAL 77 -0.239 2.688 -1.690 547 HG13 VAL 77 3HG1 VAL 77 -1.142 2.412 -3.182 548 HG21 VAL 77 3HG2 VAL 77 2.156 3.120 -1.700 549 HG22 VAL 77 1HG2 VAL 77 2.446 1.627 -2.631 550 HG23 VAL 77 2HG2 VAL 77 3.062 3.168 -3.216 551 H SER 78 H SER 78 -0.668 0.952 -6.374 552 HA SER 78 HA SER 78 -2.648 3.103 -6.535 553 HB2 SER 78 1HB SER 78 -1.764 1.578 -9.028 554 HB3 SER 78 2HB SER 78 -3.049 2.786 -8.901 555 HG SER 78 HG SER 78 -1.457 3.871 -9.695 556 H GLY 79 H GLY 79 -4.789 2.178 -7.297 557 HA2 GLY 79 1HA GLY 79 -5.374 -0.262 -8.175 558 HA3 GLY 79 2HA GLY 79 -5.201 -0.621 -6.453 559 H GLY 80 H GLY 80 -6.408 1.025 -4.966 560 HA2 GLY 80 1HA GLY 80 -8.320 2.201 -4.375 561 HA3 GLY 80 2HA GLY 80 -8.750 2.346 -6.056 562 H VAL 81 H VAL 81 -10.812 1.876 -4.496 563 HA VAL 81 HA VAL 81 -11.709 -0.758 -5.447 564 HB VAL 81 HB VAL 81 -13.364 -0.673 -3.459 565 HG11 VAL 81 1HG1 VAL 81 -10.452 -1.336 -2.957 566 HG12 VAL 81 2HG1 VAL 81 -11.817 -1.905 -1.963 567 HG13 VAL 81 3HG1 VAL 81 -11.700 -2.396 -3.660 568 HG21 VAL 81 3HG2 VAL 81 -12.703 0.320 -1.393 569 HG22 VAL 81 1HG2 VAL 81 -11.134 0.813 -2.057 570 HG23 VAL 81 2HG2 VAL 81 -12.629 1.608 -2.611 571 H VAL 82 H VAL 82 -13.984 -0.674 -6.019 572 HA VAL 82 HA VAL 82 -15.087 2.087 -6.271 573 HB VAL 82 HB VAL 82 -14.439 1.130 -8.423 574 HG11 VAL 82 1HG1 VAL 82 -16.428 -1.103 -7.885 575 HG12 VAL 82 2HG1 VAL 82 -15.585 -0.791 -9.416 576 HG13 VAL 82 3HG1 VAL 82 -14.657 -1.250 -7.986 577 HG21 VAL 82 3HG2 VAL 82 -16.405 2.662 -8.267 578 HG22 VAL 82 1HG2 VAL 82 -16.427 1.577 -9.657 579 HG23 VAL 82 2HG2 VAL 82 -17.465 1.236 -8.271 580 H ASP 83 H ASP 83 -17.511 2.158 -6.004 581 HA ASP 83 HA ASP 83 -18.340 0.252 -3.892 582 HB2 ASP 83 1HB ASP 83 -18.246 2.865 -3.731 583 HB3 ASP 83 2HB ASP 83 -19.777 2.802 -4.610 584 H GLY 84 H GLY 84 -18.465 0.155 -7.049 585 HA2 GLY 84 1HA GLY 84 -21.114 0.588 -7.807 586 HA3 GLY 84 2HA GLY 84 -19.851 -0.111 -8.812 587 H GLU 85 H GLU 85 -20.943 -1.730 -5.857 588 HA GLU 85 HA GLU 85 -21.833 -4.140 -7.137 589 HB2 GLU 85 1HB GLU 85 -22.472 -2.888 -4.424 590 HB3 GLU 85 2HB GLU 85 -22.929 -4.515 -4.895 591 HG2 GLU 85 1HG GLU 85 -20.088 -3.482 -4.702 592 HG3 GLU 85 2HG GLU 85 -20.905 -4.414 -3.442 593 H ASP 86 H ASP 86 -23.959 -4.745 -7.552 594 HA ASP 86 HA ASP 86 -26.103 -2.793 -7.160 595 HB2 ASP 86 1HB ASP 86 -24.960 -2.160 -9.352 596 HB3 ASP 86 2HB ASP 86 -25.572 -3.677 -10.015 597 H GLY 87 H GLY 87 -27.082 -4.183 -5.852 598 HA2 GLY 87 1HA GLY 87 -28.891 -5.995 -6.169 599 HA3 GLY 87 2HA GLY 87 -27.551 -6.990 -6.748 600 H VAL 88 H VAL 88 -26.068 -5.135 -4.447 601 HA VAL 88 HA VAL 88 -27.007 -6.477 -2.049 602 HB VAL 88 HB VAL 88 -25.398 -8.036 -2.985 603 HG11 VAL 88 1HG1 VAL 88 -23.412 -5.757 -2.885 604 HG12 VAL 88 2HG1 VAL 88 -23.022 -7.463 -3.213 605 HG13 VAL 88 3HG1 VAL 88 -24.039 -6.566 -4.341 606 HG21 VAL 88 3HG2 VAL 88 -24.044 -8.453 -1.124 607 HG22 VAL 88 1HG2 VAL 88 -23.980 -6.758 -0.657 608 HG23 VAL 88 2HG2 VAL 88 -25.499 -7.681 -0.464 609 H VAL 89 H VAL 89 -25.763 -5.398 -0.112 610 HA VAL 89 HA VAL 89 -24.980 -2.617 -0.748 611 HB VAL 89 HB VAL 89 -27.227 -2.746 0.360 612 HG11 VAL 89 1HG1 VAL 89 -25.726 -3.762 2.815 613 HG12 VAL 89 2HG1 VAL 89 -27.465 -3.396 2.676 614 HG13 VAL 89 3HG1 VAL 89 -26.771 -4.768 1.791 615 HG21 VAL 89 3HG2 VAL 89 -25.801 -0.741 0.619 616 HG22 VAL 89 1HG2 VAL 89 -26.817 -1.041 2.041 617 HG23 VAL 89 2HG2 VAL 89 -25.100 -1.433 2.101 618 H ASN 90 H ASN 90 -23.307 -1.870 0.954 619 HA ASN 90 HA ASN 90 -21.911 -4.132 2.258 620 HB2 ASN 90 1HB ASN 90 -20.471 -1.923 0.728 621 HB3 ASN 90 2HB ASN 90 -19.746 -3.297 1.597 622 HD21 ASN 90 1HD2 ASN 90 -22.019 -5.060 0.126 623 HD22 ASN 90 2HD2 ASN 90 -21.235 -5.241 -1.462 624 H GLU 91 H GLU 91 -20.527 -3.216 4.087 625 HA GLU 91 HA GLU 91 -21.613 -0.698 5.144 626 HB2 GLU 91 1HB GLU 91 -20.148 -3.072 6.203 627 HB3 GLU 91 2HB GLU 91 -19.496 -1.521 6.760 628 HG2 GLU 91 1HG GLU 91 -21.988 -0.939 7.256 629 HG3 GLU 91 2HG GLU 91 -22.261 -2.670 7.132 630 HA PRO 92 HA PRO 92 -18.186 1.614 3.654 631 HB2 PRO 92 1HB PRO 92 -17.687 3.519 5.594 632 HB3 PRO 92 2HB PRO 92 -19.243 3.455 4.725 633 HG2 PRO 92 1HG PRO 92 -18.630 2.239 7.421 634 HG3 PRO 92 2HG PRO 92 -19.977 3.342 6.981 635 HD2 PRO 92 1HD PRO 92 -20.288 0.646 7.016 636 HD3 PRO 92 2HD PRO 92 -21.094 1.649 5.767 637 H MET 93 H MET 93 -15.877 2.369 4.083 638 HA MET 93 HA MET 93 -14.498 0.956 6.198 639 HB2 MET 93 1HB MET 93 -13.096 -0.379 4.833 640 HB3 MET 93 2HB MET 93 -14.729 -0.728 4.338 641 HG2 MET 93 1HG MET 93 -14.098 -0.358 2.235 642 HG3 MET 93 2HG MET 93 -14.002 1.341 2.601 643 HE1 MET 93 3HE MET 93 -10.492 -1.672 2.506 644 HE2 MET 93 1HE MET 93 -11.359 -1.441 4.040 645 HE3 MET 93 2HE MET 93 -12.226 -2.024 2.595 646 H GLN 94 H GLN 94 -12.034 1.331 5.861 647 HA GLN 94 HA GLN 94 -11.412 3.905 4.589 648 HB2 GLN 94 1HB GLN 94 -11.093 3.238 7.542 649 HB3 GLN 94 2HB GLN 94 -9.939 4.311 6.738 650 HG2 GLN 94 1HG GLN 94 -11.684 5.807 6.018 651 HG3 GLN 94 2HG GLN 94 -12.952 4.737 6.643 652 HE21 GLN 94 1HE2 GLN 94 -13.754 5.234 8.633 653 HE22 GLN 94 2HE2 GLN 94 -12.991 6.376 9.724 654 H TRP 95 H TRP 95 -9.199 4.141 4.182 655 HA TRP 95 HA TRP 95 -7.491 1.737 4.342 656 HB2 TRP 95 1HB TRP 95 -8.898 2.614 1.972 657 HB3 TRP 95 2HB TRP 95 -7.197 2.938 1.755 658 HD1 TRP 95 HD TRP 95 -8.814 -0.174 3.422 659 HE1 TRP 95 1HE TRP 95 -8.028 -2.268 2.151 660 HE3 TRP 95 3HE TRP 95 -5.964 2.088 -0.158 661 HZ2 TRP 95 2HZ TRP 95 -6.364 -2.866 -0.149 662 HZ3 TRP 95 3HZ TRP 95 -4.821 0.720 -1.899 663 HH2 TRP 95 HH TRP 95 -5.093 -1.734 -1.928 664 H VAL 96 H VAL 96 -6.229 2.766 5.829 665 HA VAL 96 HA VAL 96 -4.978 5.350 5.129 666 HB VAL 96 HB VAL 96 -4.276 3.535 7.448 667 HG11 VAL 96 1HG1 VAL 96 -3.449 5.588 8.457 668 HG12 VAL 96 2HG1 VAL 96 -2.733 5.397 6.860 669 HG13 VAL 96 3HG1 VAL 96 -4.073 6.543 7.090 670 HG21 VAL 96 3HG2 VAL 96 -5.811 4.918 8.864 671 HG22 VAL 96 1HG2 VAL 96 -6.462 5.651 7.384 672 HG23 VAL 96 2HG2 VAL 96 -6.685 3.923 7.703 673 H VAL 97 H VAL 97 -2.921 5.335 4.061 674 HA VAL 97 HA VAL 97 -1.349 2.886 4.015 675 HB VAL 97 HB VAL 97 -1.068 3.415 1.571 676 HG11 VAL 97 1HG1 VAL 97 -3.827 2.406 2.272 677 HG12 VAL 97 2HG1 VAL 97 -2.911 2.085 0.784 678 HG13 VAL 97 3HG1 VAL 97 -2.318 1.470 2.340 679 HG21 VAL 97 3HG2 VAL 97 -2.220 5.676 1.613 680 HG22 VAL 97 1HG2 VAL 97 -2.732 4.595 0.325 681 HG23 VAL 97 2HG2 VAL 97 -3.761 4.798 1.762 682 H THR 98 H THR 98 -0.530 4.666 5.742 683 HA THR 98 HA THR 98 0.681 7.094 4.649 684 HB THR 98 HB THR 98 1.410 5.574 7.169 685 HG1 THR 98 1HG THR 98 -0.502 6.073 7.825 686 HG21 THR 98 3HG2 THR 98 3.007 7.306 6.854 687 HG22 THR 98 1HG2 THR 98 1.871 7.948 8.040 688 HG23 THR 98 2HG2 THR 98 1.792 8.474 6.341 689 H VAL 99 H VAL 99 2.885 7.371 3.912 690 HA VAL 99 HA VAL 99 4.475 4.911 3.890 691 HB VAL 99 HB VAL 99 5.798 6.263 2.196 692 HG11 VAL 99 1HG1 VAL 99 4.199 5.689 0.306 693 HG12 VAL 99 2HG1 VAL 99 4.370 4.391 1.494 694 HG13 VAL 99 3HG1 VAL 99 2.920 5.441 1.516 695 HG21 VAL 99 3HG2 VAL 99 3.315 7.877 1.898 696 HG22 VAL 99 1HG2 VAL 99 4.759 8.385 2.839 697 HG23 VAL 99 2HG2 VAL 99 4.940 8.067 1.117 698 H TYR 100 H TYR 100 6.577 5.141 4.254 699 HA TYR 100 HA TYR 100 7.632 7.455 5.718 700 HB2 TYR 100 1HB TYR 100 7.878 4.611 6.688 701 HB3 TYR 100 2HB TYR 100 8.851 5.940 7.287 702 HD1 TYR 100 1HD TYR 100 7.625 7.944 8.431 703 HD2 TYR 100 2HD TYR 100 5.621 4.259 7.348 704 HE1 TYR 100 1HE TYR 100 5.776 8.503 9.940 705 HE2 TYR 100 2HE TYR 100 3.760 4.837 8.834 706 HH TYR 100 HH TYR 100 3.607 7.937 10.598 707 H LYS 101 H LYS 101 10.041 7.164 5.782 708 HA LYS 101 HA LYS 101 11.201 6.210 3.268 709 HB2 LYS 101 1HB LYS 101 10.652 8.673 3.632 710 HB3 LYS 101 2HB LYS 101 11.843 8.713 4.931 711 HG2 LYS 101 1HG LYS 101 13.639 8.610 3.430 712 HG3 LYS 101 2HG LYS 101 12.662 7.706 2.239 713 HD2 LYS 101 1HD LYS 101 11.654 9.590 1.378 714 HD3 LYS 101 2HD LYS 101 11.813 10.495 2.889 715 HE2 LYS 101 1HE LYS 101 14.328 10.635 2.347 716 HE3 LYS 101 2HE LYS 101 13.875 10.141 0.700 717 HZ1 LYS 101 3HZ LYS 101 12.413 12.129 0.624 718 HZ2 LYS 101 1HZ LYS 101 13.926 12.609 1.061 719 HZ3 LYS 101 2HZ LYS 101 12.768 12.476 2.168 720 H ASN 102 H ASN 102 13.877 6.736 4.182 721 HA ASN 102 HA ASN 102 14.340 4.694 6.204 722 HB2 ASN 102 1HB ASN 102 16.572 4.961 6.070 723 HB3 ASN 102 2HB ASN 102 16.008 5.143 4.437 724 HD21 ASN 102 1HD2 ASN 102 15.766 7.654 3.760 725 HD22 ASN 102 2HD2 ASN 102 17.185 8.575 4.271 726 H GLY 103 H GLY 103 12.725 5.690 7.715 727 HA2 GLY 103 1HA GLY 103 12.337 6.536 9.807 728 HA3 GLY 103 2HA GLY 103 13.974 7.167 9.866 729 H LYS 104 H LYS 104 11.534 8.085 7.375 730 HA LYS 104 HA LYS 104 10.774 10.440 8.857 731 HB2 LYS 104 1HB LYS 104 11.485 11.028 5.994 732 HB3 LYS 104 2HB LYS 104 11.088 12.116 7.299 733 HG2 LYS 104 1HG LYS 104 13.310 12.547 7.093 734 HG3 LYS 104 2HG LYS 104 13.371 11.337 8.372 735 HD2 LYS 104 1HD LYS 104 13.872 9.591 6.669 736 HD3 LYS 104 2HD LYS 104 13.618 10.770 5.392 737 HE2 LYS 104 1HE LYS 104 15.992 10.393 5.652 738 HE3 LYS 104 2HE LYS 104 15.607 12.047 6.125 739 HZ1 LYS 104 3HZ LYS 104 17.179 10.863 7.558 740 HZ2 LYS 104 1HZ LYS 104 16.034 9.838 8.069 741 HZ3 LYS 104 2HZ LYS 104 15.894 11.432 8.414 742 H GLU 105 H GLU 105 9.061 11.542 7.318 743 HA GLU 105 HA GLU 105 7.371 9.539 5.887 744 HB2 GLU 105 1HB GLU 105 6.295 10.058 8.055 745 HB3 GLU 105 2HB GLU 105 6.429 11.774 7.712 746 HG2 GLU 105 1HG GLU 105 4.956 11.068 5.550 747 HG3 GLU 105 2HG GLU 105 4.528 9.728 6.607 748 H ILE 106 H ILE 106 6.797 10.287 3.844 749 HA ILE 106 HA ILE 106 7.335 13.124 3.162 750 HB ILE 106 HB ILE 106 7.873 12.481 0.980 751 HG12 ILE 106 1HG1 ILE 106 6.569 9.883 1.555 752 HG13 ILE 106 2HG1 ILE 106 6.547 10.881 0.129 753 HG21 ILE 106 1HG2 ILE 106 9.306 10.531 2.805 754 HG22 ILE 106 2HG2 ILE 106 9.914 11.294 1.312 755 HG23 ILE 106 3HG2 ILE 106 9.604 12.284 2.732 756 HD11 ILE 106 3HD1 ILE 106 8.818 9.029 0.967 757 HD12 ILE 106 1HD1 ILE 106 7.649 8.752 -0.306 758 HD13 ILE 106 2HD1 ILE 106 8.816 10.066 -0.482 759 H GLU 107 H GLU 107 4.812 10.561 3.209 760 HA GLU 107 HA GLU 107 2.909 12.572 2.218 761 HB2 GLU 107 1HB GLU 107 4.094 10.846 0.394 762 HB3 GLU 107 2HB GLU 107 2.736 9.872 0.930 763 HG2 GLU 107 1HG GLU 107 2.184 11.086 -1.099 764 HG3 GLU 107 2HG GLU 107 1.175 11.635 0.230 765 H LYS 108 H LYS 108 0.776 12.155 2.993 766 HA LYS 108 HA LYS 108 0.443 9.780 4.761 767 HB2 LYS 108 1HB LYS 108 1.353 11.896 5.904 768 HB3 LYS 108 2HB LYS 108 -0.260 12.583 5.675 769 HG2 LYS 108 1HG LYS 108 -1.210 10.680 7.012 770 HG3 LYS 108 2HG LYS 108 0.406 9.984 7.126 771 HD2 LYS 108 1HD LYS 108 1.045 12.308 8.198 772 HD3 LYS 108 2HD LYS 108 -0.692 12.445 8.487 773 HE2 LYS 108 1HE LYS 108 -0.627 10.248 9.688 774 HE3 LYS 108 2HE LYS 108 1.102 10.108 9.313 775 HZ1 LYS 108 3HZ LYS 108 1.523 12.034 10.669 776 HZ2 LYS 108 1HZ LYS 108 0.709 10.923 11.568 777 HZ3 LYS 108 2HZ LYS 108 -0.079 12.232 10.997 778 H LYS 109 H LYS 109 -0.626 9.897 2.256 779 HA LYS 109 HA LYS 109 -3.308 11.011 2.272 780 HB2 LYS 109 1HB LYS 109 -1.831 10.493 0.208 781 HB3 LYS 109 2HB LYS 109 -2.263 8.790 0.471 782 HG2 LYS 109 1HG LYS 109 -4.722 9.604 0.425 783 HG3 LYS 109 2HG LYS 109 -4.104 11.148 -0.122 784 HD2 LYS 109 1HD LYS 109 -3.286 8.650 -1.621 785 HD3 LYS 109 2HD LYS 109 -4.948 9.168 -1.751 786 HE2 LYS 109 1HE LYS 109 -2.533 10.848 -2.526 787 HE3 LYS 109 2HE LYS 109 -3.647 9.975 -3.602 788 HZ1 LYS 109 3HZ LYS 109 -4.434 12.132 -3.583 789 HZ2 LYS 109 1HZ LYS 109 -4.261 12.341 -1.951 790 HZ3 LYS 109 2HZ LYS 109 -5.441 11.361 -2.551 791 H SER 110 H SER 110 -5.227 9.967 2.710 792 HA SER 110 HA SER 110 -5.306 7.093 3.291 793 HB2 SER 110 1HB SER 110 -5.046 8.147 5.507 794 HB3 SER 110 2HB SER 110 -6.398 9.243 5.163 795 HG SER 110 HG SER 110 -7.202 7.505 6.353 796 H LEU 111 H LEU 111 -7.626 6.371 3.165 797 HA LEU 111 HA LEU 111 -9.280 8.053 1.335 798 HB2 LEU 111 1HB LEU 111 -8.954 5.055 1.115 799 HB3 LEU 111 2HB LEU 111 -9.804 6.124 0.012 800 HG LEU 111 HG LEU 111 -6.790 5.997 0.453 801 HD11 LEU 111 1HD1 LEU 111 -8.349 5.209 -2.018 802 HD12 LEU 111 2HD1 LEU 111 -7.832 4.052 -0.750 803 HD13 LEU 111 3HD1 LEU 111 -6.645 4.964 -1.696 804 HD21 LEU 111 3HD2 LEU 111 -6.537 7.436 -1.521 805 HD22 LEU 111 1HD2 LEU 111 -7.469 8.302 -0.287 806 HD23 LEU 111 2HD2 LEU 111 -8.269 7.567 -1.697 807 H VAL 112 H VAL 112 -11.534 7.820 1.664 808 HA VAL 112 HA VAL 112 -12.450 6.232 3.996 809 HB VAL 112 HB VAL 112 -12.989 9.182 3.432 810 HG11 VAL 112 1HG1 VAL 112 -14.984 8.104 4.393 811 HG12 VAL 112 2HG1 VAL 112 -14.008 7.423 5.710 812 HG13 VAL 112 3HG1 VAL 112 -14.234 9.181 5.571 813 HG21 VAL 112 3HG2 VAL 112 -11.464 7.998 5.788 814 HG22 VAL 112 1HG2 VAL 112 -10.755 8.915 4.449 815 HG23 VAL 112 2HG2 VAL 112 -11.883 9.703 5.548 816 H PHE 113 H PHE 113 -14.278 5.078 3.433 817 HA PHE 113 HA PHE 113 -15.888 6.049 1.132 818 HB2 PHE 113 1HB PHE 113 -14.937 3.291 1.941 819 HB3 PHE 113 2HB PHE 113 -16.418 3.517 1.055 820 HD1 PHE 113 2HD PHE 113 -12.807 4.589 0.843 821 HD2 PHE 113 1HD PHE 113 -16.371 3.398 -1.297 822 HE1 PHE 113 2HE PHE 113 -11.595 4.746 -1.296 823 HE2 PHE 113 1HE PHE 113 -15.144 3.563 -3.426 824 HZ PHE 113 HZ PHE 113 -12.763 4.236 -3.452 825 H ARG 114 H ARG 114 -18.220 5.179 1.329 826 HA ARG 114 HA ARG 114 -19.135 5.515 4.160 827 HB2 ARG 114 1HB ARG 114 -20.378 7.004 1.848 828 HB3 ARG 114 2HB ARG 114 -20.645 7.187 3.590 829 HG2 ARG 114 1HG ARG 114 -18.102 7.818 3.666 830 HG3 ARG 114 2HG ARG 114 -18.310 8.152 1.940 831 HD2 ARG 114 1HD ARG 114 -20.451 9.456 2.713 832 HD3 ARG 114 2HD ARG 114 -19.723 9.390 4.324 833 HE ARG 114 HE ARG 114 -19.098 11.158 2.180 834 HH11 ARG 114 1HH1 ARG 114 -17.580 9.491 4.927 835 HH12 ARG 114 2HH1 ARG 114 -16.295 10.628 5.076 836 HH21 ARG 114 1HH2 ARG 114 -17.210 12.498 2.196 837 HH22 ARG 114 2HH2 ARG 114 -16.147 12.387 3.578 838 H ASP 115 H ASP 115 -19.388 3.567 1.486 839 HA ASP 115 HA ASP 115 -20.909 2.367 0.380 840 HB2 ASP 115 1HB ASP 115 -22.062 1.131 1.767 841 HB3 ASP 115 2HB ASP 115 -22.092 2.348 3.022 842 H GLY 116 H GLY 116 -21.974 2.896 -1.415 843 HA2 GLY 116 1HA GLY 116 -23.251 4.036 -2.893 844 HA3 GLY 116 2HA GLY 116 -24.026 4.863 -1.530 845 H LYS 117 H LYS 117 -20.835 4.926 -3.242 846 HA LYS 117 HA LYS 117 -20.909 7.913 -3.067 847 HB2 LYS 117 1HB LYS 117 -18.696 6.032 -2.235 848 HB3 LYS 117 2HB LYS 117 -18.355 7.696 -2.663 849 HG2 LYS 117 1HG LYS 117 -20.466 7.012 -0.571 850 HG3 LYS 117 2HG LYS 117 -18.773 7.136 -0.147 851 HD2 LYS 117 1HD LYS 117 -20.251 9.394 -1.559 852 HD3 LYS 117 2HD LYS 117 -20.192 9.244 0.200 853 HE2 LYS 117 1HE LYS 117 -17.812 9.483 0.271 854 HE3 LYS 117 2HE LYS 117 -17.646 9.202 -1.459 855 HZ1 LYS 117 3HZ LYS 117 -18.627 11.279 -1.920 856 HZ2 LYS 117 1HZ LYS 117 -17.382 11.491 -0.869 857 HZ3 LYS 117 2HZ LYS 117 -18.929 11.598 -0.315 858 H GLU 118 H GLU 118 -20.168 9.062 -4.680 859 HA GLU 118 HA GLU 118 -19.668 7.826 -7.269 860 HB2 GLU 118 1HB GLU 118 -19.702 10.744 -6.329 861 HB3 GLU 118 2HB GLU 118 -19.595 10.229 -8.012 862 HG2 GLU 118 1HG GLU 118 -21.832 9.368 -7.995 863 HG3 GLU 118 2HG GLU 118 -21.949 9.501 -6.242 864 H ILE 119 H ILE 119 -17.677 7.044 -7.709 865 HA ILE 119 HA ILE 119 -15.266 8.653 -7.145 866 HB ILE 119 HB ILE 119 -14.031 6.845 -6.405 867 HG12 ILE 119 1HG1 ILE 119 -15.686 4.590 -6.099 868 HG13 ILE 119 2HG1 ILE 119 -16.086 5.158 -7.701 869 HG21 ILE 119 1HG2 ILE 119 -15.541 7.832 -4.671 870 HG22 ILE 119 2HG2 ILE 119 -16.656 6.475 -4.922 871 HG23 ILE 119 3HG2 ILE 119 -15.011 6.179 -4.336 872 HD11 ILE 119 3HD1 ILE 119 -13.709 5.153 -8.353 873 HD12 ILE 119 1HD1 ILE 119 -13.244 4.646 -6.719 874 HD13 ILE 119 2HD1 ILE 119 -14.190 3.561 -7.764 875 H SER 120 H SER 120 -13.378 7.739 -8.550 876 HA SER 120 HA SER 120 -14.182 6.293 -10.871 877 HB2 SER 120 1HB SER 120 -14.611 8.848 -11.350 878 HB3 SER 120 2HB SER 120 -12.852 8.941 -11.477 879 HG SER 120 HG SER 120 -14.669 7.324 -12.950 880 H THR 121 H THR 121 -11.982 6.316 -12.326 881 HA THR 121 HA THR 121 -10.402 4.561 -10.801 882 HB THR 121 HB THR 121 -9.341 4.184 -13.064 883 HG1 THR 121 1HG THR 121 -10.342 5.209 -14.795 884 HG21 THR 121 3HG2 THR 121 -12.400 4.249 -13.041 885 HG22 THR 121 1HG2 THR 121 -11.377 2.972 -12.348 886 HG23 THR 121 2HG2 THR 121 -11.363 3.264 -14.087 887 H ASP 122 H ASP 122 -9.887 7.128 -9.676 888 HA ASP 122 HA ASP 122 -6.930 7.107 -9.884 889 HB2 ASP 122 1HB ASP 122 -8.595 9.648 -9.897 890 HB3 ASP 122 2HB ASP 122 -6.856 9.585 -9.640 891 H ASP 123 H ASP 123 -9.145 6.076 -8.073 892 HA ASP 123 HA ASP 123 -9.323 7.453 -5.615 893 HB2 ASP 123 1HB ASP 123 -10.314 5.036 -6.528 894 HB3 ASP 123 2HB ASP 123 -9.066 4.511 -5.375 895 H LEU 124 H LEU 124 -6.736 5.303 -6.774 896 HA LEU 124 HA LEU 124 -4.974 6.465 -4.777 897 HB2 LEU 124 1HB LEU 124 -6.004 3.919 -4.217 898 HB3 LEU 124 2HB LEU 124 -4.500 3.536 -5.019 899 HG LEU 124 HG LEU 124 -4.753 5.451 -2.655 900 HD11 LEU 124 1HD1 LEU 124 -3.783 3.624 -1.345 901 HD12 LEU 124 2HD1 LEU 124 -3.664 2.607 -2.792 902 HD13 LEU 124 3HD1 LEU 124 -5.255 3.062 -2.147 903 HD21 LEU 124 3HD2 LEU 124 -2.290 5.251 -2.496 904 HD22 LEU 124 1HD2 LEU 124 -2.789 6.038 -3.992 905 HD23 LEU 124 2HD2 LEU 124 -2.280 4.339 -4.017 906 H ASN 125 H ASN 125 -3.524 7.312 -6.104 907 HA ASN 125 HA ASN 125 -2.374 5.726 -8.319 908 HB2 ASN 125 1HB ASN 125 -4.397 7.102 -9.096 909 HB3 ASN 125 2HB ASN 125 -3.469 8.552 -8.735 910 HD21 ASN 125 1HD2 ASN 125 -1.026 8.319 -9.755 911 HD22 ASN 125 2HD2 ASN 125 -1.039 7.754 -11.427 912 H LEU 126 H LEU 126 -0.721 5.684 -6.527 913 HA LEU 126 HA LEU 126 0.783 8.223 -6.114 914 HB2 LEU 126 1HB LEU 126 -0.211 6.147 -4.279 915 HB3 LEU 126 2HB LEU 126 1.538 6.161 -4.285 916 HG LEU 126 HG LEU 126 1.572 8.559 -3.710 917 HD11 LEU 126 1HD1 LEU 126 -1.458 8.194 -3.533 918 HD12 LEU 126 2HD1 LEU 126 -0.563 9.276 -4.622 919 HD13 LEU 126 3HD1 LEU 126 -0.551 9.581 -2.879 920 HD21 LEU 126 3HD2 LEU 126 1.659 6.785 -1.973 921 HD22 LEU 126 1HD2 LEU 126 -0.112 6.808 -1.844 922 HD23 LEU 126 2HD2 LEU 126 0.848 8.237 -1.379 923 H TYR 127 H TYR 127 3.006 8.117 -6.565 924 HA TYR 127 HA TYR 127 4.309 5.606 -6.950 925 HB2 TYR 127 1HB TYR 127 3.492 5.630 -9.199 926 HB3 TYR 127 2HB TYR 127 3.754 7.353 -9.365 927 HD1 TYR 127 1HD TYR 127 6.002 8.277 -9.789 928 HD2 TYR 127 2HD TYR 127 5.344 4.034 -9.474 929 HE1 TYR 127 1HE TYR 127 8.218 7.858 -10.824 930 HE2 TYR 127 2HE TYR 127 7.557 3.614 -10.483 931 HH TYR 127 HH TYR 127 9.615 4.633 -11.267 932 H TYR 128 H TYR 128 6.399 5.839 -6.307 933 HA TYR 128 HA TYR 128 7.610 8.553 -6.371 934 HB2 TYR 128 1HB TYR 128 8.194 6.276 -4.448 935 HB3 TYR 128 2HB TYR 128 8.930 7.848 -4.396 936 HD1 TYR 128 2HD TYR 128 6.075 9.364 -4.851 937 HD2 TYR 128 1HD TYR 128 7.588 6.347 -2.155 938 HE1 TYR 128 2HE TYR 128 4.136 9.726 -3.352 939 HE2 TYR 128 1HE TYR 128 5.752 6.797 -0.620 940 HH TYR 128 HH TYR 128 3.688 7.867 -0.351 941 H ASN 129 H ASN 129 9.736 8.624 -6.962 942 HA ASN 129 HA ASN 129 11.212 6.180 -7.187 943 HB2 ASN 129 1HB ASN 129 12.476 6.590 -9.073 944 HB3 ASN 129 2HB ASN 129 10.807 6.693 -9.597 945 HD21 ASN 129 1HD2 ASN 129 9.974 9.086 -9.551 946 HD22 ASN 129 2HD2 ASN 129 11.072 10.251 -10.283 Start of MODEL 9 1 H1 GLY 1 H GLY 1 29.386 -4.141 8.597 2 HA2 GLY 1 1HA GLY 1 31.402 -2.252 9.692 3 HA3 GLY 1 2HA GLY 1 31.605 -3.180 8.187 4 H ASP 2 H ASP 2 30.485 -2.607 6.395 5 HA ASP 2 HA ASP 2 29.304 -1.533 4.872 6 HB2 ASP 2 1HB ASP 2 27.492 -1.223 6.865 7 HB3 ASP 2 2HB ASP 2 27.924 0.454 6.607 8 H ASP 3 H ASP 3 31.322 -1.096 4.344 9 HA ASP 3 HA ASP 3 32.857 0.492 6.189 10 HB2 ASP 3 1HB ASP 3 33.611 -1.578 4.086 11 HB3 ASP 3 2HB ASP 3 34.660 -0.953 5.368 12 H ASP 4 H ASP 4 31.740 2.222 5.087 13 HA ASP 4 HA ASP 4 31.317 3.956 3.811 14 HB2 ASP 4 1HB ASP 4 33.769 4.487 3.598 15 HB3 ASP 4 2HB ASP 4 33.745 3.595 2.067 16 H GLU 5 H GLU 5 31.148 4.194 1.055 17 HA GLU 5 HA GLU 5 29.995 1.862 -0.125 18 HB2 GLU 5 1HB GLU 5 27.606 2.554 0.216 19 HB3 GLU 5 2HB GLU 5 28.375 1.831 1.601 20 HG2 GLU 5 1HG GLU 5 28.616 3.917 2.765 21 HG3 GLU 5 2HG GLU 5 28.195 4.863 1.342 22 HA PRO 6 HA PRO 6 30.659 5.886 -2.409 23 HB2 PRO 6 1HB PRO 6 32.694 5.211 -4.104 24 HB3 PRO 6 2HB PRO 6 32.967 5.562 -2.371 25 HG2 PRO 6 1HG PRO 6 32.602 2.836 -3.677 26 HG3 PRO 6 2HG PRO 6 33.929 3.371 -2.591 27 HD2 PRO 6 1HD PRO 6 31.757 2.026 -1.641 28 HD3 PRO 6 2HD PRO 6 32.533 3.336 -0.703 29 H GLY 7 H GLY 7 30.608 6.354 -4.857 30 HA2 GLY 7 1HA GLY 7 30.242 5.624 -7.099 31 HA3 GLY 7 2HA GLY 7 29.330 4.227 -6.506 32 H GLY 8 H GLY 8 27.355 4.869 -5.083 33 HA2 GLY 8 1HA GLY 8 26.187 7.405 -5.154 34 HA3 GLY 8 2HA GLY 8 25.462 6.444 -6.462 35 H LYS 9 H LYS 9 23.680 7.108 -4.458 36 HA LYS 9 HA LYS 9 23.422 4.731 -2.845 37 HB2 LYS 9 1HB LYS 9 24.732 6.485 -1.559 38 HB3 LYS 9 2HB LYS 9 23.304 7.528 -1.652 39 HG2 LYS 9 1HG LYS 9 22.033 6.006 -0.285 40 HG3 LYS 9 2HG LYS 9 23.249 4.740 -0.434 41 HD2 LYS 9 1HD LYS 9 24.848 6.170 0.854 42 HD3 LYS 9 2HD LYS 9 23.534 7.346 1.104 43 HE2 LYS 9 1HE LYS 9 22.161 5.612 2.195 44 HE3 LYS 9 2HE LYS 9 23.388 4.382 1.852 45 HZ1 LYS 9 3HZ LYS 9 23.436 5.246 4.143 46 HZ2 LYS 9 1HZ LYS 9 23.889 6.718 3.596 47 HZ3 LYS 9 2HZ LYS 9 24.858 5.376 3.356 48 H GLY 10 H GLY 10 21.441 4.507 -2.064 49 HA2 GLY 10 1HA GLY 10 19.147 6.064 -3.153 50 HA3 GLY 10 2HA GLY 10 19.130 4.295 -3.271 51 H ALA 11 H ALA 11 17.704 3.606 -1.706 52 HA ALA 11 HA ALA 11 17.979 4.483 1.088 53 HB1 ALA 11 1HB ALA 11 15.550 5.274 1.131 54 HB2 ALA 11 2HB ALA 11 16.691 6.348 0.298 55 HB3 ALA 11 3HB ALA 11 15.606 5.300 -0.637 56 H MET 12 H MET 12 15.722 3.531 2.209 57 HA MET 12 HA MET 12 15.184 0.827 1.168 58 HB2 MET 12 1HB MET 12 14.888 1.705 4.089 59 HB3 MET 12 2HB MET 12 14.500 0.152 3.390 60 HG2 MET 12 1HG MET 12 17.104 0.262 2.728 61 HG3 MET 12 2HG MET 12 17.154 1.310 4.123 62 HE1 MET 12 3HE MET 12 16.772 -2.380 2.815 63 HE2 MET 12 1HE MET 12 15.994 -3.203 4.177 64 HE3 MET 12 2HE MET 12 15.087 -2.010 3.227 65 H TYR 13 H TYR 13 12.880 0.351 1.353 66 HA TYR 13 HA TYR 13 11.126 2.615 2.048 67 HB2 TYR 13 1HB TYR 13 11.209 1.059 -0.566 68 HB3 TYR 13 2HB TYR 13 9.744 1.812 -0.001 69 HD1 TYR 13 2HD TYR 13 10.850 4.421 1.161 70 HD2 TYR 13 1HD TYR 13 11.514 2.361 -2.579 71 HE1 TYR 13 2HE TYR 13 11.447 6.537 0.121 72 HE2 TYR 13 1HE TYR 13 12.133 4.533 -3.656 73 HH TYR 13 HH TYR 13 12.555 6.945 -3.201 74 H GLU 14 H GLU 14 9.369 2.131 3.088 75 HA GLU 14 HA GLU 14 8.308 -0.595 3.231 76 HB2 GLU 14 1HB GLU 14 9.659 -0.307 5.249 77 HB3 GLU 14 2HB GLU 14 8.926 1.256 5.563 78 HG2 GLU 14 1HG GLU 14 6.766 0.219 6.055 79 HG3 GLU 14 2HG GLU 14 7.384 -1.366 5.564 80 H VAL 15 H VAL 15 6.151 -0.559 2.922 81 HA VAL 15 HA VAL 15 4.602 1.970 3.231 82 HB VAL 15 HB VAL 15 4.620 1.232 0.901 83 HG11 VAL 15 1HG1 VAL 15 3.542 -1.463 1.851 84 HG12 VAL 15 2HG1 VAL 15 3.701 -0.934 0.164 85 HG13 VAL 15 3HG1 VAL 15 5.143 -1.185 1.153 86 HG21 VAL 15 3HG2 VAL 15 1.913 0.517 2.083 87 HG22 VAL 15 1HG2 VAL 15 2.505 2.172 1.785 88 HG23 VAL 15 2HG2 VAL 15 2.257 1.041 0.446 89 H THR 16 H THR 16 2.493 1.712 4.129 90 HA THR 16 HA THR 16 1.824 -0.784 5.459 91 HB THR 16 HB THR 16 1.123 1.002 7.410 92 HG1 THR 16 1HG THR 16 2.751 2.423 5.999 93 HG21 THR 16 3HG2 THR 16 3.070 0.255 8.716 94 HG22 THR 16 1HG2 THR 16 3.879 -0.277 7.224 95 HG23 THR 16 2HG2 THR 16 2.388 -1.081 7.770 96 H ILE 17 H ILE 17 -0.347 -1.020 5.474 97 HA ILE 17 HA ILE 17 -1.992 1.204 4.402 98 HB ILE 17 HB ILE 17 -1.540 -0.121 2.528 99 HG12 ILE 17 1HG1 ILE 17 -3.678 -1.247 1.940 100 HG13 ILE 17 2HG1 ILE 17 -4.124 -1.316 3.637 101 HG21 ILE 17 1HG2 ILE 17 -2.047 -2.695 3.978 102 HG22 ILE 17 2HG2 ILE 17 -1.684 -2.506 2.259 103 HG23 ILE 17 3HG2 ILE 17 -0.458 -2.085 3.448 104 HD11 ILE 17 3HD1 ILE 17 -3.988 1.308 3.562 105 HD12 ILE 17 1HD1 ILE 17 -3.981 1.068 1.807 106 HD13 ILE 17 2HD1 ILE 17 -5.335 0.476 2.790 107 H GLU 18 H GLU 18 -3.052 1.709 6.320 108 HA GLU 18 HA GLU 18 -4.352 -0.519 7.798 109 HB2 GLU 18 1HB GLU 18 -4.114 2.468 8.281 110 HB3 GLU 18 2HB GLU 18 -5.468 1.531 8.922 111 HG2 GLU 18 1HG GLU 18 -3.235 0.029 9.674 112 HG3 GLU 18 2HG GLU 18 -2.676 1.676 9.838 113 H GLN 19 H GLN 19 -6.533 -0.861 7.495 114 HA GLN 19 HA GLN 19 -7.962 0.725 5.440 115 HB2 GLN 19 1HB GLN 19 -8.104 -2.252 6.151 116 HB3 GLN 19 2HB GLN 19 -9.200 -1.424 5.104 117 HG2 GLN 19 1HG GLN 19 -7.103 -0.767 3.676 118 HG3 GLN 19 2HG GLN 19 -6.244 -1.966 4.649 119 HE21 GLN 19 1HE2 GLN 19 -7.845 -4.109 4.929 120 HE22 GLN 19 2HE2 GLN 19 -8.171 -4.752 3.339 121 H SER 20 H SER 20 -9.813 1.621 6.280 122 HA SER 20 HA SER 20 -10.578 0.758 9.013 123 HB2 SER 20 1HB SER 20 -11.152 3.435 7.792 124 HB3 SER 20 2HB SER 20 -11.211 3.010 9.498 125 HG SER 20 HG SER 20 -8.937 2.897 9.466 126 H GLY 21 H GLY 21 -12.896 1.127 9.555 127 HA2 GLY 21 1HA GLY 21 -15.128 0.819 9.174 128 HA3 GLY 21 2HA GLY 21 -14.858 1.584 7.601 129 H ASP 22 H ASP 22 -16.212 0.216 6.393 130 HA ASP 22 HA ASP 22 -15.996 -2.704 6.644 131 HB2 ASP 22 1HB ASP 22 -18.153 -1.487 6.275 132 HB3 ASP 22 2HB ASP 22 -17.656 -1.148 4.622 133 H PHE 23 H PHE 23 -13.696 -2.709 6.104 134 HA PHE 23 HA PHE 23 -13.009 -2.260 3.273 135 HB2 PHE 23 1HB PHE 23 -10.775 -3.058 3.988 136 HB3 PHE 23 2HB PHE 23 -11.402 -1.682 4.901 137 HD1 PHE 23 1HD PHE 23 -11.096 -5.456 5.131 138 HD2 PHE 23 2HD PHE 23 -11.356 -1.697 7.235 139 HE1 PHE 23 1HE PHE 23 -10.731 -6.622 7.271 140 HE2 PHE 23 2HE PHE 23 -10.943 -2.872 9.375 141 HZ PHE 23 HZ PHE 23 -10.636 -5.335 9.408 142 H ARG 24 H ARG 24 -14.709 -4.663 4.801 143 HA ARG 24 HA ARG 24 -13.471 -7.036 3.581 144 HB2 ARG 24 1HB ARG 24 -16.180 -6.528 4.905 145 HB3 ARG 24 2HB ARG 24 -15.671 -8.092 4.257 146 HG2 ARG 24 1HG ARG 24 -13.803 -8.216 5.817 147 HG3 ARG 24 2HG ARG 24 -14.145 -6.576 6.419 148 HD2 ARG 24 1HD ARG 24 -16.364 -7.296 7.190 149 HD3 ARG 24 2HD ARG 24 -16.072 -8.933 6.598 150 HE ARG 24 HE ARG 24 -14.776 -7.555 8.884 151 HH11 ARG 24 1HH1 ARG 24 -14.983 -10.588 6.957 152 HH12 ARG 24 2HH1 ARG 24 -14.143 -11.504 8.138 153 HH21 ARG 24 1HH2 ARG 24 -13.649 -8.843 10.390 154 HH22 ARG 24 2HH2 ARG 24 -13.521 -10.574 10.151 155 H SER 25 H SER 25 -16.441 -5.097 3.087 156 HA SER 25 HA SER 25 -17.358 -6.831 1.090 157 HB2 SER 25 1HB SER 25 -18.434 -4.093 1.897 158 HB3 SER 25 2HB SER 25 -19.322 -5.468 1.224 159 HG SER 25 HG SER 25 -18.292 -5.044 3.792 160 H PHE 26 H PHE 26 -14.949 -5.754 0.044 161 HA PHE 26 HA PHE 26 -15.715 -3.940 -2.189 162 HB2 PHE 26 1HB PHE 26 -14.087 -3.287 0.288 163 HB3 PHE 26 2HB PHE 26 -13.808 -2.440 -1.198 164 HD1 PHE 26 1HD PHE 26 -15.504 -1.027 -2.304 165 HD2 PHE 26 2HD PHE 26 -16.104 -2.834 1.563 166 HE1 PHE 26 1HE PHE 26 -17.433 0.502 -1.875 167 HE2 PHE 26 2HE PHE 26 -18.022 -1.360 1.971 168 HZ PHE 26 HZ PHE 26 -18.680 0.318 0.271 169 H ILE 27 H ILE 27 -14.775 -4.855 -3.895 170 HA ILE 27 HA ILE 27 -12.509 -6.573 -3.876 171 HB ILE 27 HB ILE 27 -12.735 -6.168 -6.445 172 HG12 ILE 27 1HG1 ILE 27 -15.415 -5.037 -5.569 173 HG13 ILE 27 2HG1 ILE 27 -14.097 -4.192 -6.401 174 HG21 ILE 27 1HG2 ILE 27 -13.470 -8.188 -5.007 175 HG22 ILE 27 2HG2 ILE 27 -15.089 -7.469 -5.033 176 HG23 ILE 27 3HG2 ILE 27 -14.319 -7.982 -6.539 177 HD11 ILE 27 3HD1 ILE 27 -15.773 -6.468 -7.530 178 HD12 ILE 27 1HD1 ILE 27 -15.854 -4.757 -7.965 179 HD13 ILE 27 2HD1 ILE 27 -14.401 -5.692 -8.356 180 H LYS 28 H LYS 28 -11.112 -5.287 -2.766 181 HA LYS 28 HA LYS 28 -9.800 -2.927 -3.842 182 HB2 LYS 28 1HB LYS 28 -8.365 -3.273 -1.792 183 HB3 LYS 28 2HB LYS 28 -10.088 -3.122 -1.505 184 HG2 LYS 28 1HG LYS 28 -10.003 -5.817 -1.565 185 HG3 LYS 28 2HG LYS 28 -8.319 -5.553 -1.210 186 HD2 LYS 28 1HD LYS 28 -8.831 -4.565 0.889 187 HD3 LYS 28 2HD LYS 28 -10.495 -4.192 0.442 188 HE2 LYS 28 1HE LYS 28 -9.497 -7.058 0.646 189 HE3 LYS 28 2HE LYS 28 -10.110 -6.150 2.047 190 HZ1 LYS 28 3HZ LYS 28 -11.830 -7.478 1.019 191 HZ2 LYS 28 1HZ LYS 28 -11.662 -6.725 -0.406 192 HZ3 LYS 28 2HZ LYS 28 -12.203 -5.885 0.918 193 H SER 29 H SER 29 -7.425 -2.758 -4.296 194 HA SER 29 HA SER 29 -6.001 -5.251 -4.900 195 HB2 SER 29 1HB SER 29 -7.497 -4.707 -6.899 196 HB3 SER 29 2HB SER 29 -6.587 -3.203 -7.095 197 HG SER 29 HG SER 29 -5.751 -4.782 -8.410 198 H VAL 30 H VAL 30 -3.755 -4.851 -5.249 199 HA VAL 30 HA VAL 30 -2.737 -2.071 -4.823 200 HB VAL 30 HB VAL 30 -1.790 -4.636 -3.503 201 HG11 VAL 30 1HG1 VAL 30 0.230 -3.463 -4.157 202 HG12 VAL 30 2HG1 VAL 30 -0.409 -1.931 -3.503 203 HG13 VAL 30 3HG1 VAL 30 0.002 -3.285 -2.428 204 HG21 VAL 30 3HG2 VAL 30 -2.104 -3.441 -1.386 205 HG22 VAL 30 1HG2 VAL 30 -2.663 -2.008 -2.263 206 HG23 VAL 30 2HG2 VAL 30 -3.619 -3.517 -2.293 207 H VAL 31 H VAL 31 -1.106 -1.534 -6.151 208 HA VAL 31 HA VAL 31 0.264 -3.523 -7.878 209 HB VAL 31 HB VAL 31 0.026 -0.481 -8.094 210 HG11 VAL 31 1HG1 VAL 31 2.028 -1.391 -9.205 211 HG12 VAL 31 2HG1 VAL 31 0.994 -2.496 -10.150 212 HG13 VAL 31 3HG1 VAL 31 0.872 -0.744 -10.375 213 HG21 VAL 31 3HG2 VAL 31 -2.213 -1.384 -8.521 214 HG22 VAL 31 1HG2 VAL 31 -1.485 -0.784 -10.006 215 HG23 VAL 31 2HG2 VAL 31 -1.538 -2.530 -9.704 216 H VAL 32 H VAL 32 2.459 -3.847 -7.129 217 HA VAL 32 HA VAL 32 3.684 -1.673 -5.538 218 HB VAL 32 HB VAL 32 2.785 -3.281 -3.965 219 HG11 VAL 32 1HG1 VAL 32 2.833 -5.305 -5.247 220 HG12 VAL 32 2HG1 VAL 32 4.611 -5.274 -5.319 221 HG13 VAL 32 3HG1 VAL 32 3.773 -5.526 -3.768 222 HG21 VAL 32 3HG2 VAL 32 4.871 -1.993 -3.458 223 HG22 VAL 32 1HG2 VAL 32 4.742 -3.534 -2.607 224 HG23 VAL 32 2HG2 VAL 32 5.824 -3.405 -4.000 225 H VAL 33 H VAL 33 5.980 -1.486 -5.726 226 HA VAL 33 HA VAL 33 7.364 -3.137 -7.711 227 HB VAL 33 HB VAL 33 7.282 -0.084 -7.857 228 HG11 VAL 33 1HG1 VAL 33 8.464 -0.405 -10.031 229 HG12 VAL 33 2HG1 VAL 33 9.411 -0.981 -8.672 230 HG13 VAL 33 3HG1 VAL 33 8.562 -2.147 -9.717 231 HG21 VAL 33 3HG2 VAL 33 5.125 -0.821 -8.690 232 HG22 VAL 33 1HG2 VAL 33 6.136 -0.354 -10.055 233 HG23 VAL 33 2HG2 VAL 33 5.875 -2.066 -9.701 234 H ALA 34 H ALA 34 9.691 -3.027 -7.279 235 HA ALA 34 HA ALA 34 10.695 -1.190 -5.271 236 HB1 ALA 34 1HB ALA 34 10.921 -4.213 -4.875 237 HB2 ALA 34 2HB ALA 34 11.811 -2.978 -3.968 238 HB3 ALA 34 3HB ALA 34 10.041 -3.076 -3.825 239 H ASN 35 H ASN 35 12.092 -0.293 -6.786 240 HA ASN 35 HA ASN 35 13.382 -1.881 -8.872 241 HB2 ASN 35 1HB ASN 35 12.967 0.544 -9.164 242 HB3 ASN 35 2HB ASN 35 14.091 0.889 -7.833 243 HD21 ASN 35 1HD2 ASN 35 14.787 2.244 -9.926 244 HD22 ASN 35 2HD2 ASN 35 16.179 1.505 -10.680 245 H GLY 36 H GLY 36 14.998 -3.318 -8.417 246 HA2 GLY 36 1HA GLY 36 17.316 -3.371 -8.272 247 HA3 GLY 36 2HA GLY 36 17.294 -2.196 -6.962 248 H THR 37 H THR 37 14.986 -4.103 -5.857 249 HA THR 37 HA THR 37 16.599 -6.273 -4.783 250 HB THR 37 HB THR 37 17.126 -4.215 -3.443 251 HG1 THR 37 1HG THR 37 17.496 -6.126 -2.576 252 HG21 THR 37 3HG2 THR 37 14.842 -3.231 -3.494 253 HG22 THR 37 1HG2 THR 37 15.485 -3.385 -1.857 254 HG23 THR 37 2HG2 THR 37 14.269 -4.535 -2.434 255 H GLN 38 H GLN 38 15.044 -7.313 -2.931 256 HA GLN 38 HA GLN 38 12.431 -7.835 -4.286 257 HB2 GLN 38 1HB GLN 38 14.216 -9.414 -2.455 258 HB3 GLN 38 2HB GLN 38 12.478 -9.603 -2.221 259 HG2 GLN 38 1HG GLN 38 12.144 -10.268 -4.513 260 HG3 GLN 38 2HG GLN 38 13.795 -9.890 -4.930 261 HE21 GLN 38 1HE2 GLN 38 11.649 -12.361 -3.787 262 HE22 GLN 38 2HE2 GLN 38 12.822 -13.501 -3.207 263 H LEU 39 H LEU 39 10.565 -7.931 -2.978 264 HA LEU 39 HA LEU 39 10.355 -5.846 -0.914 265 HB2 LEU 39 1HB LEU 39 8.714 -6.442 -2.922 266 HB3 LEU 39 2HB LEU 39 8.172 -7.712 -1.840 267 HG LEU 39 HG LEU 39 7.759 -5.860 -0.129 268 HD11 LEU 39 1HD1 LEU 39 8.091 -4.148 -2.650 269 HD12 LEU 39 2HD1 LEU 39 9.135 -4.083 -1.206 270 HD13 LEU 39 3HD1 LEU 39 7.446 -3.574 -1.093 271 HD21 LEU 39 3HD2 LEU 39 5.961 -6.956 -1.432 272 HD22 LEU 39 1HD2 LEU 39 6.149 -5.753 -2.710 273 HD23 LEU 39 2HD2 LEU 39 5.600 -5.253 -1.099 274 H LYS 40 H LYS 40 9.120 -6.569 1.083 275 HA LYS 40 HA LYS 40 9.689 -9.346 1.965 276 HB2 LYS 40 1HB LYS 40 11.543 -7.864 2.737 277 HB3 LYS 40 2HB LYS 40 10.352 -6.781 3.471 278 HG2 LYS 40 1HG LYS 40 9.597 -8.692 4.925 279 HG3 LYS 40 2HG LYS 40 10.903 -9.683 4.260 280 HD2 LYS 40 1HD LYS 40 12.590 -8.330 5.266 281 HD3 LYS 40 2HD LYS 40 11.469 -6.972 5.521 282 HE2 LYS 40 1HE LYS 40 10.130 -8.389 7.072 283 HE3 LYS 40 2HE LYS 40 11.346 -9.669 6.927 284 HZ1 LYS 40 3HZ LYS 40 11.645 -8.270 8.886 285 HZ2 LYS 40 1HZ LYS 40 11.881 -6.943 7.935 286 HZ3 LYS 40 2HZ LYS 40 12.953 -8.222 7.901 287 H ASP 41 H ASP 41 7.895 -10.173 3.000 288 HA ASP 41 HA ASP 41 5.575 -8.358 3.336 289 HB2 ASP 41 1HB ASP 41 5.394 -10.720 2.322 290 HB3 ASP 41 2HB ASP 41 5.470 -11.299 3.970 291 H GLY 42 H GLY 42 5.145 -7.398 5.218 292 HA2 GLY 42 1HA GLY 42 6.730 -7.929 7.507 293 HA3 GLY 42 2HA GLY 42 5.342 -6.840 7.440 294 H ALA 43 H ALA 43 3.974 -9.611 6.329 295 HA ALA 43 HA ALA 43 2.760 -10.319 8.876 296 HB1 ALA 43 1HB ALA 43 1.460 -11.866 7.482 297 HB2 ALA 43 2HB ALA 43 1.482 -10.254 6.744 298 HB3 ALA 43 3HB ALA 43 2.513 -11.556 6.095 299 H THR 44 H THR 44 5.343 -11.633 6.835 300 HA THR 44 HA THR 44 5.590 -14.032 8.596 301 HB THR 44 HB THR 44 6.318 -15.109 6.354 302 HG1 THR 44 1HG THR 44 5.017 -14.063 4.615 303 HG21 THR 44 3HG2 THR 44 4.209 -15.647 7.559 304 HG22 THR 44 1HG2 THR 44 4.039 -15.734 5.801 305 HG23 THR 44 2HG2 THR 44 3.388 -14.330 6.684 306 H GLY 45 H GLY 45 7.307 -11.717 6.418 307 HA2 GLY 45 1HA GLY 45 9.569 -11.102 6.626 308 HA3 GLY 45 2HA GLY 45 9.905 -12.540 7.613 309 H GLU 46 H GLU 46 7.799 -13.127 4.859 310 HA GLU 46 HA GLU 46 9.808 -14.620 3.404 311 HB2 GLU 46 1HB GLU 46 6.955 -13.716 2.765 312 HB3 GLU 46 2HB GLU 46 7.975 -14.607 1.647 313 HG2 GLU 46 1HG GLU 46 8.191 -16.210 3.876 314 HG3 GLU 46 2HG GLU 46 6.555 -15.567 4.060 315 H SER 47 H SER 47 10.464 -14.060 1.259 316 HA SER 47 HA SER 47 10.646 -11.148 0.731 317 HB2 SER 47 1HB SER 47 12.774 -11.807 -0.486 318 HB3 SER 47 2HB SER 47 12.781 -11.899 1.284 319 HG SER 47 HG SER 47 13.718 -13.747 0.550 320 H LEU 48 H LEU 48 9.985 -10.429 -1.222 321 HA LEU 48 HA LEU 48 8.580 -12.430 -2.959 322 HB2 LEU 48 1HB LEU 48 7.548 -9.740 -2.037 323 HB3 LEU 48 2HB LEU 48 6.693 -10.922 -3.009 324 HG LEU 48 HG LEU 48 7.565 -11.378 -0.109 325 HD11 LEU 48 1HD1 LEU 48 5.974 -9.615 -0.084 326 HD12 LEU 48 2HD1 LEU 48 5.068 -11.099 0.285 327 HD13 LEU 48 3HD1 LEU 48 4.974 -10.385 -1.325 328 HD21 LEU 48 3HD2 LEU 48 5.630 -12.950 -1.875 329 HD22 LEU 48 1HD2 LEU 48 6.024 -13.281 -0.164 330 HD23 LEU 48 2HD2 LEU 48 7.259 -13.484 -1.403 331 H ALA 49 H ALA 49 8.413 -11.974 -5.116 332 HA ALA 49 HA ALA 49 10.698 -10.416 -6.112 333 HB1 ALA 49 1HB ALA 49 8.856 -12.421 -7.455 334 HB2 ALA 49 2HB ALA 49 10.318 -11.720 -8.158 335 HB3 ALA 49 3HB ALA 49 10.450 -12.771 -6.743 336 H SER 50 H SER 50 9.302 -8.427 -5.418 337 HA SER 50 HA SER 50 7.176 -7.485 -7.051 338 HB2 SER 50 1HB SER 50 9.288 -6.258 -5.315 339 HB3 SER 50 2HB SER 50 8.383 -5.204 -6.395 340 HG SER 50 HG SER 50 7.023 -7.082 -4.762 341 HA PRO 51 HA PRO 51 6.675 -5.293 -8.153 342 HB2 PRO 51 1HB PRO 51 5.595 -4.813 -10.616 343 HB3 PRO 51 2HB PRO 51 7.010 -3.907 -9.997 344 HG2 PRO 51 1HG PRO 51 7.045 -6.320 -11.822 345 HG3 PRO 51 2HG PRO 51 7.849 -4.744 -12.062 346 HD2 PRO 51 1HD PRO 51 9.173 -6.856 -10.977 347 HD3 PRO 51 2HD PRO 51 9.455 -5.194 -10.386 348 H VAL 52 H VAL 52 4.590 -6.028 -7.760 349 HA VAL 52 HA VAL 52 3.460 -8.362 -9.126 350 HB VAL 52 HB VAL 52 4.232 -8.251 -6.160 351 HG11 VAL 52 1HG1 VAL 52 3.251 -10.559 -5.932 352 HG12 VAL 52 2HG1 VAL 52 2.055 -9.311 -6.154 353 HG13 VAL 52 3HG1 VAL 52 2.491 -10.347 -7.532 354 HG21 VAL 52 3HG2 VAL 52 6.037 -9.109 -7.636 355 HG22 VAL 52 1HG2 VAL 52 5.425 -10.378 -6.596 356 HG23 VAL 52 2HG2 VAL 52 4.927 -10.297 -8.302 357 H ILE 53 H ILE 53 1.199 -8.744 -8.230 358 HA ILE 53 HA ILE 53 -0.127 -6.232 -7.430 359 HB ILE 53 HB ILE 53 -1.176 -8.492 -9.181 360 HG12 ILE 53 1HG1 ILE 53 0.276 -7.328 -10.588 361 HG13 ILE 53 2HG1 ILE 53 -1.339 -6.767 -10.961 362 HG21 ILE 53 1HG2 ILE 53 -3.164 -7.080 -9.574 363 HG22 ILE 53 2HG2 ILE 53 -2.998 -7.523 -7.881 364 HG23 ILE 53 3HG2 ILE 53 -2.555 -5.891 -8.394 365 HD11 ILE 53 3HD1 ILE 53 0.040 -4.846 -11.039 366 HD12 ILE 53 1HD1 ILE 53 -0.837 -4.718 -9.490 367 HD13 ILE 53 2HD1 ILE 53 0.853 -5.280 -9.543 368 H LEU 54 H LEU 54 -1.568 -6.528 -5.714 369 HA LEU 54 HA LEU 54 -1.749 -9.280 -4.522 370 HB2 LEU 54 1HB LEU 54 -1.566 -6.650 -3.020 371 HB3 LEU 54 2HB LEU 54 -2.038 -8.174 -2.323 372 HG LEU 54 HG LEU 54 0.246 -7.588 -1.781 373 HD11 LEU 54 1HD1 LEU 54 -0.363 -9.960 -1.844 374 HD12 LEU 54 2HD1 LEU 54 1.322 -9.705 -2.294 375 HD13 LEU 54 3HD1 LEU 54 0.122 -10.060 -3.556 376 HD21 LEU 54 3HD2 LEU 54 0.725 -6.402 -3.985 377 HD22 LEU 54 1HD2 LEU 54 1.044 -8.028 -4.655 378 HD23 LEU 54 2HD2 LEU 54 2.024 -7.417 -3.357 379 H SER 55 H SER 55 -3.684 -10.010 -4.349 380 HA SER 55 HA SER 55 -5.825 -8.565 -5.606 381 HB2 SER 55 1HB SER 55 -6.804 -11.018 -4.918 382 HB3 SER 55 2HB SER 55 -5.857 -10.699 -6.370 383 HG SER 55 HG SER 55 -5.290 -12.443 -4.573 384 H ASP 56 H ASP 56 -8.015 -9.015 -4.675 385 HA ASP 56 HA ASP 56 -8.566 -7.560 -2.385 386 HB2 ASP 56 1HB ASP 56 -10.249 -8.020 -4.041 387 HB3 ASP 56 2HB ASP 56 -10.029 -9.770 -3.885 388 H GLU 57 H GLU 57 -7.880 -11.049 -2.635 389 HA GLU 57 HA GLU 57 -8.885 -11.684 -0.006 390 HB2 GLU 57 1HB GLU 57 -7.076 -13.175 -1.943 391 HB3 GLU 57 2HB GLU 57 -7.619 -13.825 -0.406 392 HG2 GLU 57 1HG GLU 57 -10.029 -13.329 -1.248 393 HG3 GLU 57 2HG GLU 57 -9.298 -13.145 -2.849 394 H GLU 58 H GLU 58 -5.649 -10.901 -1.348 395 HA GLU 58 HA GLU 58 -4.191 -11.578 0.993 396 HB2 GLU 58 1HB GLU 58 -3.417 -9.360 -0.923 397 HB3 GLU 58 2HB GLU 58 -2.366 -10.455 -0.041 398 HG2 GLU 58 1HG GLU 58 -4.091 -11.027 -2.473 399 HG3 GLU 58 2HG GLU 58 -2.341 -11.043 -2.392 400 H LEU 59 H LEU 59 -5.826 -8.674 -0.166 401 HA LEU 59 HA LEU 59 -5.027 -6.969 2.059 402 HB2 LEU 59 1HB LEU 59 -6.506 -6.742 -0.560 403 HB3 LEU 59 2HB LEU 59 -6.774 -5.489 0.624 404 HG LEU 59 HG LEU 59 -5.130 -4.901 -1.041 405 HD11 LEU 59 1HD1 LEU 59 -3.529 -3.859 0.504 406 HD12 LEU 59 2HD1 LEU 59 -4.017 -4.981 1.789 407 HD13 LEU 59 3HD1 LEU 59 -5.168 -3.797 1.160 408 HD21 LEU 59 3HD2 LEU 59 -3.253 -6.917 0.236 409 HD22 LEU 59 1HD2 LEU 59 -2.879 -5.757 -1.066 410 HD23 LEU 59 2HD2 LEU 59 -4.022 -7.067 -1.356 411 H ALA 60 H ALA 60 -7.217 -9.391 2.325 412 HA ALA 60 HA ALA 60 -9.634 -8.016 2.913 413 HB1 ALA 60 1HB ALA 60 -9.422 -10.387 2.218 414 HB2 ALA 60 2HB ALA 60 -8.792 -10.751 3.850 415 HB3 ALA 60 3HB ALA 60 -10.447 -10.151 3.641 416 H VAL 61 H VAL 61 -7.280 -7.019 4.676 417 HA VAL 61 HA VAL 61 -8.210 -7.871 7.387 418 HB VAL 61 HB VAL 61 -5.793 -7.748 7.959 419 HG11 VAL 61 1HG1 VAL 61 -5.139 -9.824 6.903 420 HG12 VAL 61 2HG1 VAL 61 -6.837 -9.893 7.425 421 HG13 VAL 61 3HG1 VAL 61 -6.432 -9.667 5.707 422 HG21 VAL 61 3HG2 VAL 61 -5.058 -6.249 6.059 423 HG22 VAL 61 1HG2 VAL 61 -4.092 -7.721 6.255 424 HG23 VAL 61 2HG2 VAL 61 -5.280 -7.617 4.946 425 H GLU 62 H GLU 62 -7.262 -6.393 9.210 426 HA GLU 62 HA GLU 62 -8.163 -3.689 8.668 427 HB2 GLU 62 1HB GLU 62 -7.423 -3.218 10.994 428 HB3 GLU 62 2HB GLU 62 -8.462 -4.643 10.926 429 HG2 GLU 62 1HG GLU 62 -6.563 -6.120 11.180 430 HG3 GLU 62 2HG GLU 62 -5.443 -4.759 10.973 431 H LYS 63 H LYS 63 -4.922 -5.245 8.601 432 HA LYS 63 HA LYS 63 -4.009 -2.785 7.357 433 HB2 LYS 63 1HB LYS 63 -3.674 -2.319 9.769 434 HB3 LYS 63 2HB LYS 63 -2.794 -3.826 9.939 435 HG2 LYS 63 1HG LYS 63 -0.998 -2.923 8.437 436 HG3 LYS 63 2HG LYS 63 -1.871 -1.379 8.363 437 HD2 LYS 63 1HD LYS 63 -1.644 -1.222 10.873 438 HD3 LYS 63 2HD LYS 63 -0.802 -2.772 10.836 439 HE2 LYS 63 1HE LYS 63 1.065 -1.513 10.775 440 HE3 LYS 63 2HE LYS 63 0.752 -1.485 9.046 441 HZ1 LYS 63 3HZ LYS 63 1.242 0.701 10.151 442 HZ2 LYS 63 1HZ LYS 63 -0.136 0.627 10.951 443 HZ3 LYS 63 2HZ LYS 63 -0.159 0.773 9.321 444 H VAL 64 H VAL 64 -2.078 -3.100 6.061 445 HA VAL 64 HA VAL 64 -0.737 -5.675 6.542 446 HB VAL 64 HB VAL 64 -0.759 -4.604 3.720 447 HG11 VAL 64 1HG1 VAL 64 -0.345 -7.383 4.888 448 HG12 VAL 64 2HG1 VAL 64 -0.243 -6.949 3.180 449 HG13 VAL 64 3HG1 VAL 64 0.928 -6.289 4.316 450 HG21 VAL 64 3HG2 VAL 64 -2.738 -6.638 4.797 451 HG22 VAL 64 1HG2 VAL 64 -3.169 -5.026 4.170 452 HG23 VAL 64 2HG2 VAL 64 -2.488 -6.252 3.092 453 H THR 65 H THR 65 1.594 -5.493 6.131 454 HA THR 65 HA THR 65 2.750 -2.750 6.033 455 HB THR 65 HB THR 65 3.464 -4.997 7.973 456 HG1 THR 65 1HG THR 65 2.863 -3.055 9.440 457 HG21 THR 65 3HG2 THR 65 5.167 -3.710 8.808 458 HG22 THR 65 1HG2 THR 65 4.492 -2.177 8.232 459 HG23 THR 65 2HG2 THR 65 5.261 -3.253 7.096 460 H LEU 66 H LEU 66 4.465 -2.803 4.435 461 HA LEU 66 HA LEU 66 5.924 -5.345 4.153 462 HB2 LEU 66 1HB LEU 66 4.524 -3.999 1.811 463 HB3 LEU 66 2HB LEU 66 5.920 -5.054 1.648 464 HG LEU 66 HG LEU 66 4.297 -6.594 3.302 465 HD11 LEU 66 1HD1 LEU 66 2.549 -5.206 1.255 466 HD12 LEU 66 2HD1 LEU 66 2.420 -5.017 3.016 467 HD13 LEU 66 3HD1 LEU 66 2.080 -6.595 2.261 468 HD21 LEU 66 3HD2 LEU 66 4.398 -6.674 0.318 469 HD22 LEU 66 1HD2 LEU 66 4.017 -8.016 1.436 470 HD23 LEU 66 2HD2 LEU 66 5.640 -7.326 1.420 471 H SER 67 H SER 67 7.919 -5.123 3.377 472 HA SER 67 HA SER 67 8.990 -2.389 3.001 473 HB2 SER 67 1HB SER 67 9.133 -2.950 5.412 474 HB3 SER 67 2HB SER 67 10.136 -4.360 4.992 475 HG SER 67 HG SER 67 11.097 -2.083 5.594 476 H THR 68 H THR 68 11.618 -3.056 2.920 477 HA THR 68 HA THR 68 11.782 -4.723 0.452 478 HB THR 68 HB THR 68 13.884 -3.187 0.184 479 HG1 THR 68 1HG THR 68 12.077 -1.514 1.645 480 HG21 THR 68 3HG2 THR 68 12.424 -1.550 -1.103 481 HG22 THR 68 1HG2 THR 68 11.012 -2.283 -0.333 482 HG23 THR 68 2HG2 THR 68 12.029 -3.254 -1.418 483 H THR 69 H THR 69 13.482 -6.093 0.264 484 HA THR 69 HA THR 69 14.713 -6.993 2.747 485 HB THR 69 HB THR 69 15.830 -8.677 1.224 486 HG1 THR 69 1HG THR 69 14.208 -7.402 -0.746 487 HG21 THR 69 3HG2 THR 69 13.828 -9.934 0.682 488 HG22 THR 69 1HG2 THR 69 12.814 -8.489 0.869 489 HG23 THR 69 2HG2 THR 69 13.642 -9.180 2.274 490 H GLY 70 H GLY 70 15.543 -4.654 0.392 491 HA2 GLY 70 1HA GLY 70 18.211 -4.293 1.516 492 HA3 GLY 70 2HA GLY 70 18.097 -4.819 -0.183 493 H LYS 71 H LYS 71 19.205 -2.687 -0.451 494 HA LYS 71 HA LYS 71 17.752 -0.244 -0.102 495 HB2 LYS 71 1HB LYS 71 20.296 -0.620 -0.418 496 HB3 LYS 71 2HB LYS 71 19.940 -0.827 -2.136 497 HG2 LYS 71 1HG LYS 71 18.817 1.474 -2.080 498 HG3 LYS 71 2HG LYS 71 19.402 1.627 -0.419 499 HD2 LYS 71 1HD LYS 71 21.178 2.598 -1.446 500 HD3 LYS 71 2HD LYS 71 21.729 0.917 -1.570 501 HE2 LYS 71 1HE LYS 71 20.415 0.865 -3.821 502 HE3 LYS 71 2HE LYS 71 20.293 2.627 -3.626 503 HZ1 LYS 71 3HZ LYS 71 22.646 0.894 -4.106 504 HZ2 LYS 71 1HZ LYS 71 22.915 2.289 -3.342 505 HZ3 LYS 71 2HZ LYS 71 22.273 2.330 -4.854 506 H ALA 72 H ALA 72 16.292 0.723 -1.493 507 HA ALA 72 HA ALA 72 15.877 -0.540 -4.142 508 HB1 ALA 72 1HB ALA 72 13.448 -0.090 -3.949 509 HB2 ALA 72 2HB ALA 72 13.999 -1.214 -2.695 510 HB3 ALA 72 3HB ALA 72 13.682 0.487 -2.283 511 H ILE 73 H ILE 73 15.297 0.880 -5.763 512 HA ILE 73 HA ILE 73 15.893 3.753 -5.177 513 HB ILE 73 HB ILE 73 15.942 2.751 -7.979 514 HG12 ILE 73 1HG1 ILE 73 17.120 0.882 -7.018 515 HG13 ILE 73 2HG1 ILE 73 18.168 1.890 -7.970 516 HG21 ILE 73 1HG2 ILE 73 17.758 4.596 -6.374 517 HG22 ILE 73 2HG2 ILE 73 17.829 4.327 -8.129 518 HG23 ILE 73 3HG2 ILE 73 16.418 5.102 -7.384 519 HD11 ILE 73 3HD1 ILE 73 19.347 1.153 -5.978 520 HD12 ILE 73 1HD1 ILE 73 19.164 2.902 -5.931 521 HD13 ILE 73 2HD1 ILE 73 18.124 1.869 -4.921 522 H GLU 74 H GLU 74 13.187 1.812 -5.588 523 HA GLU 74 HA GLU 74 11.632 4.097 -6.327 524 HB2 GLU 74 1HB GLU 74 11.385 1.555 -7.999 525 HB3 GLU 74 2HB GLU 74 10.220 2.872 -7.981 526 HG2 GLU 74 1HG GLU 74 11.981 4.462 -8.718 527 HG3 GLU 74 2HG GLU 74 13.093 3.081 -8.904 528 H PHE 75 H PHE 75 9.425 3.772 -5.777 529 HA PHE 75 HA PHE 75 8.486 1.189 -4.925 530 HB2 PHE 75 1HB PHE 75 9.096 3.221 -2.946 531 HB3 PHE 75 2HB PHE 75 7.372 3.204 -3.150 532 HD1 PHE 75 1HD PHE 75 9.529 0.133 -3.383 533 HD2 PHE 75 2HD PHE 75 6.860 2.470 -0.896 534 HE1 PHE 75 1HE PHE 75 9.359 -1.734 -1.817 535 HE2 PHE 75 2HE PHE 75 6.737 0.587 0.663 536 HZ PHE 75 HZ PHE 75 7.976 -1.522 0.253 537 H ALA 76 H ALA 76 6.103 1.230 -5.076 538 HA ALA 76 HA ALA 76 4.910 3.728 -5.909 539 HB1 ALA 76 1HB ALA 76 3.707 2.830 -7.820 540 HB2 ALA 76 2HB ALA 76 5.445 2.683 -8.118 541 HB3 ALA 76 3HB ALA 76 4.502 1.250 -7.634 542 H VAL 77 H VAL 77 2.836 3.858 -5.243 543 HA VAL 77 HA VAL 77 1.555 1.494 -4.031 544 HB VAL 77 HB VAL 77 1.962 4.167 -2.649 545 HG11 VAL 77 1HG1 VAL 77 0.219 1.794 -1.864 546 HG12 VAL 77 2HG1 VAL 77 0.610 3.170 -0.806 547 HG13 VAL 77 3HG1 VAL 77 -0.324 3.436 -2.276 548 HG21 VAL 77 3HG2 VAL 77 2.743 1.362 -1.795 549 HG22 VAL 77 1HG2 VAL 77 3.861 2.585 -2.418 550 HG23 VAL 77 2HG2 VAL 77 3.021 2.873 -0.898 551 H SER 78 H SER 78 0.366 1.227 -5.747 552 HA SER 78 HA SER 78 -1.566 3.305 -6.541 553 HB2 SER 78 1HB SER 78 -0.041 3.385 -8.348 554 HB3 SER 78 2HB SER 78 0.277 1.653 -8.290 555 HG SER 78 HG SER 78 -1.957 3.027 -9.339 556 H GLY 79 H GLY 79 -3.537 2.186 -7.356 557 HA2 GLY 79 1HA GLY 79 -4.590 -0.234 -7.177 558 HA3 GLY 79 2HA GLY 79 -4.050 -0.035 -5.490 559 H GLY 80 H GLY 80 -6.246 0.000 -4.764 560 HA2 GLY 80 1HA GLY 80 -7.743 2.097 -4.096 561 HA3 GLY 80 2HA GLY 80 -8.022 2.052 -5.840 562 H VAL 81 H VAL 81 -10.247 1.572 -5.081 563 HA VAL 81 HA VAL 81 -10.668 -1.307 -5.230 564 HB VAL 81 HB VAL 81 -10.510 -0.777 -2.837 565 HG11 VAL 81 1HG1 VAL 81 -12.172 0.564 -1.654 566 HG12 VAL 81 2HG1 VAL 81 -11.250 1.554 -2.793 567 HG13 VAL 81 3HG1 VAL 81 -12.908 1.061 -3.196 568 HG21 VAL 81 3HG2 VAL 81 -13.403 -1.309 -3.087 569 HG22 VAL 81 1HG2 VAL 81 -12.307 -2.385 -3.942 570 HG23 VAL 81 2HG2 VAL 81 -12.078 -2.150 -2.214 571 H VAL 82 H VAL 82 -12.997 -1.782 -5.719 572 HA VAL 82 HA VAL 82 -14.588 0.522 -6.558 573 HB VAL 82 HB VAL 82 -13.619 -0.021 -8.632 574 HG11 VAL 82 1HG1 VAL 82 -13.480 -2.210 -9.684 575 HG12 VAL 82 2HG1 VAL 82 -12.566 -2.193 -8.180 576 HG13 VAL 82 3HG1 VAL 82 -14.169 -2.976 -8.246 577 HG21 VAL 82 3HG2 VAL 82 -16.104 0.178 -8.751 578 HG22 VAL 82 1HG2 VAL 82 -15.396 -0.813 -10.029 579 HG23 VAL 82 2HG2 VAL 82 -16.214 -1.596 -8.665 580 H ASP 83 H ASP 83 -16.949 -0.070 -6.455 581 HA ASP 83 HA ASP 83 -17.347 -2.162 -4.432 582 HB2 ASP 83 1HB ASP 83 -18.371 0.119 -4.270 583 HB3 ASP 83 2HB ASP 83 -19.340 -0.258 -5.690 584 H GLY 84 H GLY 84 -18.040 -4.178 -4.996 585 HA2 GLY 84 1HA GLY 84 -18.853 -4.816 -7.777 586 HA3 GLY 84 2HA GLY 84 -18.270 -5.926 -6.534 587 H GLU 85 H GLU 85 -20.383 -3.770 -5.034 588 HA GLU 85 HA GLU 85 -22.731 -5.571 -5.301 589 HB2 GLU 85 1HB GLU 85 -21.399 -4.240 -2.910 590 HB3 GLU 85 2HB GLU 85 -23.026 -4.901 -2.831 591 HG2 GLU 85 1HG GLU 85 -20.912 -6.753 -3.901 592 HG3 GLU 85 2HG GLU 85 -20.768 -6.310 -2.225 593 H ASP 86 H ASP 86 -24.706 -4.370 -4.380 594 HA ASP 86 HA ASP 86 -24.911 -1.652 -4.018 595 HB2 ASP 86 1HB ASP 86 -24.556 -1.215 -6.402 596 HB3 ASP 86 2HB ASP 86 -25.768 -2.416 -6.846 597 H GLY 87 H GLY 87 -26.232 -2.301 -2.381 598 HA2 GLY 87 1HA GLY 87 -28.878 -2.538 -2.330 599 HA3 GLY 87 2HA GLY 87 -28.466 -4.186 -2.835 600 H VAL 88 H VAL 88 -25.975 -4.396 -1.306 601 HA VAL 88 HA VAL 88 -27.150 -4.892 1.348 602 HB VAL 88 HB VAL 88 -26.000 -6.702 0.461 603 HG11 VAL 88 1HG1 VAL 88 -23.545 -6.704 0.095 604 HG12 VAL 88 2HG1 VAL 88 -24.446 -5.755 -1.095 605 HG13 VAL 88 3HG1 VAL 88 -23.579 -4.931 0.193 606 HG21 VAL 88 3HG2 VAL 88 -24.537 -7.243 2.274 607 HG22 VAL 88 1HG2 VAL 88 -24.225 -5.535 2.632 608 HG23 VAL 88 2HG2 VAL 88 -25.839 -6.226 2.909 609 H VAL 89 H VAL 89 -27.567 -2.724 1.831 610 HA VAL 89 HA VAL 89 -25.702 -0.669 1.940 611 HB VAL 89 HB VAL 89 -28.091 -0.968 3.810 612 HG11 VAL 89 1HG1 VAL 89 -26.616 0.942 4.313 613 HG12 VAL 89 2HG1 VAL 89 -26.708 1.482 2.618 614 HG13 VAL 89 3HG1 VAL 89 -28.148 1.509 3.646 615 HG21 VAL 89 3HG2 VAL 89 -29.335 0.300 1.986 616 HG22 VAL 89 1HG2 VAL 89 -27.992 -0.102 0.896 617 HG23 VAL 89 2HG2 VAL 89 -28.983 -1.386 1.614 618 H ASN 90 H ASN 90 -23.752 -1.117 2.781 619 HA ASN 90 HA ASN 90 -23.523 -2.202 5.515 620 HB2 ASN 90 1HB ASN 90 -21.366 -3.049 4.960 621 HB3 ASN 90 2HB ASN 90 -22.587 -3.650 3.856 622 HD21 ASN 90 1HD2 ASN 90 -22.780 -2.566 1.733 623 HD22 ASN 90 2HD2 ASN 90 -21.289 -1.983 0.981 624 H GLU 91 H GLU 91 -20.572 -1.178 5.602 625 HA GLU 91 HA GLU 91 -21.331 1.592 6.405 626 HB2 GLU 91 1HB GLU 91 -19.430 -0.429 7.578 627 HB3 GLU 91 2HB GLU 91 -18.937 1.259 7.573 628 HG2 GLU 91 1HG GLU 91 -21.368 1.634 8.567 629 HG3 GLU 91 2HG GLU 91 -21.203 -0.061 9.025 630 HA PRO 92 HA PRO 92 -18.245 2.977 3.565 631 HB2 PRO 92 1HB PRO 92 -17.298 5.282 4.792 632 HB3 PRO 92 2HB PRO 92 -18.846 5.148 3.902 633 HG2 PRO 92 1HG PRO 92 -18.386 5.074 6.873 634 HG3 PRO 92 2HG PRO 92 -19.695 5.871 5.952 635 HD2 PRO 92 1HD PRO 92 -19.943 3.415 7.200 636 HD3 PRO 92 2HD PRO 92 -20.895 3.901 5.767 637 H MET 93 H MET 93 -15.687 3.842 3.686 638 HA MET 93 HA MET 93 -14.176 2.417 5.634 639 HB2 MET 93 1HB MET 93 -13.319 0.745 4.270 640 HB3 MET 93 2HB MET 93 -15.007 0.644 3.958 641 HG2 MET 93 1HG MET 93 -14.768 1.383 1.750 642 HG3 MET 93 2HG MET 93 -13.294 2.276 2.060 643 HE1 MET 93 3HE MET 93 -10.564 -0.583 2.261 644 HE2 MET 93 1HE MET 93 -10.832 1.168 2.319 645 HE3 MET 93 2HE MET 93 -11.405 0.148 3.645 646 H GLN 94 H GLN 94 -11.765 2.505 4.579 647 HA GLN 94 HA GLN 94 -11.197 4.454 2.593 648 HB2 GLN 94 1HB GLN 94 -9.823 5.948 4.245 649 HB3 GLN 94 2HB GLN 94 -11.563 6.259 4.112 650 HG2 GLN 94 1HG GLN 94 -12.030 5.098 6.124 651 HG3 GLN 94 2HG GLN 94 -10.347 4.461 6.170 652 HE21 GLN 94 1HE2 GLN 94 -9.885 5.191 8.268 653 HE22 GLN 94 2HE2 GLN 94 -9.775 6.910 8.655 654 H TRP 95 H TRP 95 -8.803 4.683 2.428 655 HA TRP 95 HA TRP 95 -7.233 2.562 3.832 656 HB2 TRP 95 1HB TRP 95 -6.883 3.937 1.156 657 HB3 TRP 95 2HB TRP 95 -5.553 3.164 1.996 658 HD1 TRP 95 HD TRP 95 -8.474 1.071 2.634 659 HE1 TRP 95 1HE TRP 95 -8.336 -1.063 1.259 660 HE3 TRP 95 3HE TRP 95 -4.712 2.354 -0.621 661 HZ2 TRP 95 2HZ TRP 95 -6.792 -2.161 -0.802 662 HZ3 TRP 95 3HZ TRP 95 -3.798 0.578 -2.138 663 HH2 TRP 95 HH TRP 95 -4.887 -1.615 -2.283 664 H VAL 96 H VAL 96 -5.553 3.208 4.981 665 HA VAL 96 HA VAL 96 -4.847 6.085 5.196 666 HB VAL 96 HB VAL 96 -5.330 4.012 7.384 667 HG11 VAL 96 1HG1 VAL 96 -3.395 5.485 7.950 668 HG12 VAL 96 2HG1 VAL 96 -4.450 6.909 7.745 669 HG13 VAL 96 3HG1 VAL 96 -4.774 5.719 9.025 670 HG21 VAL 96 3HG2 VAL 96 -7.051 5.587 8.213 671 HG22 VAL 96 1HG2 VAL 96 -6.807 6.601 6.767 672 HG23 VAL 96 2HG2 VAL 96 -7.438 4.948 6.625 673 H VAL 97 H VAL 97 -3.249 5.549 3.547 674 HA VAL 97 HA VAL 97 -1.392 3.353 4.168 675 HB VAL 97 HB VAL 97 -0.353 3.956 2.033 676 HG11 VAL 97 1HG1 VAL 97 -3.284 3.274 1.794 677 HG12 VAL 97 2HG1 VAL 97 -2.027 2.963 0.570 678 HG13 VAL 97 3HG1 VAL 97 -1.940 2.148 2.136 679 HG21 VAL 97 3HG2 VAL 97 -1.494 5.317 0.362 680 HG22 VAL 97 1HG2 VAL 97 -2.773 5.720 1.525 681 HG23 VAL 97 2HG2 VAL 97 -1.108 6.306 1.773 682 H THR 98 H THR 98 0.670 3.719 4.691 683 HA THR 98 HA THR 98 1.573 6.521 5.124 684 HB THR 98 HB THR 98 2.320 4.269 6.956 685 HG1 THR 98 1HG THR 98 0.030 5.876 7.496 686 HG21 THR 98 3HG2 THR 98 2.101 7.240 7.445 687 HG22 THR 98 1HG2 THR 98 3.585 6.341 7.055 688 HG23 THR 98 2HG2 THR 98 2.742 5.999 8.560 689 H VAL 99 H VAL 99 3.764 6.738 4.597 690 HA VAL 99 HA VAL 99 5.116 4.278 3.554 691 HB VAL 99 HB VAL 99 5.134 7.006 2.236 692 HG11 VAL 99 1HG1 VAL 99 7.124 5.626 1.864 693 HG12 VAL 99 2HG1 VAL 99 6.076 4.332 1.213 694 HG13 VAL 99 3HG1 VAL 99 6.204 5.908 0.399 695 HG21 VAL 99 3HG2 VAL 99 2.855 5.976 1.906 696 HG22 VAL 99 1HG2 VAL 99 3.778 5.971 0.403 697 HG23 VAL 99 2HG2 VAL 99 3.623 4.481 1.364 698 H TYR 100 H TYR 100 7.116 4.019 4.313 699 HA TYR 100 HA TYR 100 8.416 6.258 5.753 700 HB2 TYR 100 1HB TYR 100 8.603 3.278 6.316 701 HB3 TYR 100 2HB TYR 100 9.476 4.533 7.167 702 HD1 TYR 100 2HD TYR 100 8.284 6.074 8.727 703 HD2 TYR 100 1HD TYR 100 6.279 2.758 6.834 704 HE1 TYR 100 2HE TYR 100 6.395 6.324 10.311 705 HE2 TYR 100 1HE TYR 100 4.445 2.939 8.482 706 HH TYR 100 HH TYR 100 4.268 5.528 10.928 707 H LYS 101 H LYS 101 10.553 6.530 5.377 708 HA LYS 101 HA LYS 101 11.868 5.050 3.154 709 HB2 LYS 101 1HB LYS 101 11.883 7.651 3.465 710 HB3 LYS 101 2HB LYS 101 13.184 7.326 4.626 711 HG2 LYS 101 1HG LYS 101 14.505 6.239 2.919 712 HG3 LYS 101 2HG LYS 101 13.139 6.022 1.866 713 HD2 LYS 101 1HD LYS 101 14.323 7.624 0.848 714 HD3 LYS 101 2HD LYS 101 13.052 8.573 1.632 715 HE2 LYS 101 1HE LYS 101 14.559 9.125 3.490 716 HE3 LYS 101 2HE LYS 101 15.839 8.130 2.803 717 HZ1 LYS 101 3HZ LYS 101 14.721 10.574 1.578 718 HZ2 LYS 101 1HZ LYS 101 15.890 9.677 0.902 719 HZ3 LYS 101 2HZ LYS 101 16.186 10.480 2.304 720 H ASN 102 H ASN 102 14.453 5.146 4.199 721 HA ASN 102 HA ASN 102 14.777 3.000 6.040 722 HB2 ASN 102 1HB ASN 102 17.118 3.611 6.098 723 HB3 ASN 102 2HB ASN 102 16.473 3.422 4.480 724 HD21 ASN 102 1HD2 ASN 102 16.404 5.194 3.041 725 HD22 ASN 102 2HD2 ASN 102 17.395 6.580 3.336 726 H GLY 103 H GLY 103 13.144 3.882 7.618 727 HA2 GLY 103 1HA GLY 103 12.875 4.354 9.876 728 HA3 GLY 103 2HA GLY 103 14.557 4.878 9.955 729 H LYS 104 H LYS 104 11.908 6.262 7.903 730 HA LYS 104 HA LYS 104 11.333 8.363 9.769 731 HB2 LYS 104 1HB LYS 104 13.073 8.903 7.393 732 HB3 LYS 104 2HB LYS 104 11.624 9.899 7.432 733 HG2 LYS 104 1HG LYS 104 13.536 9.665 9.769 734 HG3 LYS 104 2HG LYS 104 13.666 10.902 8.528 735 HD2 LYS 104 1HD LYS 104 11.145 10.489 10.175 736 HD3 LYS 104 2HD LYS 104 12.449 11.531 10.722 737 HE2 LYS 104 1HE LYS 104 11.183 11.899 7.978 738 HE3 LYS 104 2HE LYS 104 10.473 12.618 9.427 739 HZ1 LYS 104 3HZ LYS 104 13.296 13.124 8.741 740 HZ2 LYS 104 1HZ LYS 104 12.316 13.945 9.765 741 HZ3 LYS 104 2HZ LYS 104 12.068 14.055 8.164 742 H GLU 105 H GLU 105 9.198 9.313 9.171 743 HA GLU 105 HA GLU 105 7.678 7.742 7.184 744 HB2 GLU 105 1HB GLU 105 6.851 8.640 9.513 745 HB3 GLU 105 2HB GLU 105 6.697 10.185 8.667 746 HG2 GLU 105 1HG GLU 105 5.224 8.986 6.974 747 HG3 GLU 105 2HG GLU 105 5.322 7.551 7.983 748 H ILE 106 H ILE 106 7.018 8.651 5.177 749 HA ILE 106 HA ILE 106 7.902 11.416 4.535 750 HB ILE 106 HB ILE 106 8.509 10.629 2.272 751 HG12 ILE 106 1HG1 ILE 106 8.339 7.811 3.443 752 HG13 ILE 106 2HG1 ILE 106 7.221 8.497 2.255 753 HG21 ILE 106 1HG2 ILE 106 10.728 9.899 2.884 754 HG22 ILE 106 2HG2 ILE 106 10.164 11.033 4.108 755 HG23 ILE 106 3HG2 ILE 106 10.160 9.289 4.459 756 HD11 ILE 106 3HD1 ILE 106 8.778 7.108 1.093 757 HD12 ILE 106 1HD1 ILE 106 9.180 8.791 0.693 758 HD13 ILE 106 2HD1 ILE 106 10.164 7.882 1.867 759 H GLU 107 H GLU 107 5.345 8.968 4.329 760 HA GLU 107 HA GLU 107 3.639 11.062 3.085 761 HB2 GLU 107 1HB GLU 107 4.482 9.084 1.498 762 HB3 GLU 107 2HB GLU 107 3.306 8.141 2.421 763 HG2 GLU 107 1HG GLU 107 2.292 8.879 0.387 764 HG3 GLU 107 2HG GLU 107 1.514 9.703 1.744 765 H LYS 108 H LYS 108 1.529 11.071 3.960 766 HA LYS 108 HA LYS 108 0.733 8.897 5.808 767 HB2 LYS 108 1HB LYS 108 1.915 11.020 6.918 768 HB3 LYS 108 2HB LYS 108 0.351 11.790 6.635 769 HG2 LYS 108 1HG LYS 108 -0.698 9.789 7.859 770 HG3 LYS 108 2HG LYS 108 0.960 9.256 8.183 771 HD2 LYS 108 1HD LYS 108 1.282 11.611 9.252 772 HD3 LYS 108 2HD LYS 108 -0.499 11.707 9.216 773 HE2 LYS 108 1HE LYS 108 -0.559 9.473 10.415 774 HE3 LYS 108 2HE LYS 108 1.208 9.531 10.501 775 HZ1 LYS 108 3HZ LYS 108 -0.626 11.442 11.778 776 HZ2 LYS 108 1HZ LYS 108 1.044 11.506 11.828 777 HZ3 LYS 108 2HZ LYS 108 0.226 10.271 12.528 778 H LYS 109 H LYS 109 -0.085 9.546 3.085 779 HA LYS 109 HA LYS 109 -2.488 11.217 3.367 780 HB2 LYS 109 1HB LYS 109 -1.195 11.572 1.419 781 HB3 LYS 109 2HB LYS 109 -1.323 9.869 0.894 782 HG2 LYS 109 1HG LYS 109 -3.773 10.138 0.655 783 HG3 LYS 109 2HG LYS 109 -3.676 11.747 1.375 784 HD2 LYS 109 1HD LYS 109 -3.950 12.205 -0.780 785 HD3 LYS 109 2HD LYS 109 -2.189 12.339 -0.619 786 HE2 LYS 109 1HE LYS 109 -1.851 10.213 -1.694 787 HE3 LYS 109 2HE LYS 109 -3.572 9.821 -1.599 788 HZ1 LYS 109 3HZ LYS 109 -2.977 10.535 -3.794 789 HZ2 LYS 109 1HZ LYS 109 -2.471 12.018 -3.267 790 HZ3 LYS 109 2HZ LYS 109 -4.046 11.565 -3.143 791 H SER 110 H SER 110 -4.521 10.575 3.444 792 HA SER 110 HA SER 110 -5.129 7.689 3.517 793 HB2 SER 110 1HB SER 110 -7.115 8.779 4.847 794 HB3 SER 110 2HB SER 110 -5.598 8.342 5.657 795 HG SER 110 HG SER 110 -6.597 10.847 4.836 796 H LEU 111 H LEU 111 -7.546 7.350 2.918 797 HA LEU 111 HA LEU 111 -8.250 8.961 0.514 798 HB2 LEU 111 1HB LEU 111 -8.398 5.949 0.748 799 HB3 LEU 111 2HB LEU 111 -8.720 6.931 -0.679 800 HG LEU 111 HG LEU 111 -5.998 6.455 0.588 801 HD11 LEU 111 1HD1 LEU 111 -5.621 4.836 -0.940 802 HD12 LEU 111 2HD1 LEU 111 -6.640 5.587 -2.195 803 HD13 LEU 111 3HD1 LEU 111 -7.386 4.665 -0.897 804 HD21 LEU 111 3HD2 LEU 111 -6.794 8.088 -1.844 805 HD22 LEU 111 1HD2 LEU 111 -5.154 7.490 -1.606 806 HD23 LEU 111 2HD2 LEU 111 -5.856 8.635 -0.453 807 H VAL 112 H VAL 112 -10.661 7.904 -0.150 808 HA VAL 112 HA VAL 112 -12.192 7.208 2.210 809 HB VAL 112 HB VAL 112 -11.999 9.680 2.263 810 HG11 VAL 112 1HG1 VAL 112 -11.812 10.192 -0.127 811 HG12 VAL 112 2HG1 VAL 112 -13.508 9.722 -0.369 812 HG13 VAL 112 3HG1 VAL 112 -13.097 11.118 0.649 813 HG21 VAL 112 3HG2 VAL 112 -13.961 8.566 3.220 814 HG22 VAL 112 1HG2 VAL 112 -14.348 10.180 2.618 815 HG23 VAL 112 2HG2 VAL 112 -14.836 8.753 1.683 816 H PHE 113 H PHE 113 -14.131 6.092 1.584 817 HA PHE 113 HA PHE 113 -15.345 6.504 -0.936 818 HB2 PHE 113 1HB PHE 113 -13.933 3.854 -0.436 819 HB3 PHE 113 2HB PHE 113 -15.417 3.889 -1.357 820 HD1 PHE 113 2HD PHE 113 -15.191 6.289 -3.078 821 HD2 PHE 113 1HD PHE 113 -12.209 3.380 -1.985 822 HE1 PHE 113 2HE PHE 113 -13.992 6.722 -5.178 823 HE2 PHE 113 1HE PHE 113 -11.085 3.722 -4.152 824 HZ PHE 113 HZ PHE 113 -11.968 5.397 -5.766 825 H ARG 114 H ARG 114 -17.387 4.962 -0.979 826 HA ARG 114 HA ARG 114 -18.128 3.931 1.644 827 HB2 ARG 114 1HB ARG 114 -20.203 5.592 0.186 828 HB3 ARG 114 2HB ARG 114 -20.237 4.948 1.826 829 HG2 ARG 114 1HG ARG 114 -18.229 6.660 2.183 830 HG3 ARG 114 2HG ARG 114 -18.946 7.436 0.774 831 HD2 ARG 114 1HD ARG 114 -20.142 6.918 3.526 832 HD3 ARG 114 2HD ARG 114 -19.888 8.471 2.717 833 HE ARG 114 HE ARG 114 -21.633 6.917 1.124 834 HH11 ARG 114 1HH1 ARG 114 -21.849 8.274 4.438 835 HH12 ARG 114 2HH1 ARG 114 -23.551 8.596 4.259 836 HH21 ARG 114 1HH2 ARG 114 -23.785 7.057 1.116 837 HH22 ARG 114 2HH2 ARG 114 -24.699 7.971 2.301 838 H ASP 115 H ASP 115 -20.356 2.903 1.418 839 HA ASP 115 HA ASP 115 -20.535 0.765 -0.436 840 HB2 ASP 115 1HB ASP 115 -22.642 0.400 0.703 841 HB3 ASP 115 2HB ASP 115 -21.409 0.800 1.894 842 H GLY 116 H GLY 116 -21.768 0.466 -2.205 843 HA2 GLY 116 1HA GLY 116 -23.074 0.812 -3.986 844 HA3 GLY 116 2HA GLY 116 -24.177 1.493 -2.792 845 H LYS 117 H LYS 117 -21.112 2.664 -4.384 846 HA LYS 117 HA LYS 117 -22.575 5.103 -5.191 847 HB2 LYS 117 1HB LYS 117 -20.523 4.893 -2.994 848 HB3 LYS 117 2HB LYS 117 -20.338 6.263 -4.067 849 HG2 LYS 117 1HG LYS 117 -22.942 5.633 -2.627 850 HG3 LYS 117 2HG LYS 117 -21.692 6.699 -2.001 851 HD2 LYS 117 1HD LYS 117 -21.911 8.153 -4.033 852 HD3 LYS 117 2HD LYS 117 -23.224 7.097 -4.607 853 HE2 LYS 117 1HE LYS 117 -24.371 7.505 -2.382 854 HE3 LYS 117 2HE LYS 117 -23.177 8.778 -2.068 855 HZ1 LYS 117 3HZ LYS 117 -24.059 9.995 -3.954 856 HZ2 LYS 117 1HZ LYS 117 -25.340 9.461 -3.058 857 HZ3 LYS 117 2HZ LYS 117 -24.967 8.697 -4.427 858 H GLU 118 H GLU 118 -21.289 6.589 -6.409 859 HA GLU 118 HA GLU 118 -19.630 5.721 -8.492 860 HB2 GLU 118 1HB GLU 118 -19.027 8.084 -8.657 861 HB3 GLU 118 2HB GLU 118 -20.754 7.840 -8.451 862 HG2 GLU 118 1HG GLU 118 -20.230 8.263 -5.871 863 HG3 GLU 118 2HG GLU 118 -18.722 8.920 -6.499 864 H ILE 119 H ILE 119 -17.381 5.717 -8.757 865 HA ILE 119 HA ILE 119 -15.548 6.198 -6.658 866 HB ILE 119 HB ILE 119 -14.373 4.122 -6.761 867 HG12 ILE 119 1HG1 ILE 119 -15.905 2.116 -7.682 868 HG13 ILE 119 2HG1 ILE 119 -16.420 3.347 -8.822 869 HG21 ILE 119 1HG2 ILE 119 -15.752 2.719 -5.396 870 HG22 ILE 119 2HG2 ILE 119 -16.078 4.409 -5.000 871 HG23 ILE 119 3HG2 ILE 119 -17.241 3.495 -5.985 872 HD11 ILE 119 3HD1 ILE 119 -13.522 2.568 -8.286 873 HD12 ILE 119 1HD1 ILE 119 -14.499 2.013 -9.664 874 HD13 ILE 119 2HD1 ILE 119 -14.086 3.722 -9.508 875 H SER 120 H SER 120 -13.283 6.114 -7.822 876 HA SER 120 HA SER 120 -13.535 6.131 -10.745 877 HB2 SER 120 1HB SER 120 -12.527 8.347 -8.978 878 HB3 SER 120 2HB SER 120 -11.726 8.048 -10.540 879 HG SER 120 HG SER 120 -13.389 9.601 -10.673 880 H THR 121 H THR 121 -11.658 5.350 -11.719 881 HA THR 121 HA THR 121 -9.735 3.888 -10.096 882 HB THR 121 HB THR 121 -8.861 3.692 -12.644 883 HG1 THR 121 1HG THR 121 -10.323 3.975 -14.098 884 HG21 THR 121 3HG2 THR 121 -11.311 2.231 -11.557 885 HG22 THR 121 1HG2 THR 121 -9.609 1.818 -11.216 886 HG23 THR 121 2HG2 THR 121 -10.238 1.664 -12.860 887 H ASP 122 H ASP 122 -9.499 6.133 -9.015 888 HA ASP 122 HA ASP 122 -7.049 7.352 -10.050 889 HB2 ASP 122 1HB ASP 122 -7.829 9.601 -9.892 890 HB3 ASP 122 2HB ASP 122 -8.938 8.720 -10.937 891 H ASP 123 H ASP 123 -8.492 5.905 -7.522 892 HA ASP 123 HA ASP 123 -8.412 7.751 -5.440 893 HB2 ASP 123 1HB ASP 123 -9.571 5.429 -5.582 894 HB3 ASP 123 2HB ASP 123 -8.038 4.753 -5.076 895 H LEU 124 H LEU 124 -5.844 5.541 -6.567 896 HA LEU 124 HA LEU 124 -4.094 6.554 -4.393 897 HB2 LEU 124 1HB LEU 124 -5.110 3.976 -4.605 898 HB3 LEU 124 2HB LEU 124 -3.555 3.840 -5.397 899 HG LEU 124 HG LEU 124 -4.258 4.350 -2.547 900 HD11 LEU 124 1HD1 LEU 124 -2.608 2.643 -2.178 901 HD12 LEU 124 2HD1 LEU 124 -2.007 2.796 -3.847 902 HD13 LEU 124 3HD1 LEU 124 -3.625 2.162 -3.553 903 HD21 LEU 124 3HD2 LEU 124 -2.859 6.292 -2.727 904 HD22 LEU 124 1HD2 LEU 124 -1.656 5.405 -3.690 905 HD23 LEU 124 2HD2 LEU 124 -1.922 5.026 -1.978 906 H ASN 125 H ASN 125 -2.611 7.798 -5.319 907 HA ASN 125 HA ASN 125 -1.277 6.927 -7.846 908 HB2 ASN 125 1HB ASN 125 -3.209 8.627 -8.098 909 HB3 ASN 125 2HB ASN 125 -2.155 9.790 -7.315 910 HD21 ASN 125 1HD2 ASN 125 -2.777 7.903 -10.179 911 HD22 ASN 125 2HD2 ASN 125 -1.550 8.657 -11.204 912 H LEU 126 H LEU 126 0.003 6.312 -5.614 913 HA LEU 126 HA LEU 126 1.857 8.581 -4.938 914 HB2 LEU 126 1HB LEU 126 1.383 5.967 -3.522 915 HB3 LEU 126 2HB LEU 126 2.558 7.181 -3.036 916 HG LEU 126 HG LEU 126 -0.479 7.502 -3.000 917 HD11 LEU 126 1HD1 LEU 126 1.571 7.075 -0.778 918 HD12 LEU 126 2HD1 LEU 126 0.349 5.914 -1.332 919 HD13 LEU 126 3HD1 LEU 126 -0.165 7.407 -0.535 920 HD21 LEU 126 3HD2 LEU 126 0.472 9.699 -3.314 921 HD22 LEU 126 1HD2 LEU 126 1.702 9.414 -2.062 922 HD23 LEU 126 2HD2 LEU 126 -0.015 9.558 -1.619 923 H TYR 127 H TYR 127 4.083 8.267 -5.227 924 HA TYR 127 HA TYR 127 5.232 5.785 -6.174 925 HB2 TYR 127 1HB TYR 127 4.422 6.469 -8.323 926 HB3 TYR 127 2HB TYR 127 4.810 8.153 -8.028 927 HD1 TYR 127 2HD TYR 127 6.390 4.778 -8.492 928 HD2 TYR 127 1HD TYR 127 6.898 9.055 -8.743 929 HE1 TYR 127 2HE TYR 127 8.587 4.444 -9.554 930 HE2 TYR 127 1HE TYR 127 9.097 8.731 -9.818 931 HH TYR 127 HH TYR 127 10.424 5.447 -10.498 932 H TYR 128 H TYR 128 7.566 5.896 -5.961 933 HA TYR 128 HA TYR 128 8.775 8.445 -5.164 934 HB2 TYR 128 1HB TYR 128 8.452 5.978 -3.419 935 HB3 TYR 128 2HB TYR 128 9.885 6.960 -3.272 936 HD1 TYR 128 1HD TYR 128 9.379 9.636 -3.205 937 HD2 TYR 128 2HD TYR 128 6.809 6.472 -1.818 938 HE1 TYR 128 1HE TYR 128 8.302 11.227 -1.657 939 HE2 TYR 128 2HE TYR 128 5.667 8.098 -0.276 940 HH TYR 128 HH TYR 128 5.355 10.718 -0.077 941 H ASN 129 H ASN 129 11.085 8.382 -5.379 942 HA ASN 129 HA ASN 129 12.356 5.947 -6.218 943 HB2 ASN 129 1HB ASN 129 13.629 6.881 -7.997 944 HB3 ASN 129 2HB ASN 129 11.930 6.978 -8.424 945 HD21 ASN 129 1HD2 ASN 129 10.898 9.130 -8.107 946 HD22 ASN 129 2HD2 ASN 129 11.877 10.520 -8.539 Start of MODEL 10 1 H1 GLY 1 H GLY 1 30.651 -15.470 6.194 2 HA2 GLY 1 1HA GLY 1 30.664 -14.722 8.563 3 HA3 GLY 1 2HA GLY 1 32.390 -15.161 8.582 4 H ASP 2 H ASP 2 29.945 -12.910 7.409 5 HA ASP 2 HA ASP 2 31.490 -10.800 6.378 6 HB2 ASP 2 1HB ASP 2 30.864 -11.254 4.016 7 HB3 ASP 2 2HB ASP 2 32.031 -12.435 4.586 8 H ASP 3 H ASP 3 29.868 -9.165 6.006 9 HA ASP 3 HA ASP 3 27.093 -9.963 5.688 10 HB2 ASP 3 1HB ASP 3 26.169 -9.117 7.561 11 HB3 ASP 3 2HB ASP 3 27.654 -9.749 8.247 12 H ASP 4 H ASP 4 29.339 -8.431 4.258 13 HA ASP 4 HA ASP 4 28.570 -5.655 4.180 14 HB2 ASP 4 1HB ASP 4 30.846 -6.813 3.621 15 HB3 ASP 4 2HB ASP 4 30.137 -7.115 2.037 16 H GLU 5 H GLU 5 27.821 -4.624 2.149 17 HA GLU 5 HA GLU 5 26.219 -6.114 0.261 18 HB2 GLU 5 1HB GLU 5 24.855 -6.260 2.436 19 HB3 GLU 5 2HB GLU 5 24.695 -4.516 2.367 20 HG2 GLU 5 1HG GLU 5 22.715 -5.311 1.485 21 HG3 GLU 5 2HG GLU 5 23.609 -4.876 0.038 22 HA PRO 6 HA PRO 6 27.416 -1.619 -0.456 23 HB2 PRO 6 1HB PRO 6 29.355 -1.778 -2.350 24 HB3 PRO 6 2HB PRO 6 29.674 -2.115 -0.618 25 HG2 PRO 6 1HG PRO 6 29.139 -4.109 -2.837 26 HG3 PRO 6 2HG PRO 6 30.438 -4.145 -1.602 27 HD2 PRO 6 1HD PRO 6 28.061 -5.534 -1.350 28 HD3 PRO 6 2HD PRO 6 28.979 -4.906 0.050 29 H GLY 7 H GLY 7 26.591 -0.207 -2.047 30 HA2 GLY 7 1HA GLY 7 25.894 -1.130 -4.725 31 HA3 GLY 7 2HA GLY 7 24.497 -0.904 -3.661 32 H GLY 8 H GLY 8 24.178 1.299 -2.679 33 HA2 GLY 8 1HA GLY 8 25.737 3.514 -3.550 34 HA3 GLY 8 2HA GLY 8 24.351 3.272 -4.636 35 H LYS 9 H LYS 9 23.419 5.258 -4.021 36 HA LYS 9 HA LYS 9 22.401 5.424 -1.241 37 HB2 LYS 9 1HB LYS 9 22.934 7.867 -1.395 38 HB3 LYS 9 2HB LYS 9 24.261 6.726 -1.164 39 HG2 LYS 9 1HG LYS 9 24.893 6.977 -3.565 40 HG3 LYS 9 2HG LYS 9 23.547 8.107 -3.791 41 HD2 LYS 9 1HD LYS 9 25.641 9.300 -3.487 42 HD3 LYS 9 2HD LYS 9 24.539 9.646 -2.155 43 HE2 LYS 9 1HE LYS 9 25.749 8.191 -0.650 44 HE3 LYS 9 2HE LYS 9 26.695 7.497 -1.983 45 HZ1 LYS 9 3HZ LYS 9 27.786 9.548 -2.271 46 HZ2 LYS 9 1HZ LYS 9 27.911 9.165 -0.676 47 HZ3 LYS 9 2HZ LYS 9 26.834 10.326 -1.165 48 H GLY 10 H GLY 10 20.357 5.515 -1.219 49 HA2 GLY 10 1HA GLY 10 18.856 7.396 -2.715 50 HA3 GLY 10 2HA GLY 10 18.347 5.725 -3.059 51 H ALA 11 H ALA 11 16.643 5.093 -1.613 52 HA ALA 11 HA ALA 11 16.816 6.019 1.164 53 HB1 ALA 11 1HB ALA 11 15.577 7.814 0.024 54 HB2 ALA 11 2HB ALA 11 14.486 6.613 -0.699 55 HB3 ALA 11 3HB ALA 11 14.482 6.859 1.051 56 H MET 12 H MET 12 15.787 4.684 2.572 57 HA MET 12 HA MET 12 14.526 2.169 1.750 58 HB2 MET 12 1HB MET 12 14.332 3.806 4.330 59 HB3 MET 12 2HB MET 12 13.717 2.181 4.082 60 HG2 MET 12 1HG MET 12 16.272 1.765 3.336 61 HG3 MET 12 2HG MET 12 16.545 3.149 4.387 62 HE1 MET 12 3HE MET 12 15.028 -1.048 5.598 63 HE2 MET 12 1HE MET 12 14.045 -0.002 4.565 64 HE3 MET 12 2HE MET 12 15.627 -0.569 3.998 65 H TYR 13 H TYR 13 12.270 1.906 1.577 66 HA TYR 13 HA TYR 13 10.550 4.179 2.203 67 HB2 TYR 13 1HB TYR 13 10.191 2.587 -0.354 68 HB3 TYR 13 2HB TYR 13 9.119 3.821 0.288 69 HD1 TYR 13 1HD TYR 13 12.376 3.218 -1.329 70 HD2 TYR 13 2HD TYR 13 9.530 6.191 -0.073 71 HE1 TYR 13 1HE TYR 13 13.518 4.880 -2.742 72 HE2 TYR 13 2HE TYR 13 10.631 7.864 -1.534 73 HH TYR 13 HH TYR 13 13.248 7.046 -3.794 74 H GLU 14 H GLU 14 8.567 3.473 3.001 75 HA GLU 14 HA GLU 14 7.998 0.588 3.287 76 HB2 GLU 14 1HB GLU 14 9.264 1.038 5.245 77 HB3 GLU 14 2HB GLU 14 8.531 2.620 5.460 78 HG2 GLU 14 1HG GLU 14 6.316 1.409 5.966 79 HG3 GLU 14 2HG GLU 14 7.252 -0.093 5.988 80 H VAL 15 H VAL 15 5.994 0.514 2.370 81 HA VAL 15 HA VAL 15 4.108 2.739 2.848 82 HB VAL 15 HB VAL 15 4.229 2.070 0.518 83 HG11 VAL 15 1HG1 VAL 15 4.882 -0.321 0.768 84 HG12 VAL 15 2HG1 VAL 15 3.265 -0.684 1.412 85 HG13 VAL 15 3HG1 VAL 15 3.461 -0.131 -0.261 86 HG21 VAL 15 3HG2 VAL 15 1.856 1.681 0.090 87 HG22 VAL 15 1HG2 VAL 15 1.591 1.209 1.768 88 HG23 VAL 15 2HG2 VAL 15 2.082 2.874 1.379 89 H THR 16 H THR 16 2.243 2.409 4.037 90 HA THR 16 HA THR 16 1.817 -0.229 5.281 91 HB THR 16 HB THR 16 0.855 1.339 7.229 92 HG1 THR 16 1HG THR 16 3.133 2.753 6.303 93 HG21 THR 16 3HG2 THR 16 3.819 0.664 6.989 94 HG22 THR 16 1HG2 THR 16 2.536 -0.440 7.530 95 HG23 THR 16 2HG2 THR 16 2.931 0.992 8.493 96 H ILE 17 H ILE 17 -0.427 -0.648 5.660 97 HA ILE 17 HA ILE 17 -2.341 1.328 4.707 98 HB ILE 17 HB ILE 17 -1.925 -0.161 2.801 99 HG12 ILE 17 1HG1 ILE 17 -4.132 -0.988 2.290 100 HG13 ILE 17 2HG1 ILE 17 -4.611 -0.938 3.993 101 HG21 ILE 17 1HG2 ILE 17 -2.387 -2.531 2.815 102 HG22 ILE 17 2HG2 ILE 17 -1.156 -2.160 4.020 103 HG23 ILE 17 3HG2 ILE 17 -2.826 -2.470 4.540 104 HD11 ILE 17 3HD1 ILE 17 -3.670 1.591 2.673 105 HD12 ILE 17 1HD1 ILE 17 -5.290 0.964 2.330 106 HD13 ILE 17 2HD1 ILE 17 -4.847 1.344 3.998 107 H GLU 18 H GLU 18 -4.141 1.299 6.032 108 HA GLU 18 HA GLU 18 -4.529 -0.903 8.015 109 HB2 GLU 18 1HB GLU 18 -4.538 2.096 8.419 110 HB3 GLU 18 2HB GLU 18 -5.473 1.052 9.471 111 HG2 GLU 18 1HG GLU 18 -2.523 0.461 8.991 112 HG3 GLU 18 2HG GLU 18 -2.983 1.736 10.073 113 H GLN 19 H GLN 19 -6.106 -1.905 6.967 114 HA GLN 19 HA GLN 19 -8.289 -0.487 5.582 115 HB2 GLN 19 1HB GLN 19 -7.887 -3.495 5.951 116 HB3 GLN 19 2HB GLN 19 -8.965 -2.652 4.838 117 HG2 GLN 19 1HG GLN 19 -6.799 -1.655 3.811 118 HG3 GLN 19 2HG GLN 19 -5.948 -2.922 4.700 119 HE21 GLN 19 1HE2 GLN 19 -6.175 -5.120 3.976 120 HE22 GLN 19 2HE2 GLN 19 -6.922 -5.549 2.479 121 H SER 20 H SER 20 -10.164 -0.058 6.733 122 HA SER 20 HA SER 20 -10.998 -1.926 8.792 123 HB2 SER 20 1HB SER 20 -9.442 -0.403 9.977 124 HB3 SER 20 2HB SER 20 -10.408 0.988 9.459 125 HG SER 20 HG SER 20 -10.721 0.076 11.612 126 H GLY 21 H GLY 21 -13.066 -1.268 9.646 127 HA2 GLY 21 1HA GLY 21 -15.319 -0.991 9.204 128 HA3 GLY 21 2HA GLY 21 -14.952 0.087 7.855 129 H ASP 22 H ASP 22 -16.444 -1.195 6.491 130 HA ASP 22 HA ASP 22 -16.171 -4.059 6.354 131 HB2 ASP 22 1HB ASP 22 -18.326 -2.834 6.169 132 HB3 ASP 22 2HB ASP 22 -17.816 -2.233 4.580 133 H PHE 23 H PHE 23 -13.710 -3.431 5.685 134 HA PHE 23 HA PHE 23 -13.181 -2.803 2.964 135 HB2 PHE 23 1HB PHE 23 -10.885 -3.434 3.453 136 HB3 PHE 23 2HB PHE 23 -11.559 -2.491 4.770 137 HD1 PHE 23 1HD PHE 23 -10.741 -6.014 3.722 138 HD2 PHE 23 2HD PHE 23 -11.545 -3.348 7.014 139 HE1 PHE 23 1HE PHE 23 -10.158 -7.808 5.328 140 HE2 PHE 23 2HE PHE 23 -10.910 -5.124 8.606 141 HZ PHE 23 HZ PHE 23 -10.212 -7.366 7.767 142 H ARG 24 H ARG 24 -14.560 -5.666 4.004 143 HA ARG 24 HA ARG 24 -13.013 -7.668 2.680 144 HB2 ARG 24 1HB ARG 24 -16.029 -7.749 3.138 145 HB3 ARG 24 2HB ARG 24 -14.966 -9.090 2.778 146 HG2 ARG 24 1HG ARG 24 -14.958 -9.450 4.972 147 HG3 ARG 24 2HG ARG 24 -13.764 -8.149 5.070 148 HD2 ARG 24 1HD ARG 24 -15.584 -6.520 5.485 149 HD3 ARG 24 2HD ARG 24 -16.799 -7.797 5.275 150 HE ARG 24 HE ARG 24 -15.238 -8.773 7.275 151 HH11 ARG 24 1HH1 ARG 24 -17.355 -5.942 6.782 152 HH12 ARG 24 2HH1 ARG 24 -17.384 -5.492 8.470 153 HH21 ARG 24 1HH2 ARG 24 -15.504 -8.312 9.541 154 HH22 ARG 24 2HH2 ARG 24 -16.556 -7.020 10.047 155 H SER 25 H SER 25 -16.095 -6.148 1.617 156 HA SER 25 HA SER 25 -16.037 -7.417 -0.922 157 HB2 SER 25 1HB SER 25 -17.865 -5.244 0.181 158 HB3 SER 25 2HB SER 25 -18.212 -6.370 -1.151 159 HG SER 25 HG SER 25 -19.083 -7.147 0.786 160 H PHE 26 H PHE 26 -13.730 -5.570 -0.622 161 HA PHE 26 HA PHE 26 -14.399 -3.549 -2.702 162 HB2 PHE 26 1HB PHE 26 -12.860 -3.286 -0.104 163 HB3 PHE 26 2HB PHE 26 -12.587 -2.206 -1.449 164 HD1 PHE 26 1HD PHE 26 -15.297 -3.493 0.810 165 HD2 PHE 26 2HD PHE 26 -14.054 -0.353 -1.880 166 HE1 PHE 26 1HE PHE 26 -17.347 -2.248 1.326 167 HE2 PHE 26 2HE PHE 26 -16.068 0.933 -1.291 168 HZ PHE 26 HZ PHE 26 -17.752 -0.021 0.278 169 H ILE 27 H ILE 27 -13.194 -3.867 -4.524 170 HA ILE 27 HA ILE 27 -11.183 -5.924 -4.534 171 HB ILE 27 HB ILE 27 -11.619 -3.859 -6.706 172 HG12 ILE 27 1HG1 ILE 27 -13.770 -4.972 -6.169 173 HG13 ILE 27 2HG1 ILE 27 -13.197 -5.224 -7.789 174 HG21 ILE 27 1HG2 ILE 27 -10.377 -6.655 -6.720 175 HG22 ILE 27 2HG2 ILE 27 -10.619 -5.636 -8.154 176 HG23 ILE 27 3HG2 ILE 27 -9.509 -5.134 -6.902 177 HD11 ILE 27 3HD1 ILE 27 -12.849 -7.254 -5.550 178 HD12 ILE 27 1HD1 ILE 27 -14.151 -7.282 -6.762 179 HD13 ILE 27 2HD1 ILE 27 -12.470 -7.499 -7.270 180 H LYS 28 H LYS 28 -9.490 -5.508 -3.208 181 HA LYS 28 HA LYS 28 -8.101 -2.970 -3.104 182 HB2 LYS 28 1HB LYS 28 -6.982 -5.638 -2.194 183 HB3 LYS 28 2HB LYS 28 -6.628 -4.026 -1.592 184 HG2 LYS 28 1HG LYS 28 -7.924 -4.667 0.129 185 HG3 LYS 28 2HG LYS 28 -9.238 -4.106 -0.911 186 HD2 LYS 28 1HD LYS 28 -9.330 -6.540 -1.775 187 HD3 LYS 28 2HD LYS 28 -8.222 -6.960 -0.464 188 HE2 LYS 28 1HE LYS 28 -9.917 -6.089 1.180 189 HE3 LYS 28 2HE LYS 28 -10.987 -5.700 -0.156 190 HZ1 LYS 28 3HZ LYS 28 -11.744 -7.736 0.338 191 HZ2 LYS 28 1HZ LYS 28 -10.288 -8.291 0.913 192 HZ3 LYS 28 2HZ LYS 28 -10.580 -8.206 -0.721 193 H SER 29 H SER 29 -6.451 -2.221 -4.504 194 HA SER 29 HA SER 29 -4.687 -4.240 -5.742 195 HB2 SER 29 1HB SER 29 -5.935 -1.756 -7.018 196 HB3 SER 29 2HB SER 29 -4.628 -2.709 -7.707 197 HG SER 29 HG SER 29 -6.529 -3.339 -8.629 198 H VAL 30 H VAL 30 -2.544 -3.699 -5.276 199 HA VAL 30 HA VAL 30 -1.854 -0.829 -5.169 200 HB VAL 30 HB VAL 30 -0.820 -2.846 -3.179 201 HG11 VAL 30 1HG1 VAL 30 1.014 -1.408 -3.792 202 HG12 VAL 30 2HG1 VAL 30 -0.004 0.043 -3.646 203 HG13 VAL 30 3HG1 VAL 30 0.435 -0.910 -2.208 204 HG21 VAL 30 3HG2 VAL 30 -2.407 -0.270 -2.725 205 HG22 VAL 30 1HG2 VAL 30 -3.053 -1.904 -2.528 206 HG23 VAL 30 2HG2 VAL 30 -1.775 -1.341 -1.456 207 H VAL 31 H VAL 31 -0.609 -0.598 -6.954 208 HA VAL 31 HA VAL 31 1.364 -2.628 -7.766 209 HB VAL 31 HB VAL 31 0.334 -1.124 -9.438 210 HG11 VAL 31 1HG1 VAL 31 1.849 1.164 -8.123 211 HG12 VAL 31 2HG1 VAL 31 0.934 1.220 -9.642 212 HG13 VAL 31 3HG1 VAL 31 0.092 0.903 -8.127 213 HG21 VAL 31 3HG2 VAL 31 2.387 -0.339 -10.597 214 HG22 VAL 31 1HG2 VAL 31 3.334 -0.746 -9.155 215 HG23 VAL 31 2HG2 VAL 31 2.458 -2.000 -10.066 216 H VAL 32 H VAL 32 3.398 -2.806 -6.878 217 HA VAL 32 HA VAL 32 4.482 -0.595 -5.289 218 HB VAL 32 HB VAL 32 3.662 -1.935 -3.625 219 HG11 VAL 32 1HG1 VAL 32 4.007 -4.403 -3.472 220 HG12 VAL 32 2HG1 VAL 32 2.960 -3.907 -4.804 221 HG13 VAL 32 3HG1 VAL 32 4.652 -4.347 -5.129 222 HG21 VAL 32 3HG2 VAL 32 6.151 -1.442 -3.358 223 HG22 VAL 32 1HG2 VAL 32 5.558 -2.834 -2.446 224 HG23 VAL 32 2HG2 VAL 32 6.472 -3.078 -3.947 225 H VAL 33 H VAL 33 6.773 -0.407 -5.431 226 HA VAL 33 HA VAL 33 8.125 -1.959 -7.546 227 HB VAL 33 HB VAL 33 7.829 1.078 -7.563 228 HG11 VAL 33 1HG1 VAL 33 9.976 0.434 -8.548 229 HG12 VAL 33 2HG1 VAL 33 9.191 -0.793 -9.565 230 HG13 VAL 33 3HG1 VAL 33 8.890 0.929 -9.822 231 HG21 VAL 33 3HG2 VAL 33 6.582 -0.946 -9.482 232 HG22 VAL 33 1HG2 VAL 33 5.700 0.036 -8.305 233 HG23 VAL 33 2HG2 VAL 33 6.527 0.814 -9.642 234 H ALA 34 H ALA 34 10.530 -1.491 -7.491 235 HA ALA 34 HA ALA 34 11.568 0.151 -5.426 236 HB1 ALA 34 1HB ALA 34 11.194 -1.943 -4.078 237 HB2 ALA 34 2HB ALA 34 12.146 -2.859 -5.271 238 HB3 ALA 34 3HB ALA 34 12.916 -1.603 -4.288 239 H ASN 35 H ASN 35 13.741 0.514 -5.768 240 HA ASN 35 HA ASN 35 14.893 -0.466 -8.348 241 HB2 ASN 35 1HB ASN 35 14.292 1.998 -8.139 242 HB3 ASN 35 2HB ASN 35 15.540 2.141 -6.990 243 HD21 ASN 35 1HD2 ASN 35 14.688 2.762 -9.916 244 HD22 ASN 35 2HD2 ASN 35 16.251 2.801 -10.730 245 H GLY 36 H GLY 36 15.954 -2.157 -7.384 246 HA2 GLY 36 1HA GLY 36 18.462 -2.565 -7.350 247 HA3 GLY 36 2HA GLY 36 18.479 -1.430 -5.984 248 H THR 37 H THR 37 17.088 -1.879 -4.271 249 HA THR 37 HA THR 37 17.569 -4.531 -3.215 250 HB THR 37 HB THR 37 17.789 -2.257 -2.061 251 HG1 THR 37 1HG THR 37 18.003 -4.117 -0.892 252 HG21 THR 37 3HG2 THR 37 15.823 -1.447 -0.838 253 HG22 THR 37 1HG2 THR 37 14.820 -2.721 -1.527 254 HG23 THR 37 2HG2 THR 37 15.487 -1.470 -2.593 255 H GLN 38 H GLN 38 15.653 -5.395 -1.712 256 HA GLN 38 HA GLN 38 13.393 -5.924 -3.575 257 HB2 GLN 38 1HB GLN 38 15.003 -7.710 -1.766 258 HB3 GLN 38 2HB GLN 38 13.398 -8.147 -2.322 259 HG2 GLN 38 1HG GLN 38 13.999 -8.583 -4.434 260 HG3 GLN 38 2HG GLN 38 15.084 -7.202 -4.546 261 HE21 GLN 38 1HE2 GLN 38 15.547 -9.971 -5.542 262 HE22 GLN 38 2HE2 GLN 38 17.130 -10.293 -4.867 263 H LEU 39 H LEU 39 11.595 -7.022 -2.287 264 HA LEU 39 HA LEU 39 10.745 -5.076 -0.192 265 HB2 LEU 39 1HB LEU 39 9.420 -6.429 -2.495 266 HB3 LEU 39 2HB LEU 39 8.480 -6.459 -1.039 267 HG LEU 39 HG LEU 39 8.099 -4.578 -2.739 268 HD11 LEU 39 1HD1 LEU 39 7.536 -2.974 -0.946 269 HD12 LEU 39 2HD1 LEU 39 8.486 -3.939 0.206 270 HD13 LEU 39 3HD1 LEU 39 7.052 -4.640 -0.589 271 HD21 LEU 39 3HD2 LEU 39 9.398 -2.587 -2.601 272 HD22 LEU 39 1HD2 LEU 39 10.524 -3.923 -2.929 273 HD23 LEU 39 2HD2 LEU 39 10.399 -3.229 -1.287 274 H LYS 40 H LYS 40 9.497 -5.966 1.505 275 HA LYS 40 HA LYS 40 9.745 -8.929 1.957 276 HB2 LYS 40 1HB LYS 40 11.462 -7.576 3.123 277 HB3 LYS 40 2HB LYS 40 10.186 -6.689 3.963 278 HG2 LYS 40 1HG LYS 40 9.415 -8.793 5.007 279 HG3 LYS 40 2HG LYS 40 10.720 -9.689 4.186 280 HD2 LYS 40 1HD LYS 40 12.418 -8.356 5.364 281 HD3 LYS 40 2HD LYS 40 11.158 -7.303 6.034 282 HE2 LYS 40 1HE LYS 40 10.167 -9.545 6.991 283 HE3 LYS 40 2HE LYS 40 11.806 -10.174 6.710 284 HZ1 LYS 40 3HZ LYS 40 11.052 -7.834 8.337 285 HZ2 LYS 40 1HZ LYS 40 12.613 -8.360 8.123 286 HZ3 LYS 40 2HZ LYS 40 11.536 -9.307 8.937 287 H ASP 41 H ASP 41 7.833 -9.845 2.384 288 HA ASP 41 HA ASP 41 5.483 -8.157 2.807 289 HB2 ASP 41 1HB ASP 41 5.449 -10.439 1.587 290 HB3 ASP 41 2HB ASP 41 5.380 -11.139 3.207 291 H GLY 42 H GLY 42 4.672 -7.520 4.756 292 HA2 GLY 42 1HA GLY 42 6.065 -8.172 7.201 293 HA3 GLY 42 2HA GLY 42 4.654 -7.134 7.006 294 H ALA 43 H ALA 43 3.870 -10.154 5.577 295 HA ALA 43 HA ALA 43 2.320 -11.085 7.854 296 HB1 ALA 43 1HB ALA 43 2.954 -12.277 5.107 297 HB2 ALA 43 2HB ALA 43 1.917 -13.049 6.316 298 HB3 ALA 43 3HB ALA 43 1.454 -11.487 5.642 299 H THR 44 H THR 44 4.997 -12.544 5.956 300 HA THR 44 HA THR 44 5.935 -13.986 8.388 301 HB THR 44 HB THR 44 6.396 -15.789 6.349 302 HG1 THR 44 1HG THR 44 5.189 -15.139 4.765 303 HG21 THR 44 3HG2 THR 44 3.860 -15.533 8.025 304 HG22 THR 44 1HG2 THR 44 5.408 -16.197 8.601 305 HG23 THR 44 2HG2 THR 44 4.527 -17.028 7.316 306 H GLY 45 H GLY 45 6.871 -11.599 6.438 307 HA2 GLY 45 1HA GLY 45 8.900 -10.756 5.924 308 HA3 GLY 45 2HA GLY 45 9.663 -12.008 6.934 309 H GLU 46 H GLU 46 7.488 -12.545 4.165 310 HA GLU 46 HA GLU 46 9.333 -14.398 2.877 311 HB2 GLU 46 1HB GLU 46 6.714 -13.118 1.979 312 HB3 GLU 46 2HB GLU 46 7.589 -14.342 1.072 313 HG2 GLU 46 1HG GLU 46 7.080 -15.180 3.874 314 HG3 GLU 46 2HG GLU 46 5.601 -14.745 3.071 315 H SER 47 H SER 47 10.945 -13.770 1.467 316 HA SER 47 HA SER 47 11.343 -10.905 1.185 317 HB2 SER 47 1HB SER 47 13.328 -12.784 0.114 318 HB3 SER 47 2HB SER 47 13.553 -11.399 1.147 319 HG SER 47 HG SER 47 13.594 -13.905 1.874 320 H LEU 48 H LEU 48 10.459 -9.984 -0.480 321 HA LEU 48 HA LEU 48 9.468 -11.571 -2.775 322 HB2 LEU 48 1HB LEU 48 8.858 -8.704 -1.976 323 HB3 LEU 48 2HB LEU 48 7.992 -9.658 -3.179 324 HG LEU 48 HG LEU 48 8.047 -10.169 -0.180 325 HD11 LEU 48 1HD1 LEU 48 6.723 -8.250 -0.727 326 HD12 LEU 48 2HD1 LEU 48 5.601 -9.590 -0.431 327 HD13 LEU 48 3HD1 LEU 48 5.967 -9.108 -2.086 328 HD21 LEU 48 3HD2 LEU 48 7.871 -12.331 -1.352 329 HD22 LEU 48 1HD2 LEU 48 6.566 -11.685 -2.384 330 HD23 LEU 48 2HD2 LEU 48 6.317 -11.895 -0.642 331 H ALA 49 H ALA 49 9.223 -9.888 -4.849 332 HA ALA 49 HA ALA 49 11.837 -8.620 -5.430 333 HB1 ALA 49 1HB ALA 49 11.879 -9.830 -7.597 334 HB2 ALA 49 2HB ALA 49 12.013 -10.943 -6.220 335 HB3 ALA 49 3HB ALA 49 10.472 -10.785 -7.089 336 H SER 50 H SER 50 11.193 -6.539 -5.943 337 HA SER 50 HA SER 50 8.517 -6.090 -7.086 338 HB2 SER 50 1HB SER 50 10.558 -4.477 -5.642 339 HB3 SER 50 2HB SER 50 9.819 -3.666 -7.018 340 HG SER 50 HG SER 50 8.491 -4.849 -4.808 341 HA PRO 51 HA PRO 51 7.890 -3.946 -8.276 342 HB2 PRO 51 1HB PRO 51 6.641 -3.644 -10.697 343 HB3 PRO 51 2HB PRO 51 7.950 -2.584 -10.111 344 HG2 PRO 51 1HG PRO 51 8.141 -4.930 -11.978 345 HG3 PRO 51 2HG PRO 51 8.845 -3.295 -12.186 346 HD2 PRO 51 1HD PRO 51 10.334 -5.344 -11.228 347 HD3 PRO 51 2HD PRO 51 10.514 -3.705 -10.558 348 H VAL 52 H VAL 52 5.895 -4.753 -7.664 349 HA VAL 52 HA VAL 52 4.787 -7.153 -8.857 350 HB VAL 52 HB VAL 52 6.437 -7.901 -7.245 351 HG11 VAL 52 1HG1 VAL 52 6.378 -5.989 -5.676 352 HG12 VAL 52 2HG1 VAL 52 4.812 -6.585 -5.073 353 HG13 VAL 52 3HG1 VAL 52 6.270 -7.565 -4.869 354 HG21 VAL 52 3HG2 VAL 52 3.643 -8.462 -6.154 355 HG22 VAL 52 1HG2 VAL 52 4.363 -9.271 -7.571 356 HG23 VAL 52 2HG2 VAL 52 5.081 -9.472 -5.964 357 H ILE 53 H ILE 53 2.632 -7.696 -7.862 358 HA ILE 53 HA ILE 53 1.128 -5.216 -7.212 359 HB ILE 53 HB ILE 53 0.284 -7.610 -8.912 360 HG12 ILE 53 1HG1 ILE 53 1.772 -6.323 -10.274 361 HG13 ILE 53 2HG1 ILE 53 0.131 -6.006 -10.800 362 HG21 ILE 53 1HG2 ILE 53 -1.645 -6.789 -7.751 363 HG22 ILE 53 2HG2 ILE 53 -1.247 -5.100 -8.107 364 HG23 ILE 53 3HG2 ILE 53 -1.748 -6.212 -9.406 365 HD11 ILE 53 3HD1 ILE 53 1.988 -4.225 -9.257 366 HD12 ILE 53 1HD1 ILE 53 1.192 -3.897 -10.791 367 HD13 ILE 53 2HD1 ILE 53 0.239 -3.885 -9.305 368 H LEU 54 H LEU 54 0.411 -5.302 -5.308 369 HA LEU 54 HA LEU 54 -0.326 -7.788 -3.936 370 HB2 LEU 54 1HB LEU 54 -0.906 -4.921 -3.238 371 HB3 LEU 54 2HB LEU 54 -1.274 -6.313 -2.232 372 HG LEU 54 HG LEU 54 1.519 -5.366 -3.007 373 HD11 LEU 54 1HD1 LEU 54 1.682 -4.679 -0.693 374 HD12 LEU 54 2HD1 LEU 54 0.053 -5.315 -0.340 375 HD13 LEU 54 3HD1 LEU 54 0.263 -3.904 -1.407 376 HD21 LEU 54 3HD2 LEU 54 1.384 -7.864 -2.630 377 HD22 LEU 54 1HD2 LEU 54 0.703 -7.535 -1.023 378 HD23 LEU 54 2HD2 LEU 54 2.347 -7.026 -1.409 379 H SER 55 H SER 55 -1.869 -8.813 -5.020 380 HA SER 55 HA SER 55 -4.256 -7.545 -6.104 381 HB2 SER 55 1HB SER 55 -3.660 -10.461 -5.420 382 HB3 SER 55 2HB SER 55 -4.948 -9.865 -6.481 383 HG SER 55 HG SER 55 -3.247 -10.571 -7.686 384 H ASP 56 H ASP 56 -6.396 -8.597 -5.285 385 HA ASP 56 HA ASP 56 -7.158 -7.961 -2.684 386 HB2 ASP 56 1HB ASP 56 -8.754 -8.459 -4.442 387 HB3 ASP 56 2HB ASP 56 -8.181 -10.124 -4.561 388 H GLU 57 H GLU 57 -5.559 -10.936 -3.804 389 HA GLU 57 HA GLU 57 -6.075 -12.555 -1.500 390 HB2 GLU 57 1HB GLU 57 -3.990 -12.546 -3.737 391 HB3 GLU 57 2HB GLU 57 -3.973 -13.773 -2.470 392 HG2 GLU 57 1HG GLU 57 -6.393 -13.238 -4.224 393 HG3 GLU 57 2HG GLU 57 -5.149 -14.430 -4.609 394 H GLU 58 H GLU 58 -3.649 -10.136 -2.249 395 HA GLU 58 HA GLU 58 -1.857 -11.007 -0.075 396 HB2 GLU 58 1HB GLU 58 -1.584 -8.533 -1.788 397 HB3 GLU 58 2HB GLU 58 -0.334 -9.440 -0.926 398 HG2 GLU 58 1HG GLU 58 -1.833 -10.370 -3.397 399 HG3 GLU 58 2HG GLU 58 -0.219 -9.722 -3.361 400 H LEU 59 H LEU 59 -3.888 -8.267 -1.055 401 HA LEU 59 HA LEU 59 -3.835 -6.888 1.520 402 HB2 LEU 59 1HB LEU 59 -5.303 -6.546 -1.098 403 HB3 LEU 59 2HB LEU 59 -5.597 -5.472 0.273 404 HG LEU 59 HG LEU 59 -2.749 -5.879 -0.628 405 HD11 LEU 59 1HD1 LEU 59 -4.081 -5.387 -2.710 406 HD12 LEU 59 2HD1 LEU 59 -2.842 -4.202 -2.299 407 HD13 LEU 59 3HD1 LEU 59 -4.533 -3.827 -1.976 408 HD21 LEU 59 3HD2 LEU 59 -2.476 -3.585 0.152 409 HD22 LEU 59 1HD2 LEU 59 -3.234 -4.570 1.413 410 HD23 LEU 59 2HD2 LEU 59 -4.224 -3.448 0.461 411 H ALA 60 H ALA 60 -4.928 -9.764 1.230 412 HA ALA 60 HA ALA 60 -7.718 -9.653 1.911 413 HB1 ALA 60 1HB ALA 60 -6.594 -11.572 0.870 414 HB2 ALA 60 2HB ALA 60 -5.702 -11.849 2.391 415 HB3 ALA 60 3HB ALA 60 -7.478 -11.990 2.339 416 H VAL 61 H VAL 61 -5.032 -8.699 3.684 417 HA VAL 61 HA VAL 61 -6.103 -9.397 6.361 418 HB VAL 61 HB VAL 61 -3.696 -8.602 6.975 419 HG11 VAL 61 1HG1 VAL 61 -4.042 -11.204 5.441 420 HG12 VAL 61 2HG1 VAL 61 -2.800 -10.816 6.658 421 HG13 VAL 61 3HG1 VAL 61 -4.511 -10.936 7.129 422 HG21 VAL 61 3HG2 VAL 61 -2.017 -8.601 5.372 423 HG22 VAL 61 1HG2 VAL 61 -2.940 -9.572 4.217 424 HG23 VAL 61 2HG2 VAL 61 -3.358 -7.883 4.441 425 H GLU 62 H GLU 62 -5.839 -7.773 8.034 426 HA GLU 62 HA GLU 62 -7.147 -5.323 7.297 427 HB2 GLU 62 1HB GLU 62 -6.876 -4.752 9.724 428 HB3 GLU 62 2HB GLU 62 -7.667 -6.305 9.420 429 HG2 GLU 62 1HG GLU 62 -5.646 -7.530 9.900 430 HG3 GLU 62 2HG GLU 62 -4.691 -6.059 10.004 431 H LYS 63 H LYS 63 -3.727 -6.097 7.862 432 HA LYS 63 HA LYS 63 -2.975 -3.228 7.526 433 HB2 LYS 63 1HB LYS 63 -3.304 -4.035 9.987 434 HB3 LYS 63 2HB LYS 63 -1.834 -4.968 9.749 435 HG2 LYS 63 1HG LYS 63 -2.198 -1.969 9.490 436 HG3 LYS 63 2HG LYS 63 -1.448 -2.830 10.842 437 HD2 LYS 63 1HD LYS 63 0.304 -3.577 9.029 438 HD3 LYS 63 2HD LYS 63 -0.339 -2.212 8.105 439 HE2 LYS 63 1HE LYS 63 1.016 -2.202 10.809 440 HE3 LYS 63 2HE LYS 63 1.565 -1.412 9.342 441 HZ1 LYS 63 3HZ LYS 63 -0.890 -0.610 10.826 442 HZ2 LYS 63 1HZ LYS 63 -0.173 0.228 9.610 443 HZ3 LYS 63 2HZ LYS 63 0.567 0.076 11.034 444 H VAL 64 H VAL 64 -1.291 -3.163 6.046 445 HA VAL 64 HA VAL 64 0.298 -5.660 5.754 446 HB VAL 64 HB VAL 64 -0.612 -4.233 3.258 447 HG11 VAL 64 1HG1 VAL 64 -0.204 -7.175 3.756 448 HG12 VAL 64 2HG1 VAL 64 -0.159 -6.295 2.221 449 HG13 VAL 64 3HG1 VAL 64 1.156 -6.113 3.406 450 HG21 VAL 64 3HG2 VAL 64 -2.461 -6.003 3.112 451 HG22 VAL 64 1HG2 VAL 64 -2.267 -6.175 4.867 452 HG23 VAL 64 2HG2 VAL 64 -2.801 -4.646 4.188 453 H THR 65 H THR 65 2.085 -4.742 6.743 454 HA THR 65 HA THR 65 3.228 -2.221 5.787 455 HB THR 65 HB THR 65 4.396 -4.303 7.680 456 HG1 THR 65 1HG THR 65 3.639 -3.000 9.308 457 HG21 THR 65 3HG2 THR 65 6.083 -2.739 6.794 458 HG22 THR 65 1HG2 THR 65 5.737 -2.308 8.472 459 HG23 THR 65 2HG2 THR 65 5.040 -1.353 7.145 460 H LEU 66 H LEU 66 4.380 -2.173 3.917 461 HA LEU 66 HA LEU 66 6.049 -4.546 3.171 462 HB2 LEU 66 1HB LEU 66 4.543 -2.580 1.424 463 HB3 LEU 66 2HB LEU 66 5.889 -3.482 0.841 464 HG LEU 66 HG LEU 66 3.960 -4.566 0.061 465 HD11 LEU 66 1HD1 LEU 66 4.932 -6.217 2.399 466 HD12 LEU 66 2HD1 LEU 66 5.764 -6.096 0.829 467 HD13 LEU 66 3HD1 LEU 66 4.150 -6.829 0.937 468 HD21 LEU 66 3HD2 LEU 66 2.961 -4.854 2.914 469 HD22 LEU 66 1HD2 LEU 66 2.152 -5.390 1.439 470 HD23 LEU 66 2HD2 LEU 66 2.358 -3.651 1.757 471 H SER 67 H SER 67 8.183 -4.086 2.866 472 HA SER 67 HA SER 67 9.070 -1.301 2.776 473 HB2 SER 67 1HB SER 67 8.680 -1.805 5.234 474 HB3 SER 67 2HB SER 67 9.916 -3.079 5.083 475 HG SER 67 HG SER 67 11.035 -1.266 5.730 476 H THR 68 H THR 68 11.523 -1.337 2.899 477 HA THR 68 HA THR 68 12.353 -3.145 0.707 478 HB THR 68 HB THR 68 14.220 -1.292 0.739 479 HG1 THR 68 1HG THR 68 11.959 0.067 1.841 480 HG21 THR 68 3HG2 THR 68 12.670 -1.667 -1.160 481 HG22 THR 68 1HG2 THR 68 12.775 0.077 -0.836 482 HG23 THR 68 2HG2 THR 68 11.362 -0.837 -0.295 483 H THR 69 H THR 69 14.119 -4.510 0.887 484 HA THR 69 HA THR 69 14.934 -4.996 3.493 485 HB THR 69 HB THR 69 16.631 -6.591 2.389 486 HG1 THR 69 1HG THR 69 16.409 -6.932 0.251 487 HG21 THR 69 3HG2 THR 69 13.735 -6.883 1.472 488 HG22 THR 69 1HG2 THR 69 14.318 -7.290 3.104 489 HG23 THR 69 2HG2 THR 69 14.937 -8.177 1.706 490 H GLY 70 H GLY 70 16.535 -2.943 1.186 491 HA2 GLY 70 1HA GLY 70 18.713 -2.392 3.191 492 HA3 GLY 70 2HA GLY 70 18.967 -2.533 1.463 493 H LYS 71 H LYS 71 18.481 -0.835 0.176 494 HA LYS 71 HA LYS 71 16.693 1.352 0.846 495 HB2 LYS 71 1HB LYS 71 18.275 2.975 -0.114 496 HB3 LYS 71 2HB LYS 71 18.761 2.263 1.435 497 HG2 LYS 71 1HG LYS 71 20.728 1.720 0.733 498 HG3 LYS 71 2HG LYS 71 20.076 0.721 -0.545 499 HD2 LYS 71 1HD LYS 71 20.419 3.740 -0.703 500 HD3 LYS 71 2HD LYS 71 21.599 2.564 -1.239 501 HE2 LYS 71 1HE LYS 71 18.871 3.024 -2.571 502 HE3 LYS 71 2HE LYS 71 20.430 3.405 -3.111 503 HZ1 LYS 71 3HZ LYS 71 21.052 0.996 -2.956 504 HZ2 LYS 71 1HZ LYS 71 19.980 1.308 -4.138 505 HZ3 LYS 71 2HZ LYS 71 19.477 0.648 -2.713 506 H ALA 72 H ALA 72 15.789 2.108 -1.014 507 HA ALA 72 HA ALA 72 16.325 0.695 -3.544 508 HB1 ALA 72 1HB ALA 72 13.676 1.833 -2.514 509 HB2 ALA 72 2HB ALA 72 13.928 1.159 -4.128 510 HB3 ALA 72 3HB ALA 72 14.011 0.108 -2.722 511 H ILE 73 H ILE 73 15.303 2.347 -5.216 512 HA ILE 73 HA ILE 73 16.144 5.100 -4.357 513 HB ILE 73 HB ILE 73 15.926 4.255 -7.234 514 HG12 ILE 73 1HG1 ILE 73 17.513 2.564 -6.105 515 HG13 ILE 73 2HG1 ILE 73 18.167 3.490 -7.380 516 HG21 ILE 73 1HG2 ILE 73 17.641 5.995 -7.426 517 HG22 ILE 73 2HG2 ILE 73 16.108 6.546 -6.721 518 HG23 ILE 73 3HG2 ILE 73 17.530 6.236 -5.643 519 HD11 ILE 73 3HD1 ILE 73 19.405 4.898 -5.805 520 HD12 ILE 73 1HD1 ILE 73 18.608 4.069 -4.442 521 HD13 ILE 73 2HD1 ILE 73 19.714 3.183 -5.512 522 H GLU 74 H GLU 74 13.311 3.236 -5.182 523 HA GLU 74 HA GLU 74 11.703 5.633 -5.756 524 HB2 GLU 74 1HB GLU 74 11.236 4.789 -7.981 525 HB3 GLU 74 2HB GLU 74 13.000 4.631 -7.769 526 HG2 GLU 74 1HG GLU 74 12.678 2.387 -7.079 527 HG3 GLU 74 2HG GLU 74 10.967 2.414 -7.498 528 H PHE 75 H PHE 75 9.322 4.919 -5.949 529 HA PHE 75 HA PHE 75 8.487 2.382 -4.865 530 HB2 PHE 75 1HB PHE 75 9.349 4.050 -2.912 531 HB3 PHE 75 2HB PHE 75 7.779 4.764 -3.107 532 HD1 PHE 75 2HD PHE 75 8.952 1.217 -3.147 533 HD2 PHE 75 1HD PHE 75 6.573 4.134 -1.083 534 HE1 PHE 75 2HE PHE 75 8.481 -0.437 -1.365 535 HE2 PHE 75 1HE PHE 75 6.263 2.629 0.708 536 HZ PHE 75 HZ PHE 75 7.173 0.265 0.626 537 H ALA 76 H ALA 76 6.444 2.043 -5.856 538 HA ALA 76 HA ALA 76 4.768 4.465 -6.358 539 HB1 ALA 76 1HB ALA 76 3.680 3.386 -8.156 540 HB2 ALA 76 2HB ALA 76 5.421 3.264 -8.464 541 HB3 ALA 76 3HB ALA 76 4.517 1.851 -7.845 542 H VAL 77 H VAL 77 2.555 4.267 -5.891 543 HA VAL 77 HA VAL 77 1.487 1.935 -4.516 544 HB VAL 77 HB VAL 77 1.603 4.678 -3.161 545 HG11 VAL 77 1HG1 VAL 77 -0.567 3.660 -2.796 546 HG12 VAL 77 2HG1 VAL 77 0.179 2.110 -2.345 547 HG13 VAL 77 3HG1 VAL 77 0.371 3.545 -1.312 548 HG21 VAL 77 3HG2 VAL 77 3.694 3.450 -2.741 549 HG22 VAL 77 1HG2 VAL 77 2.713 3.552 -1.288 550 HG23 VAL 77 2HG2 VAL 77 2.754 2.033 -2.215 551 H SER 78 H SER 78 0.106 1.780 -6.350 552 HA SER 78 HA SER 78 -1.918 3.929 -6.595 553 HB2 SER 78 1HB SER 78 -0.781 2.622 -9.075 554 HB3 SER 78 2HB SER 78 -1.875 3.981 -8.964 555 HG SER 78 HG SER 78 0.573 4.223 -9.325 556 H GLY 79 H GLY 79 -3.964 3.191 -7.513 557 HA2 GLY 79 1HA GLY 79 -4.820 0.966 -8.656 558 HA3 GLY 79 2HA GLY 79 -4.571 0.365 -6.999 559 H GLY 80 H GLY 80 -6.021 0.939 -5.419 560 HA2 GLY 80 1HA GLY 80 -7.529 2.956 -4.652 561 HA3 GLY 80 2HA GLY 80 -8.324 2.596 -6.181 562 H VAL 81 H VAL 81 -10.145 2.104 -4.686 563 HA VAL 81 HA VAL 81 -10.402 -0.716 -4.643 564 HB VAL 81 HB VAL 81 -11.889 -0.517 -2.526 565 HG11 VAL 81 1HG1 VAL 81 -10.049 -1.213 -1.014 566 HG12 VAL 81 2HG1 VAL 81 -10.054 -2.034 -2.576 567 HG13 VAL 81 3HG1 VAL 81 -8.894 -0.724 -2.274 568 HG21 VAL 81 3HG2 VAL 81 -11.659 1.864 -2.116 569 HG22 VAL 81 1HG2 VAL 81 -11.137 0.910 -0.726 570 HG23 VAL 81 2HG2 VAL 81 -9.918 1.664 -1.777 571 H VAL 82 H VAL 82 -12.765 -1.235 -4.800 572 HA VAL 82 HA VAL 82 -14.588 0.994 -5.170 573 HB VAL 82 HB VAL 82 -13.741 0.702 -7.414 574 HG11 VAL 82 1HG1 VAL 82 -13.889 -1.403 -8.682 575 HG12 VAL 82 2HG1 VAL 82 -12.772 -1.551 -7.331 576 HG13 VAL 82 3HG1 VAL 82 -14.397 -2.273 -7.217 577 HG21 VAL 82 3HG2 VAL 82 -16.164 1.064 -7.139 578 HG22 VAL 82 1HG2 VAL 82 -15.773 0.174 -8.622 579 HG23 VAL 82 2HG2 VAL 82 -16.440 -0.690 -7.225 580 H ASP 83 H ASP 83 -16.592 0.384 -4.426 581 HA ASP 83 HA ASP 83 -16.860 -1.910 -2.767 582 HB2 ASP 83 1HB ASP 83 -18.065 0.379 -2.697 583 HB3 ASP 83 2HB ASP 83 -19.225 -0.289 -3.836 584 H GLY 84 H GLY 84 -18.167 -3.740 -3.009 585 HA2 GLY 84 1HA GLY 84 -18.275 -4.866 -5.740 586 HA3 GLY 84 2HA GLY 84 -18.537 -5.710 -4.200 587 H GLU 85 H GLU 85 -20.373 -3.092 -3.675 588 HA GLU 85 HA GLU 85 -22.769 -4.052 -5.080 589 HB2 GLU 85 1HB GLU 85 -23.892 -4.096 -2.852 590 HB3 GLU 85 2HB GLU 85 -22.890 -5.455 -3.288 591 HG2 GLU 85 1HG GLU 85 -21.399 -3.380 -1.771 592 HG3 GLU 85 2HG GLU 85 -22.777 -4.009 -0.945 593 H ASP 86 H ASP 86 -24.479 -2.659 -5.112 594 HA ASP 86 HA ASP 86 -24.595 -0.376 -3.307 595 HB2 ASP 86 1HB ASP 86 -23.562 0.604 -5.346 596 HB3 ASP 86 2HB ASP 86 -24.914 0.020 -6.314 597 H GLY 87 H GLY 87 -26.382 -1.166 -2.263 598 HA2 GLY 87 1HA GLY 87 -28.886 -1.243 -2.789 599 HA3 GLY 87 2HA GLY 87 -28.497 -2.616 -3.807 600 H VAL 88 H VAL 88 -26.473 -2.824 -0.981 601 HA VAL 88 HA VAL 88 -28.497 -4.342 0.513 602 HB VAL 88 HB VAL 88 -26.476 -5.597 1.323 603 HG11 VAL 88 1HG1 VAL 88 -28.082 -6.587 -0.281 604 HG12 VAL 88 2HG1 VAL 88 -27.119 -5.943 -1.628 605 HG13 VAL 88 3HG1 VAL 88 -26.432 -7.170 -0.545 606 HG21 VAL 88 3HG2 VAL 88 -25.111 -4.543 -1.140 607 HG22 VAL 88 1HG2 VAL 88 -24.743 -4.012 0.518 608 HG23 VAL 88 2HG2 VAL 88 -24.467 -5.691 0.046 609 H VAL 89 H VAL 89 -27.409 -4.556 2.925 610 HA VAL 89 HA VAL 89 -26.706 -1.796 3.755 611 HB VAL 89 HB VAL 89 -28.896 -2.267 4.502 612 HG11 VAL 89 1HG1 VAL 89 -28.877 -4.761 4.618 613 HG12 VAL 89 2HG1 VAL 89 -27.917 -4.656 6.103 614 HG13 VAL 89 3HG1 VAL 89 -29.555 -3.982 6.051 615 HG21 VAL 89 3HG2 VAL 89 -26.959 -2.442 6.843 616 HG22 VAL 89 1HG2 VAL 89 -27.330 -0.975 5.922 617 HG23 VAL 89 2HG2 VAL 89 -28.601 -1.771 6.859 618 H ASN 90 H ASN 90 -24.633 -1.816 3.768 619 HA ASN 90 HA ASN 90 -23.096 -3.897 5.252 620 HB2 ASN 90 1HB ASN 90 -22.461 -2.353 2.722 621 HB3 ASN 90 2HB ASN 90 -21.188 -2.991 3.738 622 HD21 ASN 90 1HD2 ASN 90 -20.401 -4.616 2.595 623 HD22 ASN 90 2HD2 ASN 90 -21.383 -5.595 1.483 624 H GLU 91 H GLU 91 -20.738 -2.173 5.378 625 HA GLU 91 HA GLU 91 -21.698 0.212 6.805 626 HB2 GLU 91 1HB GLU 91 -19.737 -1.867 7.876 627 HB3 GLU 91 2HB GLU 91 -19.754 -0.198 8.444 628 HG2 GLU 91 1HG GLU 91 -22.269 -0.498 8.857 629 HG3 GLU 91 2HG GLU 91 -22.011 -2.224 8.615 630 HA PRO 92 HA PRO 92 -18.546 1.986 4.303 631 HB2 PRO 92 1HB PRO 92 -17.665 4.189 5.710 632 HB3 PRO 92 2HB PRO 92 -19.351 4.071 5.113 633 HG2 PRO 92 1HG PRO 92 -18.325 3.331 7.869 634 HG3 PRO 92 2HG PRO 92 -19.695 4.421 7.449 635 HD2 PRO 92 1HD PRO 92 -20.115 1.827 8.076 636 HD3 PRO 92 2HD PRO 92 -21.037 2.588 6.753 637 H MET 93 H MET 93 -16.062 2.891 4.430 638 HA MET 93 HA MET 93 -14.514 1.302 6.297 639 HB2 MET 93 1HB MET 93 -13.371 -0.003 4.682 640 HB3 MET 93 2HB MET 93 -15.068 -0.283 4.383 641 HG2 MET 93 1HG MET 93 -15.048 0.967 2.388 642 HG3 MET 93 2HG MET 93 -13.579 1.840 2.810 643 HE1 MET 93 3HE MET 93 -11.448 -0.314 3.684 644 HE2 MET 93 1HE MET 93 -10.723 -0.706 2.114 645 HE3 MET 93 2HE MET 93 -11.109 0.984 2.512 646 H GLN 94 H GLN 94 -12.126 1.733 5.864 647 HA GLN 94 HA GLN 94 -11.592 4.180 4.325 648 HB2 GLN 94 1HB GLN 94 -11.210 3.926 7.330 649 HB3 GLN 94 2HB GLN 94 -10.144 4.947 6.367 650 HG2 GLN 94 1HG GLN 94 -11.599 6.614 6.532 651 HG3 GLN 94 2HG GLN 94 -12.696 5.709 5.514 652 HE21 GLN 94 1HE2 GLN 94 -14.533 4.697 6.384 653 HE22 GLN 94 2HE2 GLN 94 -14.987 4.863 8.078 654 H TRP 95 H TRP 95 -9.403 4.540 4.028 655 HA TRP 95 HA TRP 95 -7.503 2.314 4.421 656 HB2 TRP 95 1HB TRP 95 -8.312 3.721 1.853 657 HB3 TRP 95 2HB TRP 95 -6.614 3.396 2.129 658 HD1 TRP 95 HD TRP 95 -8.594 0.546 3.477 659 HE1 TRP 95 1HE TRP 95 -8.269 -1.496 1.947 660 HE3 TRP 95 3HE TRP 95 -6.668 2.854 -0.700 661 HZ2 TRP 95 2HZ TRP 95 -6.959 -2.108 -0.452 662 HZ3 TRP 95 3HZ TRP 95 -5.926 1.439 -2.625 663 HH2 TRP 95 HH TRP 95 -5.962 -1.007 -2.478 664 H VAL 96 H VAL 96 -6.107 3.223 5.851 665 HA VAL 96 HA VAL 96 -5.270 6.053 5.438 666 HB VAL 96 HB VAL 96 -4.402 4.209 7.687 667 HG11 VAL 96 1HG1 VAL 96 -3.780 6.392 8.754 668 HG12 VAL 96 2HG1 VAL 96 -2.933 6.120 7.235 669 HG13 VAL 96 3HG1 VAL 96 -4.304 7.239 7.285 670 HG21 VAL 96 3HG2 VAL 96 -5.944 5.436 9.195 671 HG22 VAL 96 1HG2 VAL 96 -6.723 6.167 7.776 672 HG23 VAL 96 2HG2 VAL 96 -6.772 4.417 8.037 673 H VAL 97 H VAL 97 -3.256 6.236 4.372 674 HA VAL 97 HA VAL 97 -1.570 3.869 4.232 675 HB VAL 97 HB VAL 97 -2.737 3.608 2.226 676 HG11 VAL 97 1HG1 VAL 97 -3.860 5.787 1.971 677 HG12 VAL 97 2HG1 VAL 97 -2.311 6.494 1.439 678 HG13 VAL 97 3HG1 VAL 97 -3.109 5.235 0.476 679 HG21 VAL 97 3HG2 VAL 97 -1.130 3.845 0.466 680 HG22 VAL 97 1HG2 VAL 97 -0.244 5.102 1.345 681 HG23 VAL 97 2HG2 VAL 97 -0.268 3.435 1.953 682 H THR 98 H THR 98 0.702 4.579 3.651 683 HA THR 98 HA THR 98 1.321 7.385 3.948 684 HB THR 98 HB THR 98 2.640 5.717 6.065 685 HG1 THR 98 1HG THR 98 -0.080 6.404 6.150 686 HG21 THR 98 3HG2 THR 98 2.615 7.781 7.308 687 HG22 THR 98 1HG2 THR 98 1.302 8.448 6.308 688 HG23 THR 98 2HG2 THR 98 2.896 8.199 5.614 689 H VAL 99 H VAL 99 3.705 7.662 3.436 690 HA VAL 99 HA VAL 99 5.088 5.146 2.679 691 HB VAL 99 HB VAL 99 5.031 7.729 1.076 692 HG11 VAL 99 1HG1 VAL 99 6.634 6.471 -0.439 693 HG12 VAL 99 2HG1 VAL 99 7.325 6.956 1.102 694 HG13 VAL 99 3HG1 VAL 99 6.832 5.273 0.869 695 HG21 VAL 99 3HG2 VAL 99 4.270 6.165 -0.744 696 HG22 VAL 99 1HG2 VAL 99 4.204 4.852 0.446 697 HG23 VAL 99 2HG2 VAL 99 3.127 6.256 0.593 698 H TYR 100 H TYR 100 6.209 4.992 4.513 699 HA TYR 100 HA TYR 100 7.651 7.288 5.671 700 HB2 TYR 100 1HB TYR 100 7.422 4.328 6.341 701 HB3 TYR 100 2HB TYR 100 8.611 5.368 7.101 702 HD1 TYR 100 1HD TYR 100 4.936 4.791 6.697 703 HD2 TYR 100 2HD TYR 100 8.046 6.809 8.893 704 HE1 TYR 100 1HE TYR 100 3.268 5.499 8.401 705 HE2 TYR 100 2HE TYR 100 6.377 7.484 10.612 706 HH TYR 100 HH TYR 100 2.952 6.624 10.525 707 H LYS 101 H LYS 101 9.973 7.090 5.893 708 HA LYS 101 HA LYS 101 11.295 6.116 3.458 709 HB2 LYS 101 1HB LYS 101 10.538 8.597 3.743 710 HB3 LYS 101 2HB LYS 101 11.879 8.750 4.878 711 HG2 LYS 101 1HG LYS 101 13.376 8.861 3.165 712 HG3 LYS 101 2HG LYS 101 12.738 7.390 2.444 713 HD2 LYS 101 1HD LYS 101 10.981 8.640 1.308 714 HD3 LYS 101 2HD LYS 101 11.526 10.135 2.108 715 HE2 LYS 101 1HE LYS 101 13.822 9.612 0.984 716 HE3 LYS 101 2HE LYS 101 12.885 8.531 -0.075 717 HZ1 LYS 101 3HZ LYS 101 12.423 11.425 0.343 718 HZ2 LYS 101 1HZ LYS 101 11.543 10.466 -0.693 719 HZ3 LYS 101 2HZ LYS 101 13.136 10.776 -0.972 720 H ASN 102 H ASN 102 13.858 7.245 4.398 721 HA ASN 102 HA ASN 102 14.999 5.153 5.990 722 HB2 ASN 102 1HB ASN 102 16.177 7.952 5.693 723 HB3 ASN 102 2HB ASN 102 17.009 6.458 6.036 724 HD21 ASN 102 1HD2 ASN 102 15.784 8.599 3.584 725 HD22 ASN 102 2HD2 ASN 102 16.496 7.732 2.245 726 H GLY 103 H GLY 103 13.044 5.471 7.696 727 HA2 GLY 103 1HA GLY 103 12.364 6.107 9.804 728 HA3 GLY 103 2HA GLY 103 14.017 6.648 10.134 729 H LYS 104 H LYS 104 11.215 7.646 8.081 730 HA LYS 104 HA LYS 104 10.473 9.529 9.851 731 HB2 LYS 104 1HB LYS 104 12.310 10.733 7.991 732 HB3 LYS 104 2HB LYS 104 10.730 11.284 7.513 733 HG2 LYS 104 1HG LYS 104 11.935 11.449 10.287 734 HG3 LYS 104 2HG LYS 104 11.831 12.792 9.146 735 HD2 LYS 104 1HD LYS 104 9.279 12.524 9.229 736 HD3 LYS 104 2HD LYS 104 9.552 11.420 10.605 737 HE2 LYS 104 1HE LYS 104 10.926 13.350 11.632 738 HE3 LYS 104 2HE LYS 104 10.190 14.376 10.383 739 HZ1 LYS 104 3HZ LYS 104 8.763 12.829 12.469 740 HZ2 LYS 104 1HZ LYS 104 7.992 13.627 11.274 741 HZ3 LYS 104 2HZ LYS 104 8.860 14.471 12.369 742 H GLU 105 H GLU 105 8.478 10.632 9.026 743 HA GLU 105 HA GLU 105 6.928 9.224 6.969 744 HB2 GLU 105 1HB GLU 105 5.946 9.898 9.147 745 HB3 GLU 105 2HB GLU 105 6.528 11.538 8.903 746 HG2 GLU 105 1HG GLU 105 4.897 11.639 6.916 747 HG3 GLU 105 2HG GLU 105 4.182 10.172 7.615 748 H ILE 106 H ILE 106 6.552 10.317 4.892 749 HA ILE 106 HA ILE 106 7.412 13.144 4.634 750 HB ILE 106 HB ILE 106 8.099 12.632 2.294 751 HG12 ILE 106 1HG1 ILE 106 8.416 9.715 3.039 752 HG13 ILE 106 2HG1 ILE 106 6.863 10.275 2.419 753 HG21 ILE 106 1HG2 ILE 106 9.754 12.925 4.111 754 HG22 ILE 106 2HG2 ILE 106 9.787 11.160 4.356 755 HG23 ILE 106 3HG2 ILE 106 10.323 11.883 2.813 756 HD11 ILE 106 3HD1 ILE 106 7.834 11.068 0.383 757 HD12 ILE 106 1HD1 ILE 106 9.470 10.657 0.946 758 HD13 ILE 106 2HD1 ILE 106 8.275 9.370 0.653 759 H GLU 107 H GLU 107 4.917 10.824 4.339 760 HA GLU 107 HA GLU 107 3.285 12.456 2.476 761 HB2 GLU 107 1HB GLU 107 4.601 10.876 1.195 762 HB3 GLU 107 2HB GLU 107 4.182 9.546 2.255 763 HG2 GLU 107 1HG GLU 107 2.985 9.475 0.111 764 HG3 GLU 107 2HG GLU 107 1.919 9.514 1.510 765 H LYS 108 H LYS 108 0.921 11.756 2.633 766 HA LYS 108 HA LYS 108 0.189 10.197 4.990 767 HB2 LYS 108 1HB LYS 108 0.863 12.679 5.622 768 HB3 LYS 108 2HB LYS 108 -0.704 13.098 4.925 769 HG2 LYS 108 1HG LYS 108 -1.785 11.511 6.603 770 HG3 LYS 108 2HG LYS 108 -0.167 11.160 7.230 771 HD2 LYS 108 1HD LYS 108 0.103 13.595 7.707 772 HD3 LYS 108 2HD LYS 108 -1.576 13.867 7.193 773 HE2 LYS 108 1HE LYS 108 -2.462 12.507 8.952 774 HE3 LYS 108 2HE LYS 108 -0.870 11.863 9.343 775 HZ1 LYS 108 3HZ LYS 108 -1.864 14.562 9.854 776 HZ2 LYS 108 1HZ LYS 108 -0.239 14.166 9.947 777 HZ3 LYS 108 2HZ LYS 108 -1.332 13.445 10.941 778 H LYS 109 H LYS 109 -0.391 10.200 2.106 779 HA LYS 109 HA LYS 109 -3.010 10.887 1.429 780 HB2 LYS 109 1HB LYS 109 -1.236 8.604 0.618 781 HB3 LYS 109 2HB LYS 109 -2.929 8.522 0.136 782 HG2 LYS 109 1HG LYS 109 -1.476 11.106 -0.334 783 HG3 LYS 109 2HG LYS 109 -1.063 9.749 -1.369 784 HD2 LYS 109 1HD LYS 109 -3.944 10.621 -0.975 785 HD3 LYS 109 2HD LYS 109 -2.868 11.395 -2.162 786 HE2 LYS 109 1HE LYS 109 -2.420 9.043 -3.089 787 HE3 LYS 109 2HE LYS 109 -3.767 8.493 -2.073 788 HZ1 LYS 109 3HZ LYS 109 -4.845 10.591 -3.420 789 HZ2 LYS 109 1HZ LYS 109 -5.001 9.025 -3.859 790 HZ3 LYS 109 2HZ LYS 109 -3.865 9.945 -4.555 791 H SER 110 H SER 110 -5.042 10.517 2.358 792 HA SER 110 HA SER 110 -5.603 7.882 3.511 793 HB2 SER 110 1HB SER 110 -6.841 9.520 5.128 794 HB3 SER 110 2HB SER 110 -5.097 9.282 5.377 795 HG SER 110 HG SER 110 -5.681 11.491 5.425 796 H LEU 111 H LEU 111 -7.673 7.149 3.093 797 HA LEU 111 HA LEU 111 -9.441 8.999 1.667 798 HB2 LEU 111 1HB LEU 111 -9.302 6.102 0.921 799 HB3 LEU 111 2HB LEU 111 -10.012 7.460 0.056 800 HG LEU 111 HG LEU 111 -7.702 8.356 -0.423 801 HD11 LEU 111 1HD1 LEU 111 -7.122 5.968 1.234 802 HD12 LEU 111 2HD1 LEU 111 -6.132 7.426 0.952 803 HD13 LEU 111 3HD1 LEU 111 -6.087 6.115 -0.225 804 HD21 LEU 111 3HD2 LEU 111 -9.035 6.918 -1.974 805 HD22 LEU 111 1HD2 LEU 111 -8.232 5.489 -1.251 806 HD23 LEU 111 2HD2 LEU 111 -7.279 6.702 -2.142 807 H VAL 112 H VAL 112 -11.368 7.421 1.248 808 HA VAL 112 HA VAL 112 -12.558 6.066 3.482 809 HB VAL 112 HB VAL 112 -12.597 8.411 4.148 810 HG11 VAL 112 1HG1 VAL 112 -12.804 9.531 1.957 811 HG12 VAL 112 2HG1 VAL 112 -14.504 9.038 1.876 812 HG13 VAL 112 3HG1 VAL 112 -13.935 10.140 3.155 813 HG21 VAL 112 3HG2 VAL 112 -14.487 6.726 4.758 814 HG22 VAL 112 1HG2 VAL 112 -14.788 8.428 5.061 815 HG23 VAL 112 2HG2 VAL 112 -15.492 7.622 3.628 816 H PHE 113 H PHE 113 -14.389 4.881 2.841 817 HA PHE 113 HA PHE 113 -15.641 5.403 0.281 818 HB2 PHE 113 1HB PHE 113 -14.362 2.715 0.930 819 HB3 PHE 113 2HB PHE 113 -15.513 3.000 -0.356 820 HD1 PHE 113 2HD PHE 113 -12.078 3.916 0.835 821 HD2 PHE 113 1HD PHE 113 -14.785 3.721 -2.511 822 HE1 PHE 113 2HE PHE 113 -10.249 4.594 -0.694 823 HE2 PHE 113 1HE PHE 113 -12.929 4.265 -4.040 824 HZ PHE 113 HZ PHE 113 -10.680 4.815 -3.141 825 H ARG 114 H ARG 114 -17.620 3.689 0.279 826 HA ARG 114 HA ARG 114 -18.764 3.946 3.022 827 HB2 ARG 114 1HB ARG 114 -19.910 4.954 0.382 828 HB3 ARG 114 2HB ARG 114 -20.763 4.922 1.927 829 HG2 ARG 114 1HG ARG 114 -18.890 6.385 2.883 830 HG3 ARG 114 2HG ARG 114 -18.265 6.539 1.235 831 HD2 ARG 114 1HD ARG 114 -19.648 8.469 1.774 832 HD3 ARG 114 2HD ARG 114 -20.433 7.506 0.506 833 HE ARG 114 HE ARG 114 -21.345 6.612 3.060 834 HH11 ARG 114 1HH1 ARG 114 -21.761 9.518 0.972 835 HH12 ARG 114 2HH1 ARG 114 -23.368 9.768 1.628 836 HH21 ARG 114 1HH2 ARG 114 -23.411 6.922 3.654 837 HH22 ARG 114 2HH2 ARG 114 -24.319 8.332 3.093 838 H ASP 115 H ASP 115 -20.848 2.884 3.302 839 HA ASP 115 HA ASP 115 -21.110 0.290 2.083 840 HB2 ASP 115 1HB ASP 115 -23.361 0.355 3.206 841 HB3 ASP 115 2HB ASP 115 -22.015 0.618 4.292 842 H GLY 116 H GLY 116 -21.502 0.151 -0.167 843 HA2 GLY 116 1HA GLY 116 -23.199 -0.169 -1.634 844 HA3 GLY 116 2HA GLY 116 -24.267 0.913 -0.705 845 H LYS 117 H LYS 117 -21.065 1.245 -2.267 846 HA LYS 117 HA LYS 117 -22.237 3.168 -4.164 847 HB2 LYS 117 1HB LYS 117 -20.234 3.940 -2.029 848 HB3 LYS 117 2HB LYS 117 -20.044 4.621 -3.627 849 HG2 LYS 117 1HG LYS 117 -22.346 5.000 -1.716 850 HG3 LYS 117 2HG LYS 117 -21.212 6.196 -2.332 851 HD2 LYS 117 1HD LYS 117 -22.243 5.409 -4.706 852 HD3 LYS 117 2HD LYS 117 -23.590 4.934 -3.679 853 HE2 LYS 117 1HE LYS 117 -24.202 7.073 -4.239 854 HE3 LYS 117 2HE LYS 117 -23.379 7.369 -2.696 855 HZ1 LYS 117 3HZ LYS 117 -21.406 7.999 -3.955 856 HZ2 LYS 117 1HZ LYS 117 -22.693 8.878 -4.489 857 HZ3 LYS 117 2HZ LYS 117 -22.162 7.598 -5.383 858 H GLU 118 H GLU 118 -21.824 1.869 -5.876 859 HA GLU 118 HA GLU 118 -19.127 1.034 -6.561 860 HB2 GLU 118 1HB GLU 118 -19.967 0.985 -8.880 861 HB3 GLU 118 2HB GLU 118 -20.960 0.029 -7.780 862 HG2 GLU 118 1HG GLU 118 -22.742 1.594 -7.822 863 HG3 GLU 118 2HG GLU 118 -21.748 2.880 -8.509 864 H ILE 119 H ILE 119 -17.605 2.209 -7.878 865 HA ILE 119 HA ILE 119 -18.046 4.925 -8.678 866 HB ILE 119 HB ILE 119 -16.127 5.859 -7.497 867 HG12 ILE 119 1HG1 ILE 119 -15.542 4.656 -5.282 868 HG13 ILE 119 2HG1 ILE 119 -16.100 3.190 -6.062 869 HG21 ILE 119 1HG2 ILE 119 -17.173 6.365 -5.423 870 HG22 ILE 119 2HG2 ILE 119 -18.438 6.223 -6.649 871 HG23 ILE 119 3HG2 ILE 119 -18.174 4.906 -5.481 872 HD11 ILE 119 3HD1 ILE 119 -14.008 4.947 -7.353 873 HD12 ILE 119 1HD1 ILE 119 -13.587 3.714 -6.150 874 HD13 ILE 119 2HD1 ILE 119 -14.365 3.228 -7.655 875 H SER 120 H SER 120 -15.675 5.615 -9.620 876 HA SER 120 HA SER 120 -13.701 3.618 -9.827 877 HB2 SER 120 1HB SER 120 -15.203 4.355 -12.350 878 HB3 SER 120 2HB SER 120 -13.509 3.833 -12.382 879 HG SER 120 HG SER 120 -15.460 2.333 -11.003 880 H THR 121 H THR 121 -11.917 4.908 -9.397 881 HA THR 121 HA THR 121 -11.703 7.632 -10.450 882 HB THR 121 HB THR 121 -11.297 8.468 -8.053 883 HG1 THR 121 1HG THR 121 -12.446 7.292 -6.433 884 HG21 THR 121 3HG2 THR 121 -13.593 9.043 -7.620 885 HG22 THR 121 1HG2 THR 121 -14.188 7.698 -8.613 886 HG23 THR 121 2HG2 THR 121 -13.342 9.066 -9.372 887 H ASP 122 H ASP 122 -9.610 8.448 -10.317 888 HA ASP 122 HA ASP 122 -7.435 6.579 -10.130 889 HB2 ASP 122 1HB ASP 122 -7.582 9.597 -10.542 890 HB3 ASP 122 2HB ASP 122 -6.063 8.705 -10.515 891 H ASP 123 H ASP 123 -8.888 6.786 -7.628 892 HA ASP 123 HA ASP 123 -7.996 8.808 -5.876 893 HB2 ASP 123 1HB ASP 123 -9.671 6.404 -5.692 894 HB3 ASP 123 2HB ASP 123 -8.657 6.513 -4.289 895 H LEU 124 H LEU 124 -6.257 6.048 -6.880 896 HA LEU 124 HA LEU 124 -4.137 6.723 -4.961 897 HB2 LEU 124 1HB LEU 124 -5.514 4.512 -4.362 898 HB3 LEU 124 2HB LEU 124 -4.617 3.875 -5.698 899 HG LEU 124 HG LEU 124 -2.479 4.524 -4.560 900 HD11 LEU 124 1HD1 LEU 124 -2.581 4.971 -2.093 901 HD12 LEU 124 2HD1 LEU 124 -4.334 5.196 -2.236 902 HD13 LEU 124 3HD1 LEU 124 -3.211 6.305 -3.058 903 HD21 LEU 124 3HD2 LEU 124 -2.546 2.654 -2.964 904 HD22 LEU 124 1HD2 LEU 124 -3.475 2.224 -4.406 905 HD23 LEU 124 2HD2 LEU 124 -4.300 2.746 -2.918 906 H ASN 125 H ASN 125 -2.660 7.436 -6.183 907 HA ASN 125 HA ASN 125 -1.673 6.197 -8.655 908 HB2 ASN 125 1HB ASN 125 -3.691 7.663 -9.282 909 HB3 ASN 125 2HB ASN 125 -2.782 9.045 -8.698 910 HD21 ASN 125 1HD2 ASN 125 -2.683 6.333 -11.028 911 HD22 ASN 125 2HD2 ASN 125 -1.630 7.174 -12.187 912 H LEU 126 H LEU 126 -0.115 6.150 -6.493 913 HA LEU 126 HA LEU 126 1.282 8.762 -6.199 914 HB2 LEU 126 1HB LEU 126 0.065 7.156 -4.234 915 HB3 LEU 126 2HB LEU 126 1.767 6.697 -4.158 916 HG LEU 126 HG LEU 126 2.405 9.061 -3.811 917 HD11 LEU 126 1HD1 LEU 126 0.587 10.680 -3.145 918 HD12 LEU 126 2HD1 LEU 126 -0.603 9.550 -3.843 919 HD13 LEU 126 3HD1 LEU 126 0.624 10.316 -4.862 920 HD21 LEU 126 3HD2 LEU 126 1.437 9.189 -1.513 921 HD22 LEU 126 1HD2 LEU 126 2.074 7.587 -1.913 922 HD23 LEU 126 2HD2 LEU 126 0.320 7.869 -1.930 923 H TYR 127 H TYR 127 3.499 8.795 -6.304 924 HA TYR 127 HA TYR 127 4.969 6.392 -7.143 925 HB2 TYR 127 1HB TYR 127 3.623 7.023 -9.093 926 HB3 TYR 127 2HB TYR 127 4.166 8.683 -8.959 927 HD1 TYR 127 1HD TYR 127 6.537 5.746 -8.688 928 HD2 TYR 127 2HD TYR 127 4.840 8.829 -11.213 929 HE1 TYR 127 1HE TYR 127 8.279 5.323 -10.382 930 HE2 TYR 127 2HE TYR 127 6.552 8.343 -12.939 931 HH TYR 127 HH TYR 127 9.339 6.862 -12.337 932 H TYR 128 H TYR 128 7.102 6.619 -6.738 933 HA TYR 128 HA TYR 128 8.399 9.236 -6.340 934 HB2 TYR 128 1HB TYR 128 8.441 6.751 -4.566 935 HB3 TYR 128 2HB TYR 128 9.613 7.988 -4.397 936 HD1 TYR 128 1HD TYR 128 8.502 10.523 -4.262 937 HD2 TYR 128 2HD TYR 128 6.643 6.814 -3.092 938 HE1 TYR 128 1HE TYR 128 6.983 11.765 -2.739 939 HE2 TYR 128 2HE TYR 128 5.037 8.086 -1.646 940 HH TYR 128 HH TYR 128 4.869 11.552 -1.593 941 H ASN 129 H ASN 129 10.164 9.277 -7.567 942 HA ASN 129 HA ASN 129 12.131 7.399 -7.363 943 HB2 ASN 129 1HB ASN 129 12.674 6.745 -9.539 944 HB3 ASN 129 2HB ASN 129 10.969 6.393 -9.436 945 HD21 ASN 129 1HD2 ASN 129 13.158 9.015 -10.510 946 HD22 ASN 129 2HD2 ASN 129 12.234 9.388 -11.971 Start of MODEL 11 1 H1 GLY 1 H GLY 1 31.832 -17.256 -9.449 2 HA2 GLY 1 1HA GLY 1 33.317 -17.340 -7.512 3 HA3 GLY 1 2HA GLY 1 34.701 -17.234 -8.647 4 H ASP 2 H ASP 2 32.808 -15.276 -6.562 5 HA ASP 2 HA ASP 2 32.599 -12.987 -8.358 6 HB2 ASP 2 1HB ASP 2 30.355 -14.603 -7.045 7 HB3 ASP 2 2HB ASP 2 30.157 -12.982 -7.706 8 H ASP 3 H ASP 3 33.109 -11.322 -7.110 9 HA ASP 3 HA ASP 3 32.666 -11.189 -4.222 10 HB2 ASP 3 1HB ASP 3 34.926 -12.187 -4.513 11 HB3 ASP 3 2HB ASP 3 35.360 -10.894 -5.633 12 H ASP 4 H ASP 4 31.428 -9.318 -4.241 13 HA ASP 4 HA ASP 4 32.316 -6.977 -5.622 14 HB2 ASP 4 1HB ASP 4 30.543 -6.600 -7.081 15 HB3 ASP 4 2HB ASP 4 30.992 -8.262 -7.408 16 H GLU 5 H GLU 5 31.334 -5.107 -4.693 17 HA GLU 5 HA GLU 5 29.314 -5.371 -2.600 18 HB2 GLU 5 1HB GLU 5 30.707 -4.573 -0.807 19 HB3 GLU 5 2HB GLU 5 31.285 -6.087 -1.436 20 HG2 GLU 5 1HG GLU 5 33.312 -5.175 -1.270 21 HG3 GLU 5 2HG GLU 5 32.950 -4.466 -2.834 22 HA PRO 6 HA PRO 6 29.745 -1.522 -5.219 23 HB2 PRO 6 1HB PRO 6 27.141 -1.284 -6.111 24 HB3 PRO 6 2HB PRO 6 28.401 -2.291 -6.893 25 HG2 PRO 6 1HG PRO 6 26.305 -3.183 -4.892 26 HG3 PRO 6 2HG PRO 6 26.696 -3.928 -6.477 27 HD2 PRO 6 1HD PRO 6 27.714 -4.888 -4.164 28 HD3 PRO 6 2HD PRO 6 28.736 -4.803 -5.633 29 H GLY 7 H GLY 7 28.960 0.682 -4.819 30 HA2 GLY 7 1HA GLY 7 27.504 1.138 -2.313 31 HA3 GLY 7 2HA GLY 7 29.226 1.557 -2.428 32 H GLY 8 H GLY 8 26.112 2.584 -3.018 33 HA2 GLY 8 1HA GLY 8 27.047 5.107 -4.247 34 HA3 GLY 8 2HA GLY 8 25.739 4.252 -5.062 35 H LYS 9 H LYS 9 23.684 5.220 -4.427 36 HA LYS 9 HA LYS 9 23.222 5.801 -1.650 37 HB2 LYS 9 1HB LYS 9 24.406 7.865 -3.053 38 HB3 LYS 9 2HB LYS 9 22.725 8.120 -3.498 39 HG2 LYS 9 1HG LYS 9 22.980 9.442 -1.583 40 HG3 LYS 9 2HG LYS 9 22.230 7.992 -0.934 41 HD2 LYS 9 1HD LYS 9 24.598 7.181 -0.331 42 HD3 LYS 9 2HD LYS 9 25.194 8.743 -0.905 43 HE2 LYS 9 1HE LYS 9 24.991 9.042 1.422 44 HE3 LYS 9 2HE LYS 9 23.562 9.836 0.738 45 HZ1 LYS 9 3HZ LYS 9 22.881 8.481 2.585 46 HZ2 LYS 9 1HZ LYS 9 23.720 7.187 2.034 47 HZ3 LYS 9 2HZ LYS 9 22.396 7.647 1.233 48 H GLY 10 H GLY 10 21.054 6.235 -1.328 49 HA2 GLY 10 1HA GLY 10 18.989 6.923 -2.977 50 HA3 GLY 10 2HA GLY 10 18.984 5.155 -3.026 51 H ALA 11 H ALA 11 17.197 4.762 -1.736 52 HA ALA 11 HA ALA 11 17.013 6.208 0.898 53 HB1 ALA 11 1HB ALA 11 14.578 6.425 0.466 54 HB2 ALA 11 2HB ALA 11 15.527 7.184 -0.808 55 HB3 ALA 11 3HB ALA 11 14.781 5.598 -1.093 56 H MET 12 H MET 12 15.511 5.281 2.384 57 HA MET 12 HA MET 12 14.402 2.689 1.813 58 HB2 MET 12 1HB MET 12 15.344 3.628 4.594 59 HB3 MET 12 2HB MET 12 14.152 2.348 4.334 60 HG2 MET 12 1HG MET 12 15.970 1.452 2.666 61 HG3 MET 12 2HG MET 12 17.035 2.418 3.661 62 HE1 MET 12 3HE MET 12 13.959 0.168 3.981 63 HE2 MET 12 1HE MET 12 15.097 -0.946 3.213 64 HE3 MET 12 2HE MET 12 14.519 -1.274 4.860 65 H TYR 13 H TYR 13 12.394 2.573 3.031 66 HA TYR 13 HA TYR 13 10.883 4.664 4.034 67 HB2 TYR 13 1HB TYR 13 9.269 4.334 1.913 68 HB3 TYR 13 2HB TYR 13 10.392 5.660 2.097 69 HD1 TYR 13 1HD TYR 13 11.123 2.136 0.949 70 HD2 TYR 13 2HD TYR 13 10.807 6.304 -0.140 71 HE1 TYR 13 1HE TYR 13 12.556 1.735 -0.989 72 HE2 TYR 13 2HE TYR 13 12.106 5.857 -2.229 73 HH TYR 13 HH TYR 13 13.560 4.418 -3.169 74 H GLU 14 H GLU 14 8.625 3.763 4.374 75 HA GLU 14 HA GLU 14 8.240 0.881 4.101 76 HB2 GLU 14 1HB GLU 14 9.631 0.801 5.981 77 HB3 GLU 14 2HB GLU 14 8.798 2.130 6.784 78 HG2 GLU 14 1HG GLU 14 6.818 0.728 7.091 79 HG3 GLU 14 2HG GLU 14 7.495 -0.525 6.078 80 H VAL 15 H VAL 15 6.154 0.984 3.337 81 HA VAL 15 HA VAL 15 4.347 3.180 4.047 82 HB VAL 15 HB VAL 15 4.616 2.303 1.729 83 HG11 VAL 15 1HG1 VAL 15 3.352 0.233 1.081 84 HG12 VAL 15 2HG1 VAL 15 4.841 -0.046 1.971 85 HG13 VAL 15 3HG1 VAL 15 3.265 -0.193 2.794 86 HG21 VAL 15 3HG2 VAL 15 2.678 3.555 2.287 87 HG22 VAL 15 1HG2 VAL 15 2.304 2.329 1.088 88 HG23 VAL 15 2HG2 VAL 15 1.788 2.081 2.764 89 H THR 16 H THR 16 2.066 2.656 4.970 90 HA THR 16 HA THR 16 1.723 -0.022 5.945 91 HB THR 16 HB THR 16 0.596 1.024 8.035 92 HG1 THR 16 1HG THR 16 2.505 2.972 7.364 93 HG21 THR 16 3HG2 THR 16 2.653 1.009 9.434 94 HG22 THR 16 1HG2 THR 16 3.644 0.933 7.959 95 HG23 THR 16 2HG2 THR 16 2.523 -0.388 8.378 96 H ILE 17 H ILE 17 -0.574 -0.373 6.256 97 HA ILE 17 HA ILE 17 -2.389 1.641 5.091 98 HB ILE 17 HB ILE 17 -1.945 0.012 3.360 99 HG12 ILE 17 1HG1 ILE 17 -4.135 -1.003 2.923 100 HG13 ILE 17 2HG1 ILE 17 -4.609 -0.790 4.610 101 HG21 ILE 17 1HG2 ILE 17 -2.635 -2.208 5.258 102 HG22 ILE 17 2HG2 ILE 17 -2.277 -2.380 3.532 103 HG23 ILE 17 3HG2 ILE 17 -1.012 -1.825 4.630 104 HD11 ILE 17 3HD1 ILE 17 -4.488 1.673 4.294 105 HD12 ILE 17 1HD1 ILE 17 -4.054 1.405 2.585 106 HD13 ILE 17 2HD1 ILE 17 -5.641 0.888 3.205 107 H GLU 18 H GLU 18 -4.289 1.746 6.290 108 HA GLU 18 HA GLU 18 -4.911 -0.320 8.294 109 HB2 GLU 18 1HB GLU 18 -4.791 2.695 8.575 110 HB3 GLU 18 2HB GLU 18 -5.919 1.753 9.536 111 HG2 GLU 18 1HG GLU 18 -3.853 0.361 10.232 112 HG3 GLU 18 2HG GLU 18 -2.887 1.668 9.536 113 H GLN 19 H GLN 19 -7.012 -0.855 8.298 114 HA GLN 19 HA GLN 19 -8.800 0.291 6.211 115 HB2 GLN 19 1HB GLN 19 -8.493 -2.446 7.516 116 HB3 GLN 19 2HB GLN 19 -10.008 -1.944 6.784 117 HG2 GLN 19 1HG GLN 19 -8.978 -1.566 4.632 118 HG3 GLN 19 2HG GLN 19 -7.383 -1.939 5.274 119 HE21 GLN 19 1HE2 GLN 19 -7.186 -4.222 6.304 120 HE22 GLN 19 2HE2 GLN 19 -7.935 -5.538 5.477 121 H SER 20 H SER 20 -10.858 1.013 6.852 122 HA SER 20 HA SER 20 -11.718 0.829 9.637 123 HB2 SER 20 1HB SER 20 -10.128 2.642 9.652 124 HB3 SER 20 2HB SER 20 -10.829 3.373 8.211 125 HG SER 20 HG SER 20 -11.354 3.930 10.649 126 H GLY 21 H GLY 21 -13.836 2.210 9.723 127 HA2 GLY 21 1HA GLY 21 -16.072 1.959 9.245 128 HA3 GLY 21 2HA GLY 21 -15.672 2.347 7.571 129 H ASP 22 H ASP 22 -17.062 0.755 6.585 130 HA ASP 22 HA ASP 22 -16.844 -2.071 7.390 131 HB2 ASP 22 1HB ASP 22 -19.026 -0.952 6.699 132 HB3 ASP 22 2HB ASP 22 -18.446 -0.983 5.039 133 H PHE 23 H PHE 23 -14.815 -2.837 6.747 134 HA PHE 23 HA PHE 23 -13.896 -2.063 4.011 135 HB2 PHE 23 1HB PHE 23 -11.702 -2.920 4.829 136 HB3 PHE 23 2HB PHE 23 -12.339 -1.467 5.553 137 HD1 PHE 23 2HD PHE 23 -11.910 -5.148 6.224 138 HD2 PHE 23 1HD PHE 23 -12.590 -1.227 7.871 139 HE1 PHE 23 2HE PHE 23 -11.400 -6.004 8.479 140 HE2 PHE 23 1HE PHE 23 -12.047 -2.069 10.136 141 HZ PHE 23 HZ PHE 23 -11.429 -4.453 10.456 142 H ARG 24 H ARG 24 -15.939 -4.343 4.892 143 HA ARG 24 HA ARG 24 -14.274 -6.712 4.413 144 HB2 ARG 24 1HB ARG 24 -17.144 -6.389 5.367 145 HB3 ARG 24 2HB ARG 24 -16.250 -7.915 5.301 146 HG2 ARG 24 1HG ARG 24 -14.547 -7.032 6.852 147 HG3 ARG 24 2HG ARG 24 -15.433 -5.492 6.964 148 HD2 ARG 24 1HD ARG 24 -17.389 -6.625 7.861 149 HD3 ARG 24 2HD ARG 24 -16.592 -8.198 7.711 150 HE ARG 24 HE ARG 24 -14.841 -7.306 9.287 151 HH11 ARG 24 1HH1 ARG 24 -18.146 -5.927 9.495 152 HH12 ARG 24 2HH1 ARG 24 -17.869 -5.327 11.059 153 HH21 ARG 24 1HH2 ARG 24 -14.697 -6.836 11.405 154 HH22 ARG 24 2HH2 ARG 24 -16.126 -6.446 12.368 155 H SER 25 H SER 25 -16.193 -4.862 2.345 156 HA SER 25 HA SER 25 -17.073 -7.277 0.831 157 HB2 SER 25 1HB SER 25 -18.712 -5.838 2.257 158 HB3 SER 25 2HB SER 25 -18.557 -4.645 0.959 159 HG SER 25 HG SER 25 -19.621 -5.913 -0.365 160 H PHE 26 H PHE 26 -14.527 -5.674 0.377 161 HA PHE 26 HA PHE 26 -15.121 -4.450 -2.281 162 HB2 PHE 26 1HB PHE 26 -13.563 -3.257 0.058 163 HB3 PHE 26 2HB PHE 26 -13.710 -2.567 -1.546 164 HD1 PHE 26 2HD PHE 26 -16.550 -2.836 -2.228 165 HD2 PHE 26 1HD PHE 26 -14.712 -1.783 1.533 166 HE1 PHE 26 2HE PHE 26 -18.650 -1.827 -1.488 167 HE2 PHE 26 1HE PHE 26 -16.837 -0.642 2.204 168 HZ PHE 26 HZ PHE 26 -18.797 -0.691 0.738 169 H ILE 27 H ILE 27 -13.829 -5.358 -3.801 170 HA ILE 27 HA ILE 27 -11.549 -6.969 -3.105 171 HB ILE 27 HB ILE 27 -11.984 -5.892 -5.901 172 HG12 ILE 27 1HG1 ILE 27 -13.476 -8.236 -4.659 173 HG13 ILE 27 2HG1 ILE 27 -14.171 -6.745 -5.295 174 HG21 ILE 27 1HG2 ILE 27 -10.802 -7.903 -6.561 175 HG22 ILE 27 2HG2 ILE 27 -9.875 -7.061 -5.346 176 HG23 ILE 27 3HG2 ILE 27 -10.805 -8.504 -4.891 177 HD11 ILE 27 3HD1 ILE 27 -12.779 -8.886 -6.949 178 HD12 ILE 27 1HD1 ILE 27 -14.507 -8.538 -6.881 179 HD13 ILE 27 2HD1 ILE 27 -13.401 -7.331 -7.569 180 H LYS 28 H LYS 28 -9.810 -6.121 -2.301 181 HA LYS 28 HA LYS 28 -8.977 -3.338 -2.734 182 HB2 LYS 28 1HB LYS 28 -7.790 -5.700 -1.219 183 HB3 LYS 28 2HB LYS 28 -7.162 -4.058 -1.148 184 HG2 LYS 28 1HG LYS 28 -8.746 -3.323 0.268 185 HG3 LYS 28 2HG LYS 28 -10.068 -4.215 -0.454 186 HD2 LYS 28 1HD LYS 28 -7.981 -5.746 1.045 187 HD3 LYS 28 2HD LYS 28 -9.103 -4.800 1.984 188 HE2 LYS 28 1HE LYS 28 -10.156 -6.725 -0.085 189 HE3 LYS 28 2HE LYS 28 -9.517 -7.361 1.433 190 HZ1 LYS 28 3HZ LYS 28 -11.165 -6.081 2.628 191 HZ2 LYS 28 1HZ LYS 28 -11.872 -7.031 1.515 192 HZ3 LYS 28 2HZ LYS 28 -11.749 -5.456 1.189 193 H SER 29 H SER 29 -7.042 -2.698 -3.849 194 HA SER 29 HA SER 29 -5.212 -4.799 -4.786 195 HB2 SER 29 1HB SER 29 -6.355 -2.727 -6.715 196 HB3 SER 29 2HB SER 29 -5.267 -4.067 -7.092 197 HG SER 29 HG SER 29 -7.304 -5.235 -6.042 198 H VAL 30 H VAL 30 -3.071 -3.994 -4.681 199 HA VAL 30 HA VAL 30 -2.684 -1.078 -4.854 200 HB VAL 30 HB VAL 30 -1.426 -2.805 -2.695 201 HG11 VAL 30 1HG1 VAL 30 0.164 -1.092 -3.476 202 HG12 VAL 30 2HG1 VAL 30 -1.064 0.169 -3.217 203 HG13 VAL 30 3HG1 VAL 30 -0.405 -0.754 -1.847 204 HG21 VAL 30 3HG2 VAL 30 -3.417 -0.512 -2.435 205 HG22 VAL 30 1HG2 VAL 30 -3.733 -2.217 -2.064 206 HG23 VAL 30 2HG2 VAL 30 -2.583 -1.328 -1.081 207 H VAL 31 H VAL 31 -0.933 -0.557 -6.086 208 HA VAL 31 HA VAL 31 0.914 -2.627 -7.104 209 HB VAL 31 HB VAL 31 0.226 0.160 -8.144 210 HG11 VAL 31 1HG1 VAL 31 2.509 -0.427 -8.712 211 HG12 VAL 31 2HG1 VAL 31 2.008 -2.024 -9.304 212 HG13 VAL 31 3HG1 VAL 31 1.534 -0.553 -10.157 213 HG21 VAL 31 3HG2 VAL 31 -0.649 -2.493 -9.332 214 HG22 VAL 31 1HG2 VAL 31 -1.682 -1.294 -8.542 215 HG23 VAL 31 2HG2 VAL 31 -0.876 -0.890 -10.046 216 H VAL 32 H VAL 32 2.976 -2.498 -6.426 217 HA VAL 32 HA VAL 32 4.042 -0.018 -5.262 218 HB VAL 32 HB VAL 32 3.413 -1.831 -3.633 219 HG11 VAL 32 1HG1 VAL 32 4.251 -3.730 -4.997 220 HG12 VAL 32 2HG1 VAL 32 5.916 -3.190 -4.709 221 HG13 VAL 32 3HG1 VAL 32 4.880 -3.720 -3.357 222 HG21 VAL 32 3HG2 VAL 32 5.337 -1.641 -2.240 223 HG22 VAL 32 1HG2 VAL 32 6.335 -1.026 -3.564 224 HG23 VAL 32 2HG2 VAL 32 4.958 -0.082 -2.959 225 H VAL 33 H VAL 33 6.549 -0.031 -5.356 226 HA VAL 33 HA VAL 33 7.665 -2.004 -7.084 227 HB VAL 33 HB VAL 33 7.100 -0.023 -8.600 228 HG11 VAL 33 1HG1 VAL 33 7.813 1.853 -7.240 229 HG12 VAL 33 2HG1 VAL 33 9.498 1.292 -7.271 230 HG13 VAL 33 3HG1 VAL 33 8.692 1.812 -8.761 231 HG21 VAL 33 3HG2 VAL 33 9.056 -0.333 -9.950 232 HG22 VAL 33 1HG2 VAL 33 10.046 -0.823 -8.576 233 HG23 VAL 33 2HG2 VAL 33 8.738 -1.877 -9.176 234 H ALA 34 H ALA 34 10.115 -1.948 -6.790 235 HA ALA 34 HA ALA 34 11.122 -0.166 -4.746 236 HB1 ALA 34 1HB ALA 34 12.336 -1.892 -3.536 237 HB2 ALA 34 2HB ALA 34 10.581 -2.168 -3.392 238 HB3 ALA 34 3HB ALA 34 11.571 -3.161 -4.485 239 H ASN 35 H ASN 35 12.349 0.832 -6.288 240 HA ASN 35 HA ASN 35 13.573 -0.542 -8.542 241 HB2 ASN 35 1HB ASN 35 12.984 1.866 -8.547 242 HB3 ASN 35 2HB ASN 35 14.245 2.169 -7.342 243 HD21 ASN 35 1HD2 ASN 35 14.111 3.481 -9.813 244 HD22 ASN 35 2HD2 ASN 35 15.478 3.002 -10.792 245 H GLY 36 H GLY 36 15.074 -2.126 -8.087 246 HA2 GLY 36 1HA GLY 36 17.326 -2.598 -7.916 247 HA3 GLY 36 2HA GLY 36 17.561 -1.154 -6.934 248 H THR 37 H THR 37 15.047 -3.078 -5.534 249 HA THR 37 HA THR 37 16.712 -5.130 -4.491 250 HB THR 37 HB THR 37 17.284 -3.049 -3.063 251 HG1 THR 37 1HG THR 37 17.918 -4.394 -1.654 252 HG21 THR 37 3HG2 THR 37 14.702 -2.634 -2.696 253 HG22 THR 37 1HG2 THR 37 15.840 -2.370 -1.365 254 HG23 THR 37 2HG2 THR 37 14.883 -3.855 -1.430 255 H GLN 38 H GLN 38 15.181 -6.107 -2.439 256 HA GLN 38 HA GLN 38 12.675 -6.779 -3.842 257 HB2 GLN 38 1HB GLN 38 14.442 -8.133 -1.784 258 HB3 GLN 38 2HB GLN 38 12.746 -8.583 -1.925 259 HG2 GLN 38 1HG GLN 38 13.875 -10.041 -3.394 260 HG3 GLN 38 2HG GLN 38 13.061 -8.869 -4.390 261 HE21 GLN 38 1HE2 GLN 38 14.325 -9.044 -6.218 262 HE22 GLN 38 2HE2 GLN 38 15.909 -8.381 -6.292 263 H LEU 39 H LEU 39 10.800 -7.255 -2.470 264 HA LEU 39 HA LEU 39 10.243 -5.031 -0.614 265 HB2 LEU 39 1HB LEU 39 8.772 -5.848 -2.684 266 HB3 LEU 39 2HB LEU 39 8.296 -7.138 -1.584 267 HG LEU 39 HG LEU 39 7.629 -5.289 0.053 268 HD11 LEU 39 1HD1 LEU 39 7.164 -3.073 -0.967 269 HD12 LEU 39 2HD1 LEU 39 7.979 -3.585 -2.468 270 HD13 LEU 39 3HD1 LEU 39 8.899 -3.437 -0.954 271 HD21 LEU 39 3HD2 LEU 39 5.940 -6.522 -1.175 272 HD22 LEU 39 1HD2 LEU 39 6.188 -5.524 -2.619 273 HD23 LEU 39 2HD2 LEU 39 5.484 -4.826 -1.136 274 H LYS 40 H LYS 40 9.047 -5.669 1.331 275 HA LYS 40 HA LYS 40 9.639 -8.413 2.355 276 HB2 LYS 40 1HB LYS 40 11.148 -6.708 3.358 277 HB3 LYS 40 2HB LYS 40 9.738 -5.827 3.975 278 HG2 LYS 40 1HG LYS 40 9.085 -8.009 5.160 279 HG3 LYS 40 2HG LYS 40 10.672 -8.647 4.663 280 HD2 LYS 40 1HD LYS 40 11.682 -6.606 5.844 281 HD3 LYS 40 2HD LYS 40 10.058 -6.266 6.484 282 HE2 LYS 40 1HE LYS 40 10.025 -8.471 7.611 283 HE3 LYS 40 2HE LYS 40 11.601 -8.866 6.893 284 HZ1 LYS 40 3HZ LYS 40 11.027 -6.866 8.990 285 HZ2 LYS 40 1HZ LYS 40 12.439 -6.876 8.103 286 HZ3 LYS 40 2HZ LYS 40 12.051 -8.140 9.042 287 H ASP 41 H ASP 41 7.797 -9.385 2.643 288 HA ASP 41 HA ASP 41 5.231 -7.988 2.716 289 HB2 ASP 41 1HB ASP 41 5.688 -10.293 1.638 290 HB3 ASP 41 2HB ASP 41 5.602 -10.954 3.270 291 H GLY 42 H GLY 42 4.463 -7.064 4.612 292 HA2 GLY 42 1HA GLY 42 5.825 -7.518 7.076 293 HA3 GLY 42 2HA GLY 42 4.376 -6.550 6.854 294 H ALA 43 H ALA 43 3.522 -9.617 5.704 295 HA ALA 43 HA ALA 43 2.068 -10.335 8.098 296 HB1 ALA 43 1HB ALA 43 1.318 -10.892 5.845 297 HB2 ALA 43 2HB ALA 43 2.763 -11.914 5.591 298 HB3 ALA 43 3HB ALA 43 1.559 -12.349 6.822 299 H THR 44 H THR 44 5.089 -11.474 6.529 300 HA THR 44 HA THR 44 5.810 -12.998 8.995 301 HB THR 44 HB THR 44 6.817 -14.535 7.007 302 HG1 THR 44 1HG THR 44 4.584 -14.351 5.622 303 HG21 THR 44 3HG2 THR 44 3.930 -14.593 7.961 304 HG22 THR 44 1HG2 THR 44 5.332 -15.288 8.809 305 HG23 THR 44 2HG2 THR 44 4.826 -15.959 7.255 306 H GLY 45 H GLY 45 6.912 -10.743 6.578 307 HA2 GLY 45 1HA GLY 45 8.919 -9.676 6.510 308 HA3 GLY 45 2HA GLY 45 9.661 -10.838 7.623 309 H GLU 46 H GLU 46 7.771 -12.019 4.868 310 HA GLU 46 HA GLU 46 10.045 -13.439 3.764 311 HB2 GLU 46 1HB GLU 46 7.130 -13.061 2.932 312 HB3 GLU 46 2HB GLU 46 8.284 -13.999 1.979 313 HG2 GLU 46 1HG GLU 46 7.661 -14.555 4.909 314 HG3 GLU 46 2HG GLU 46 6.838 -15.354 3.577 315 H SER 47 H SER 47 11.486 -12.612 2.255 316 HA SER 47 HA SER 47 11.289 -10.196 1.009 317 HB2 SER 47 1HB SER 47 12.775 -12.555 -0.115 318 HB3 SER 47 2HB SER 47 13.328 -10.923 0.232 319 HG SER 47 HG SER 47 13.858 -13.014 1.702 320 H LEU 48 H LEU 48 10.266 -9.649 -0.941 321 HA LEU 48 HA LEU 48 9.337 -11.830 -2.781 322 HB2 LEU 48 1HB LEU 48 8.010 -9.138 -2.408 323 HB3 LEU 48 2HB LEU 48 7.410 -10.521 -3.306 324 HG LEU 48 HG LEU 48 7.637 -10.351 -0.260 325 HD11 LEU 48 1HD1 LEU 48 6.038 -8.830 -1.183 326 HD12 LEU 48 2HD1 LEU 48 5.169 -10.180 -0.434 327 HD13 LEU 48 3HD1 LEU 48 5.304 -10.114 -2.193 328 HD21 LEU 48 3HD2 LEU 48 6.484 -12.474 -2.118 329 HD22 LEU 48 1HD2 LEU 48 6.177 -12.397 -0.357 330 HD23 LEU 48 2HD2 LEU 48 7.816 -12.643 -0.961 331 H ALA 49 H ALA 49 9.275 -11.329 -4.958 332 HA ALA 49 HA ALA 49 11.373 -9.519 -5.889 333 HB1 ALA 49 1HB ALA 49 9.532 -11.382 -7.407 334 HB2 ALA 49 2HB ALA 49 10.981 -10.567 -8.032 335 HB3 ALA 49 3HB ALA 49 11.141 -11.798 -6.760 336 H SER 50 H SER 50 10.544 -7.509 -5.414 337 HA SER 50 HA SER 50 8.076 -6.437 -6.259 338 HB2 SER 50 1HB SER 50 10.067 -4.385 -6.454 339 HB3 SER 50 2HB SER 50 8.896 -4.684 -5.171 340 HG SER 50 HG SER 50 11.604 -5.264 -5.256 341 HA PRO 51 HA PRO 51 7.184 -4.378 -7.267 342 HB2 PRO 51 1HB PRO 51 5.424 -3.941 -9.323 343 HB3 PRO 51 2HB PRO 51 6.888 -2.951 -9.072 344 HG2 PRO 51 1HG PRO 51 6.505 -5.268 -10.949 345 HG3 PRO 51 2HG PRO 51 7.255 -3.679 -11.301 346 HD2 PRO 51 1HD PRO 51 8.736 -5.908 -10.717 347 HD3 PRO 51 2HD PRO 51 9.242 -4.279 -10.178 348 H VAL 52 H VAL 52 5.572 -5.328 -6.159 349 HA VAL 52 HA VAL 52 4.296 -7.815 -7.169 350 HB VAL 52 HB VAL 52 4.592 -6.675 -4.337 351 HG11 VAL 52 1HG1 VAL 52 3.312 -9.308 -5.193 352 HG12 VAL 52 2HG1 VAL 52 3.676 -8.835 -3.522 353 HG13 VAL 52 3HG1 VAL 52 2.490 -7.920 -4.429 354 HG21 VAL 52 3HG2 VAL 52 5.980 -8.683 -3.896 355 HG22 VAL 52 1HG2 VAL 52 5.887 -9.121 -5.615 356 HG23 VAL 52 2HG2 VAL 52 6.715 -7.640 -5.096 357 H ILE 53 H ILE 53 2.020 -7.937 -6.972 358 HA ILE 53 HA ILE 53 0.620 -5.350 -6.555 359 HB ILE 53 HB ILE 53 -0.222 -7.719 -8.259 360 HG12 ILE 53 1HG1 ILE 53 1.447 -6.778 -9.571 361 HG13 ILE 53 2HG1 ILE 53 -0.043 -6.108 -10.185 362 HG21 ILE 53 1HG2 ILE 53 -2.064 -6.227 -9.011 363 HG22 ILE 53 2HG2 ILE 53 -2.138 -6.539 -7.278 364 HG23 ILE 53 3HG2 ILE 53 -1.525 -4.983 -7.868 365 HD11 ILE 53 3HD1 ILE 53 1.230 -4.206 -10.164 366 HD12 ILE 53 1HD1 ILE 53 0.596 -4.101 -8.509 367 HD13 ILE 53 2HD1 ILE 53 2.225 -4.762 -8.822 368 H LEU 54 H LEU 54 -0.512 -5.409 -4.769 369 HA LEU 54 HA LEU 54 -0.896 -7.911 -3.177 370 HB2 LEU 54 1HB LEU 54 -1.255 -4.932 -2.712 371 HB3 LEU 54 2HB LEU 54 -2.085 -6.097 -1.770 372 HG LEU 54 HG LEU 54 -0.338 -5.641 -0.391 373 HD11 LEU 54 1HD1 LEU 54 -0.366 -8.140 -0.888 374 HD12 LEU 54 2HD1 LEU 54 1.104 -7.488 -0.183 375 HD13 LEU 54 3HD1 LEU 54 1.047 -7.865 -1.924 376 HD21 LEU 54 3HD2 LEU 54 1.558 -5.596 -2.742 377 HD22 LEU 54 1HD2 LEU 54 1.981 -5.322 -1.038 378 HD23 LEU 54 2HD2 LEU 54 0.882 -4.187 -1.836 379 H SER 55 H SER 55 -2.997 -8.205 -2.305 380 HA SER 55 HA SER 55 -5.145 -7.992 -4.291 381 HB2 SER 55 1HB SER 55 -4.382 -10.551 -2.866 382 HB3 SER 55 2HB SER 55 -5.495 -10.327 -4.234 383 HG SER 55 HG SER 55 -3.891 -10.090 -5.588 384 H ASP 56 H ASP 56 -6.765 -9.871 -2.505 385 HA ASP 56 HA ASP 56 -7.655 -7.833 -0.549 386 HB2 ASP 56 1HB ASP 56 -9.363 -8.384 -2.064 387 HB3 ASP 56 2HB ASP 56 -8.895 -10.070 -2.162 388 H GLU 57 H GLU 57 -6.290 -11.036 -0.886 389 HA GLU 57 HA GLU 57 -6.926 -12.070 1.740 390 HB2 GLU 57 1HB GLU 57 -5.061 -12.792 -0.515 391 HB3 GLU 57 2HB GLU 57 -4.643 -13.401 1.075 392 HG2 GLU 57 1HG GLU 57 -7.336 -13.935 -0.212 393 HG3 GLU 57 2HG GLU 57 -5.918 -14.983 -0.350 394 H GLU 58 H GLU 58 -4.047 -10.184 0.417 395 HA GLU 58 HA GLU 58 -2.446 -10.564 2.583 396 HB2 GLU 58 1HB GLU 58 -1.289 -8.826 1.368 397 HB3 GLU 58 2HB GLU 58 -2.006 -9.913 0.236 398 HG2 GLU 58 1HG GLU 58 -2.542 -7.975 -0.752 399 HG3 GLU 58 2HG GLU 58 -3.988 -8.199 0.174 400 H LEU 59 H LEU 59 -5.109 -8.428 2.041 401 HA LEU 59 HA LEU 59 -4.556 -6.626 4.302 402 HB2 LEU 59 1HB LEU 59 -6.177 -6.653 1.841 403 HB3 LEU 59 2HB LEU 59 -7.004 -5.879 3.181 404 HG LEU 59 HG LEU 59 -4.151 -5.157 2.479 405 HD11 LEU 59 1HD1 LEU 59 -6.626 -3.701 1.451 406 HD12 LEU 59 2HD1 LEU 59 -5.620 -4.800 0.474 407 HD13 LEU 59 3HD1 LEU 59 -4.925 -3.314 1.119 408 HD21 LEU 59 3HD2 LEU 59 -6.255 -3.437 3.779 409 HD22 LEU 59 1HD2 LEU 59 -4.516 -3.151 3.644 410 HD23 LEU 59 2HD2 LEU 59 -5.105 -4.446 4.668 411 H ALA 60 H ALA 60 -5.093 -9.441 4.976 412 HA ALA 60 HA ALA 60 -7.896 -9.587 5.809 413 HB1 ALA 60 1HB ALA 60 -6.934 -11.526 4.754 414 HB2 ALA 60 2HB ALA 60 -5.660 -11.639 6.008 415 HB3 ALA 60 3HB ALA 60 -7.370 -11.914 6.415 416 H VAL 61 H VAL 61 -5.764 -7.783 7.281 417 HA VAL 61 HA VAL 61 -6.956 -8.465 9.912 418 HB VAL 61 HB VAL 61 -5.068 -7.751 11.159 419 HG11 VAL 61 1HG1 VAL 61 -3.388 -9.454 10.708 420 HG12 VAL 61 2HG1 VAL 61 -5.027 -10.143 10.586 421 HG13 VAL 61 3HG1 VAL 61 -4.083 -9.773 9.115 422 HG21 VAL 61 3HG2 VAL 61 -3.178 -7.674 8.844 423 HG22 VAL 61 1HG2 VAL 61 -4.165 -6.259 9.134 424 HG23 VAL 61 2HG2 VAL 61 -3.116 -6.868 10.416 425 H GLU 62 H GLU 62 -6.217 -6.065 11.217 426 HA GLU 62 HA GLU 62 -7.832 -4.063 9.857 427 HB2 GLU 62 1HB GLU 62 -7.384 -2.723 11.830 428 HB3 GLU 62 2HB GLU 62 -7.942 -4.345 12.262 429 HG2 GLU 62 1HG GLU 62 -5.558 -5.019 12.695 430 HG3 GLU 62 2HG GLU 62 -5.061 -3.386 12.273 431 H LYS 63 H LYS 63 -4.333 -4.720 10.145 432 HA LYS 63 HA LYS 63 -3.669 -2.223 8.673 433 HB2 LYS 63 1HB LYS 63 -3.923 -1.700 11.062 434 HB3 LYS 63 2HB LYS 63 -2.810 -2.974 11.509 435 HG2 LYS 63 1HG LYS 63 -1.840 -0.763 9.671 436 HG3 LYS 63 2HG LYS 63 -2.120 -0.434 11.378 437 HD2 LYS 63 1HD LYS 63 -0.611 -2.254 12.000 438 HD3 LYS 63 2HD LYS 63 -0.237 -2.536 10.283 439 HE2 LYS 63 1HE LYS 63 1.510 -1.162 11.233 440 HE3 LYS 63 2HE LYS 63 0.561 -0.187 10.093 441 HZ1 LYS 63 3HZ LYS 63 0.195 1.219 11.727 442 HZ2 LYS 63 1HZ LYS 63 1.045 0.293 12.798 443 HZ3 LYS 63 2HZ LYS 63 -0.561 0.091 12.660 444 H VAL 64 H VAL 64 -1.861 -2.460 7.306 445 HA VAL 64 HA VAL 64 -0.133 -4.803 7.914 446 HB VAL 64 HB VAL 64 -0.483 -3.873 5.056 447 HG11 VAL 64 1HG1 VAL 64 1.342 -5.460 5.510 448 HG12 VAL 64 2HG1 VAL 64 0.206 -6.543 6.332 449 HG13 VAL 64 3HG1 VAL 64 0.063 -6.229 4.592 450 HG21 VAL 64 3HG2 VAL 64 -2.161 -5.753 4.779 451 HG22 VAL 64 1HG2 VAL 64 -2.263 -5.786 6.561 452 HG23 VAL 64 2HG2 VAL 64 -2.788 -4.358 5.643 453 H THR 65 H THR 65 2.108 -4.452 6.857 454 HA THR 65 HA THR 65 3.070 -1.675 6.710 455 HB THR 65 HB THR 65 4.365 -3.950 8.297 456 HG1 THR 65 1HG THR 65 3.758 -1.952 9.930 457 HG21 THR 65 3HG2 THR 65 5.044 -0.987 8.197 458 HG22 THR 65 1HG2 THR 65 5.954 -2.296 7.431 459 HG23 THR 65 2HG2 THR 65 5.856 -2.220 9.197 460 H LEU 66 H LEU 66 4.410 -1.559 4.786 461 HA LEU 66 HA LEU 66 5.675 -4.115 3.887 462 HB2 LEU 66 1HB LEU 66 4.141 -2.232 2.067 463 HB3 LEU 66 2HB LEU 66 5.398 -3.298 1.508 464 HG LEU 66 HG LEU 66 3.297 -4.228 0.978 465 HD11 LEU 66 1HD1 LEU 66 4.521 -5.821 3.241 466 HD12 LEU 66 2HD1 LEU 66 5.040 -5.831 1.544 467 HD13 LEU 66 3HD1 LEU 66 3.443 -6.447 1.986 468 HD21 LEU 66 3HD2 LEU 66 2.512 -4.542 3.864 469 HD22 LEU 66 1HD2 LEU 66 1.527 -4.752 2.416 470 HD23 LEU 66 2HD2 LEU 66 2.024 -3.122 2.921 471 H SER 67 H SER 67 7.775 -3.853 3.316 472 HA SER 67 HA SER 67 8.875 -1.085 3.123 473 HB2 SER 67 1HB SER 67 8.938 -1.940 5.474 474 HB3 SER 67 2HB SER 67 10.036 -3.211 4.940 475 HG SER 67 HG SER 67 11.071 -1.358 5.780 476 H THR 68 H THR 68 11.356 -1.409 2.567 477 HA THR 68 HA THR 68 11.595 -3.569 0.525 478 HB THR 68 HB THR 68 13.747 -2.388 0.016 479 HG1 THR 68 1HG THR 68 14.279 -0.756 1.147 480 HG21 THR 68 3HG2 THR 68 12.625 -0.711 -1.396 481 HG22 THR 68 1HG2 THR 68 11.197 -0.730 -0.338 482 HG23 THR 68 2HG2 THR 68 11.606 -2.169 -1.296 483 H THR 69 H THR 69 13.376 -5.061 0.636 484 HA THR 69 HA THR 69 14.230 -5.599 3.359 485 HB THR 69 HB THR 69 15.556 -7.438 2.296 486 HG1 THR 69 1HG THR 69 15.453 -7.758 0.185 487 HG21 THR 69 3HG2 THR 69 12.640 -7.277 1.431 488 HG22 THR 69 1HG2 THR 69 13.247 -7.882 2.989 489 HG23 THR 69 2HG2 THR 69 13.614 -8.754 1.495 490 H GLY 70 H GLY 70 15.408 -3.499 0.947 491 HA2 GLY 70 1HA GLY 70 17.837 -2.939 2.501 492 HA3 GLY 70 2HA GLY 70 18.068 -3.535 0.845 493 H LYS 71 H LYS 71 19.121 -1.384 0.686 494 HA LYS 71 HA LYS 71 17.610 1.074 0.546 495 HB2 LYS 71 1HB LYS 71 20.243 0.591 0.540 496 HB3 LYS 71 2HB LYS 71 19.980 0.379 -1.197 497 HG2 LYS 71 1HG LYS 71 18.808 2.776 -0.973 498 HG3 LYS 71 2HG LYS 71 19.767 2.844 0.514 499 HD2 LYS 71 1HD LYS 71 21.284 3.725 -1.033 500 HD3 LYS 71 2HD LYS 71 21.741 2.016 -1.074 501 HE2 LYS 71 1HE LYS 71 19.827 1.910 -2.938 502 HE3 LYS 71 2HE LYS 71 20.113 3.668 -3.013 503 HZ1 LYS 71 3HZ LYS 71 22.519 3.001 -3.521 504 HZ2 LYS 71 1HZ LYS 71 21.477 2.401 -4.641 505 HZ3 LYS 71 2HZ LYS 71 22.057 1.455 -3.446 506 H ALA 72 H ALA 72 16.447 1.886 -1.194 507 HA ALA 72 HA ALA 72 16.678 0.545 -3.793 508 HB1 ALA 72 1HB ALA 72 14.034 1.106 -2.396 509 HB2 ALA 72 2HB ALA 72 14.174 0.681 -4.103 510 HB3 ALA 72 3HB ALA 72 14.663 -0.474 -2.857 511 H ILE 73 H ILE 73 15.472 2.044 -5.413 512 HA ILE 73 HA ILE 73 16.167 4.859 -4.720 513 HB ILE 73 HB ILE 73 15.983 4.001 -7.562 514 HG12 ILE 73 1HG1 ILE 73 17.285 2.141 -6.731 515 HG13 ILE 73 2HG1 ILE 73 18.251 3.202 -7.700 516 HG21 ILE 73 1HG2 ILE 73 16.443 6.331 -6.993 517 HG22 ILE 73 2HG2 ILE 73 17.839 5.864 -6.020 518 HG23 ILE 73 3HG2 ILE 73 17.857 5.621 -7.778 519 HD11 ILE 73 3HD1 ILE 73 18.347 3.622 -4.721 520 HD12 ILE 73 1HD1 ILE 73 19.190 2.251 -5.425 521 HD13 ILE 73 2HD1 ILE 73 19.574 3.914 -5.947 522 H GLU 74 H GLU 74 13.369 2.929 -5.262 523 HA GLU 74 HA GLU 74 11.814 5.328 -5.310 524 HB2 GLU 74 1HB GLU 74 11.554 3.356 -7.631 525 HB3 GLU 74 2HB GLU 74 10.290 4.500 -7.160 526 HG2 GLU 74 1HG GLU 74 11.981 6.343 -7.320 527 HG3 GLU 74 2HG GLU 74 13.079 5.176 -8.128 528 H PHE 75 H PHE 75 9.667 4.914 -4.682 529 HA PHE 75 HA PHE 75 8.780 2.137 -4.213 530 HB2 PHE 75 1HB PHE 75 9.832 3.130 -2.081 531 HB3 PHE 75 2HB PHE 75 8.432 4.178 -1.982 532 HD1 PHE 75 2HD PHE 75 9.690 0.717 -1.951 533 HD2 PHE 75 1HD PHE 75 6.250 3.214 -1.164 534 HE1 PHE 75 2HE PHE 75 8.536 -1.188 -0.936 535 HE2 PHE 75 1HE PHE 75 5.045 1.264 -0.304 536 HZ PHE 75 HZ PHE 75 6.158 -0.946 -0.138 537 H ALA 76 H ALA 76 6.944 2.155 -5.583 538 HA ALA 76 HA ALA 76 5.308 4.618 -5.729 539 HB1 ALA 76 1HB ALA 76 4.170 3.565 -7.521 540 HB2 ALA 76 2HB ALA 76 5.894 3.281 -7.759 541 HB3 ALA 76 3HB ALA 76 4.867 1.967 -7.136 542 H VAL 77 H VAL 77 3.000 4.627 -5.153 543 HA VAL 77 HA VAL 77 1.915 2.240 -3.845 544 HB VAL 77 HB VAL 77 1.894 4.939 -2.412 545 HG11 VAL 77 1HG1 VAL 77 0.996 3.452 -0.534 546 HG12 VAL 77 2HG1 VAL 77 -0.076 3.636 -1.933 547 HG13 VAL 77 3HG1 VAL 77 0.860 2.166 -1.739 548 HG21 VAL 77 3HG2 VAL 77 4.168 4.086 -2.195 549 HG22 VAL 77 1HG2 VAL 77 3.302 3.948 -0.661 550 HG23 VAL 77 2HG2 VAL 77 3.542 2.505 -1.673 551 H SER 78 H SER 78 0.385 2.034 -5.535 552 HA SER 78 HA SER 78 -1.653 4.199 -5.612 553 HB2 SER 78 1HB SER 78 -0.805 2.634 -8.070 554 HB3 SER 78 2HB SER 78 -1.899 4.013 -7.990 555 HG SER 78 HG SER 78 -0.041 4.904 -8.642 556 H GLY 79 H GLY 79 -3.867 3.296 -6.235 557 HA2 GLY 79 1HA GLY 79 -4.785 0.934 -6.829 558 HA3 GLY 79 2HA GLY 79 -4.109 0.529 -5.241 559 H GLY 80 H GLY 80 -6.630 -0.043 -5.195 560 HA2 GLY 80 1HA GLY 80 -8.056 1.837 -3.590 561 HA3 GLY 80 2HA GLY 80 -8.579 1.920 -5.279 562 H VAL 81 H VAL 81 -10.640 1.196 -4.462 563 HA VAL 81 HA VAL 81 -10.872 -1.729 -4.258 564 HB VAL 81 HB VAL 81 -12.790 -1.099 -2.611 565 HG11 VAL 81 1HG1 VAL 81 -11.348 -1.532 -0.669 566 HG12 VAL 81 2HG1 VAL 81 -10.982 -2.593 -2.031 567 HG13 VAL 81 3HG1 VAL 81 -9.908 -1.217 -1.672 568 HG21 VAL 81 3HG2 VAL 81 -12.361 0.619 -1.005 569 HG22 VAL 81 1HG2 VAL 81 -10.906 1.162 -1.883 570 HG23 VAL 81 2HG2 VAL 81 -12.527 1.339 -2.606 571 H VAL 82 H VAL 82 -12.126 -2.390 -5.870 572 HA VAL 82 HA VAL 82 -14.336 -0.754 -6.959 573 HB VAL 82 HB VAL 82 -14.780 -2.626 -8.419 574 HG11 VAL 82 1HG1 VAL 82 -12.732 -1.568 -9.160 575 HG12 VAL 82 2HG1 VAL 82 -11.755 -2.605 -8.081 576 HG13 VAL 82 3HG1 VAL 82 -12.647 -3.305 -9.449 577 HG21 VAL 82 3HG2 VAL 82 -13.615 -4.881 -8.093 578 HG22 VAL 82 1HG2 VAL 82 -13.222 -4.292 -6.454 579 HG23 VAL 82 2HG2 VAL 82 -14.907 -4.492 -6.966 580 H ASP 83 H ASP 83 -16.553 -1.649 -7.091 581 HA ASP 83 HA ASP 83 -17.162 -3.733 -5.200 582 HB2 ASP 83 1HB ASP 83 -17.565 -1.610 -3.987 583 HB3 ASP 83 2HB ASP 83 -18.725 -1.122 -5.213 584 H GLY 84 H GLY 84 -17.886 -5.188 -6.721 585 HA2 GLY 84 1HA GLY 84 -19.425 -4.305 -9.051 586 HA3 GLY 84 2HA GLY 84 -18.953 -5.946 -8.616 587 H GLU 85 H GLU 85 -20.420 -4.452 -5.850 588 HA GLU 85 HA GLU 85 -22.981 -5.806 -6.454 589 HB2 GLU 85 1HB GLU 85 -21.809 -4.704 -3.878 590 HB3 GLU 85 2HB GLU 85 -23.469 -5.178 -4.047 591 HG2 GLU 85 1HG GLU 85 -21.215 -7.122 -4.660 592 HG3 GLU 85 2HG GLU 85 -21.838 -6.860 -3.024 593 H ASP 86 H ASP 86 -24.789 -4.630 -6.701 594 HA ASP 86 HA ASP 86 -24.850 -1.741 -6.018 595 HB2 ASP 86 1HB ASP 86 -24.107 -2.047 -8.407 596 HB3 ASP 86 2HB ASP 86 -25.651 -2.829 -8.734 597 H GLY 87 H GLY 87 -26.181 -4.697 -5.677 598 HA2 GLY 87 1HA GLY 87 -28.992 -3.754 -5.336 599 HA3 GLY 87 2HA GLY 87 -28.578 -5.326 -6.035 600 H VAL 88 H VAL 88 -26.754 -3.917 -3.332 601 HA VAL 88 HA VAL 88 -28.284 -5.290 -1.303 602 HB VAL 88 HB VAL 88 -26.927 -7.119 -1.746 603 HG11 VAL 88 1HG1 VAL 88 -25.280 -6.318 -3.228 604 HG12 VAL 88 2HG1 VAL 88 -24.583 -5.236 -2.000 605 HG13 VAL 88 3HG1 VAL 88 -24.408 -6.995 -1.845 606 HG21 VAL 88 3HG2 VAL 88 -25.340 -5.710 0.426 607 HG22 VAL 88 1HG2 VAL 88 -26.977 -6.361 0.679 608 HG23 VAL 88 2HG2 VAL 88 -25.637 -7.448 0.239 609 H VAL 89 H VAL 89 -28.391 -3.923 0.422 610 HA VAL 89 HA VAL 89 -26.936 -1.443 0.352 611 HB VAL 89 HB VAL 89 -29.236 -1.742 1.234 612 HG11 VAL 89 1HG1 VAL 89 -28.964 -3.871 2.482 613 HG12 VAL 89 2HG1 VAL 89 -27.964 -3.034 3.682 614 HG13 VAL 89 3HG1 VAL 89 -29.672 -2.589 3.472 615 HG21 VAL 89 3HG2 VAL 89 -27.946 0.243 1.799 616 HG22 VAL 89 1HG2 VAL 89 -29.006 -0.238 3.142 617 HG23 VAL 89 2HG2 VAL 89 -27.273 -0.567 3.229 618 H ASN 90 H ASN 90 -25.252 -0.734 1.735 619 HA ASN 90 HA ASN 90 -23.940 -2.655 3.501 620 HB2 ASN 90 1HB ASN 90 -23.064 -2.697 0.955 621 HB3 ASN 90 2HB ASN 90 -22.139 -1.296 1.499 622 HD21 ASN 90 1HD2 ASN 90 -21.787 -4.504 1.015 623 HD22 ASN 90 2HD2 ASN 90 -20.821 -4.965 2.414 624 H GLU 91 H GLU 91 -21.610 -1.046 3.943 625 HA GLU 91 HA GLU 91 -22.567 1.659 4.556 626 HB2 GLU 91 1HB GLU 91 -21.346 -0.342 6.492 627 HB3 GLU 91 2HB GLU 91 -20.871 1.338 6.615 628 HG2 GLU 91 1HG GLU 91 -23.615 1.604 6.413 629 HG3 GLU 91 2HG GLU 91 -23.473 0.056 7.235 630 HA PRO 92 HA PRO 92 -18.740 2.589 2.675 631 HB2 PRO 92 1HB PRO 92 -18.137 5.108 3.588 632 HB3 PRO 92 2HB PRO 92 -19.689 4.785 2.745 633 HG2 PRO 92 1HG PRO 92 -19.221 4.833 5.741 634 HG3 PRO 92 2HG PRO 92 -20.438 5.762 4.800 635 HD2 PRO 92 1HD PRO 92 -21.028 3.379 5.969 636 HD3 PRO 92 2HD PRO 92 -21.729 3.839 4.390 637 H MET 93 H MET 93 -16.359 3.548 3.120 638 HA MET 93 HA MET 93 -15.333 2.272 5.559 639 HB2 MET 93 1HB MET 93 -14.082 0.747 4.468 640 HB3 MET 93 2HB MET 93 -15.530 0.736 3.494 641 HG2 MET 93 1HG MET 93 -14.571 1.722 1.669 642 HG3 MET 93 2HG MET 93 -13.263 2.468 2.577 643 HE1 MET 93 3HE MET 93 -11.054 1.439 3.208 644 HE2 MET 93 1HE MET 93 -11.990 0.483 4.373 645 HE3 MET 93 2HE MET 93 -10.774 -0.301 3.370 646 H GLN 94 H GLN 94 -12.860 2.641 5.597 647 HA GLN 94 HA GLN 94 -11.979 5.053 4.158 648 HB2 GLN 94 1HB GLN 94 -12.034 4.728 7.177 649 HB3 GLN 94 2HB GLN 94 -10.841 5.775 6.392 650 HG2 GLN 94 1HG GLN 94 -12.577 7.153 5.440 651 HG3 GLN 94 2HG GLN 94 -13.847 6.055 6.020 652 HE21 GLN 94 1HE2 GLN 94 -13.046 9.061 6.636 653 HE22 GLN 94 2HE2 GLN 94 -13.253 9.045 8.387 654 H TRP 95 H TRP 95 -9.786 5.154 3.908 655 HA TRP 95 HA TRP 95 -8.148 2.768 4.613 656 HB2 TRP 95 1HB TRP 95 -8.509 4.155 1.959 657 HB3 TRP 95 2HB TRP 95 -6.870 3.841 2.450 658 HD1 TRP 95 HD TRP 95 -8.867 0.952 3.567 659 HE1 TRP 95 1HE TRP 95 -8.688 -0.996 1.909 660 HE3 TRP 95 3HE TRP 95 -6.551 3.415 -0.289 661 HZ2 TRP 95 2HZ TRP 95 -7.296 -1.507 -0.600 662 HZ3 TRP 95 3HZ TRP 95 -5.753 2.145 -2.266 663 HH2 TRP 95 HH TRP 95 -6.114 -0.310 -2.419 664 H VAL 96 H VAL 96 -6.392 3.418 5.748 665 HA VAL 96 HA VAL 96 -5.688 6.307 5.774 666 HB VAL 96 HB VAL 96 -5.923 4.366 8.111 667 HG11 VAL 96 1HG1 VAL 96 -5.506 6.361 9.510 668 HG12 VAL 96 2HG1 VAL 96 -4.145 5.976 8.461 669 HG13 VAL 96 3HG1 VAL 96 -5.242 7.324 8.043 670 HG21 VAL 96 3HG2 VAL 96 -7.747 5.841 8.908 671 HG22 VAL 96 1HG2 VAL 96 -7.707 6.684 7.339 672 HG23 VAL 96 2HG2 VAL 96 -8.158 4.968 7.443 673 H VAL 97 H VAL 97 -3.652 6.424 4.813 674 HA VAL 97 HA VAL 97 -1.948 3.962 4.927 675 HB VAL 97 HB VAL 97 -2.238 5.583 2.426 676 HG11 VAL 97 1HG1 VAL 97 -2.057 2.591 2.756 677 HG12 VAL 97 2HG1 VAL 97 -1.686 3.558 1.313 678 HG13 VAL 97 3HG1 VAL 97 -0.651 3.627 2.757 679 HG21 VAL 97 3HG2 VAL 97 -4.588 5.347 2.734 680 HG22 VAL 97 1HG2 VAL 97 -4.087 4.148 1.542 681 HG23 VAL 97 2HG2 VAL 97 -4.424 3.661 3.218 682 H THR 98 H THR 98 0.034 4.468 5.600 683 HA THR 98 HA THR 98 0.828 7.341 5.637 684 HB THR 98 HB THR 98 1.834 5.107 7.411 685 HG1 THR 98 1HG THR 98 0.240 5.514 8.819 686 HG21 THR 98 3HG2 THR 98 3.143 7.216 7.533 687 HG22 THR 98 1HG2 THR 98 2.289 6.875 9.037 688 HG23 THR 98 2HG2 THR 98 1.646 8.096 7.934 689 H VAL 99 H VAL 99 3.182 7.774 5.298 690 HA VAL 99 HA VAL 99 4.753 5.463 4.307 691 HB VAL 99 HB VAL 99 4.866 8.222 3.044 692 HG11 VAL 99 1HG1 VAL 99 7.124 7.397 3.247 693 HG12 VAL 99 2HG1 VAL 99 6.642 5.791 2.675 694 HG13 VAL 99 3HG1 VAL 99 6.614 7.184 1.575 695 HG21 VAL 99 3HG2 VAL 99 3.037 6.976 2.103 696 HG22 VAL 99 1HG2 VAL 99 4.359 6.919 0.945 697 HG23 VAL 99 2HG2 VAL 99 4.040 5.504 1.953 698 H TYR 100 H TYR 100 6.486 5.171 5.467 699 HA TYR 100 HA TYR 100 7.609 7.309 7.162 700 HB2 TYR 100 1HB TYR 100 7.989 4.275 7.183 701 HB3 TYR 100 2HB TYR 100 8.873 5.412 8.187 702 HD1 TYR 100 2HD TYR 100 5.349 4.262 7.425 703 HD2 TYR 100 1HD TYR 100 8.051 5.922 10.334 704 HE1 TYR 100 2HE TYR 100 3.450 4.618 8.973 705 HE2 TYR 100 1HE TYR 100 6.161 6.324 11.870 706 HH TYR 100 HH TYR 100 3.878 6.499 11.982 707 H LYS 101 H LYS 101 9.670 8.053 6.496 708 HA LYS 101 HA LYS 101 10.679 6.997 3.953 709 HB2 LYS 101 1HB LYS 101 10.089 9.507 4.567 710 HB3 LYS 101 2HB LYS 101 11.574 9.472 5.505 711 HG2 LYS 101 1HG LYS 101 11.891 10.462 3.298 712 HG3 LYS 101 2HG LYS 101 12.814 8.973 3.500 713 HD2 LYS 101 1HD LYS 101 11.404 7.737 2.046 714 HD3 LYS 101 2HD LYS 101 10.119 8.953 2.085 715 HE2 LYS 101 1HE LYS 101 12.874 9.577 0.974 716 HE3 LYS 101 2HE LYS 101 11.709 8.720 -0.009 717 HZ1 LYS 101 3HZ LYS 101 11.682 11.092 -0.374 718 HZ2 LYS 101 1HZ LYS 101 11.232 11.406 1.174 719 HZ3 LYS 101 2HZ LYS 101 10.219 10.620 0.168 720 H ASN 102 H ASN 102 13.286 7.339 4.217 721 HA ASN 102 HA ASN 102 14.423 5.501 6.025 722 HB2 ASN 102 1HB ASN 102 16.590 6.734 5.455 723 HB3 ASN 102 2HB ASN 102 15.783 5.832 4.218 724 HD21 ASN 102 1HD2 ASN 102 14.472 7.060 2.563 725 HD22 ASN 102 2HD2 ASN 102 15.081 8.646 2.119 726 H GLY 103 H GLY 103 13.245 6.293 7.945 727 HA2 GLY 103 1HA GLY 103 14.727 7.227 10.004 728 HA3 GLY 103 2HA GLY 103 14.090 8.741 9.313 729 H LYS 104 H LYS 104 11.608 8.667 8.896 730 HA LYS 104 HA LYS 104 10.046 7.238 10.883 731 HB2 LYS 104 1HB LYS 104 9.526 8.989 12.263 732 HB3 LYS 104 2HB LYS 104 11.271 8.993 12.140 733 HG2 LYS 104 1HG LYS 104 11.302 11.081 11.388 734 HG3 LYS 104 2HG LYS 104 10.267 10.723 10.029 735 HD2 LYS 104 1HD LYS 104 9.076 12.367 11.270 736 HD3 LYS 104 2HD LYS 104 8.281 10.808 11.605 737 HE2 LYS 104 1HE LYS 104 10.037 10.744 13.610 738 HE3 LYS 104 2HE LYS 104 10.082 12.486 13.363 739 HZ1 LYS 104 3HZ LYS 104 8.488 11.759 15.026 740 HZ2 LYS 104 1HZ LYS 104 7.644 10.888 13.923 741 HZ3 LYS 104 2HZ LYS 104 7.706 12.538 13.765 742 H GLU 105 H GLU 105 7.791 8.521 10.953 743 HA GLU 105 HA GLU 105 6.409 8.308 8.546 744 HB2 GLU 105 1HB GLU 105 5.461 8.509 10.873 745 HB3 GLU 105 2HB GLU 105 5.850 10.218 10.844 746 HG2 GLU 105 1HG GLU 105 4.332 9.572 8.440 747 HG3 GLU 105 2HG GLU 105 3.544 8.844 9.819 748 H ILE 106 H ILE 106 6.005 9.732 6.835 749 HA ILE 106 HA ILE 106 6.742 12.596 7.181 750 HB ILE 106 HB ILE 106 7.366 12.588 4.771 751 HG12 ILE 106 1HG1 ILE 106 7.794 9.584 4.988 752 HG13 ILE 106 2HG1 ILE 106 6.286 10.235 4.366 753 HG21 ILE 106 1HG2 ILE 106 9.672 11.889 5.192 754 HG22 ILE 106 2HG2 ILE 106 9.016 12.639 6.652 755 HG23 ILE 106 3HG2 ILE 106 9.160 10.879 6.567 756 HD11 ILE 106 3HD1 ILE 106 7.812 9.699 2.555 757 HD12 ILE 106 1HD1 ILE 106 7.384 11.425 2.600 758 HD13 ILE 106 2HD1 ILE 106 8.978 10.890 3.165 759 H GLU 107 H GLU 107 4.420 10.155 5.962 760 HA GLU 107 HA GLU 107 2.728 12.354 4.953 761 HB2 GLU 107 1HB GLU 107 4.211 11.852 3.117 762 HB3 GLU 107 2HB GLU 107 4.043 10.129 3.380 763 HG2 GLU 107 1HG GLU 107 2.870 10.714 1.406 764 HG3 GLU 107 2HG GLU 107 1.707 10.203 2.616 765 H LYS 108 H LYS 108 0.597 11.764 4.456 766 HA LYS 108 HA LYS 108 -0.533 9.455 5.942 767 HB2 LYS 108 1HB LYS 108 -1.737 11.157 7.387 768 HB3 LYS 108 2HB LYS 108 -0.016 10.968 7.705 769 HG2 LYS 108 1HG LYS 108 0.500 13.045 6.485 770 HG3 LYS 108 2HG LYS 108 -1.190 13.216 6.002 771 HD2 LYS 108 1HD LYS 108 -1.736 13.341 8.508 772 HD3 LYS 108 2HD LYS 108 0.011 13.497 8.767 773 HE2 LYS 108 1HE LYS 108 -0.025 15.391 7.048 774 HE3 LYS 108 2HE LYS 108 -1.795 15.267 7.038 775 HZ1 LYS 108 3HZ LYS 108 -0.102 15.953 9.343 776 HZ2 LYS 108 1HZ LYS 108 -1.758 15.818 9.401 777 HZ3 LYS 108 2HZ LYS 108 -1.047 16.998 8.494 778 H LYS 109 H LYS 109 -1.211 9.095 3.611 779 HA LYS 109 HA LYS 109 -3.370 10.896 2.627 780 HB2 LYS 109 1HB LYS 109 -1.738 8.651 1.447 781 HB3 LYS 109 2HB LYS 109 -3.346 8.934 0.808 782 HG2 LYS 109 1HG LYS 109 -1.651 11.384 1.186 783 HG3 LYS 109 2HG LYS 109 -1.122 10.290 -0.077 784 HD2 LYS 109 1HD LYS 109 -4.048 11.113 0.075 785 HD3 LYS 109 2HD LYS 109 -2.822 12.190 -0.657 786 HE2 LYS 109 1HE LYS 109 -2.145 10.118 -2.071 787 HE3 LYS 109 2HE LYS 109 -3.630 9.378 -1.489 788 HZ1 LYS 109 3HZ LYS 109 -4.803 11.387 -2.411 789 HZ2 LYS 109 1HZ LYS 109 -4.146 10.416 -3.553 790 HZ3 LYS 109 2HZ LYS 109 -3.420 11.825 -3.144 791 H SER 110 H SER 110 -5.367 10.544 3.577 792 HA SER 110 HA SER 110 -6.255 7.796 3.854 793 HB2 SER 110 1HB SER 110 -7.668 9.485 5.632 794 HB3 SER 110 2HB SER 110 -6.369 8.347 5.988 795 HG SER 110 HG SER 110 -5.034 9.817 6.427 796 H LEU 111 H LEU 111 -8.197 7.256 3.006 797 HA LEU 111 HA LEU 111 -9.777 9.289 1.699 798 HB2 LEU 111 1HB LEU 111 -9.573 6.521 0.600 799 HB3 LEU 111 2HB LEU 111 -10.228 7.990 -0.128 800 HG LEU 111 HG LEU 111 -7.792 8.974 0.152 801 HD11 LEU 111 1HD1 LEU 111 -6.103 7.441 0.413 802 HD12 LEU 111 2HD1 LEU 111 -7.083 6.072 -0.281 803 HD13 LEU 111 3HD1 LEU 111 -7.408 6.625 1.363 804 HD21 LEU 111 3HD2 LEU 111 -7.141 7.962 -1.956 805 HD22 LEU 111 1HD2 LEU 111 -8.836 8.524 -1.996 806 HD23 LEU 111 2HD2 LEU 111 -8.469 6.781 -1.789 807 H VAL 112 H VAL 112 -11.752 7.799 0.936 808 HA VAL 112 HA VAL 112 -13.140 6.604 3.258 809 HB VAL 112 HB VAL 112 -12.887 8.949 3.786 810 HG11 VAL 112 1HG1 VAL 112 -14.146 10.723 2.720 811 HG12 VAL 112 2HG1 VAL 112 -12.989 9.992 1.588 812 HG13 VAL 112 3HG1 VAL 112 -14.714 9.614 1.465 813 HG21 VAL 112 3HG2 VAL 112 -14.848 7.583 4.627 814 HG22 VAL 112 1HG2 VAL 112 -14.994 9.349 4.705 815 HG23 VAL 112 2HG2 VAL 112 -15.836 8.424 3.440 816 H PHE 113 H PHE 113 -12.879 5.278 0.965 817 HA PHE 113 HA PHE 113 -14.925 5.936 -0.981 818 HB2 PHE 113 1HB PHE 113 -12.563 4.259 -0.888 819 HB3 PHE 113 2HB PHE 113 -13.919 3.332 -1.520 820 HD1 PHE 113 1HD PHE 113 -11.697 6.247 -2.023 821 HD2 PHE 113 2HD PHE 113 -15.053 4.037 -3.612 822 HE1 PHE 113 1HE PHE 113 -11.426 7.398 -4.198 823 HE2 PHE 113 2HE PHE 113 -14.854 5.269 -5.725 824 HZ PHE 113 HZ PHE 113 -12.985 6.898 -6.065 825 H ARG 114 H ARG 114 -16.322 3.921 -1.846 826 HA ARG 114 HA ARG 114 -17.790 2.746 0.387 827 HB2 ARG 114 1HB ARG 114 -19.259 4.616 -1.503 828 HB3 ARG 114 2HB ARG 114 -19.812 3.917 0.014 829 HG2 ARG 114 1HG ARG 114 -18.100 5.396 1.190 830 HG3 ARG 114 2HG ARG 114 -17.879 6.227 -0.350 831 HD2 ARG 114 1HD ARG 114 -20.566 5.858 1.036 832 HD3 ARG 114 2HD ARG 114 -19.580 7.306 1.192 833 HE ARG 114 HE ARG 114 -21.176 6.417 -1.069 834 HH11 ARG 114 1HH1 ARG 114 -18.566 8.673 -0.066 835 HH12 ARG 114 2HH1 ARG 114 -18.666 9.627 -1.491 836 HH21 ARG 114 1HH2 ARG 114 -21.500 7.850 -2.788 837 HH22 ARG 114 2HH2 ARG 114 -20.569 9.315 -2.948 838 H ASP 115 H ASP 115 -19.870 1.846 -0.519 839 HA ASP 115 HA ASP 115 -19.542 -0.181 -2.443 840 HB2 ASP 115 1HB ASP 115 -21.923 -0.554 -1.832 841 HB3 ASP 115 2HB ASP 115 -20.941 -0.289 -0.387 842 H GLY 116 H GLY 116 -20.930 -0.644 -4.186 843 HA2 GLY 116 1HA GLY 116 -22.897 -0.094 -5.331 844 HA3 GLY 116 2HA GLY 116 -22.399 1.602 -5.443 845 H LYS 117 H LYS 117 -19.616 1.198 -6.659 846 HA LYS 117 HA LYS 117 -20.256 -0.207 -8.938 847 HB2 LYS 117 1HB LYS 117 -19.120 2.422 -9.582 848 HB3 LYS 117 2HB LYS 117 -19.936 1.166 -10.444 849 HG2 LYS 117 1HG LYS 117 -21.355 3.101 -10.434 850 HG3 LYS 117 2HG LYS 117 -22.130 1.833 -9.457 851 HD2 LYS 117 1HD LYS 117 -21.718 2.887 -7.492 852 HD3 LYS 117 2HD LYS 117 -20.134 3.416 -8.028 853 HE2 LYS 117 1HE LYS 117 -21.281 5.504 -7.870 854 HE3 LYS 117 2HE LYS 117 -21.529 5.099 -9.577 855 HZ1 LYS 117 3HZ LYS 117 -23.717 4.056 -8.700 856 HZ2 LYS 117 1HZ LYS 117 -23.591 5.707 -8.753 857 HZ3 LYS 117 2HZ LYS 117 -23.386 4.919 -7.322 858 H GLU 118 H GLU 118 -18.135 0.542 -10.346 859 HA GLU 118 HA GLU 118 -15.831 -0.494 -8.778 860 HB2 GLU 118 1HB GLU 118 -15.067 -1.646 -10.828 861 HB3 GLU 118 2HB GLU 118 -16.579 -2.295 -10.188 862 HG2 GLU 118 1HG GLU 118 -17.872 -1.100 -11.914 863 HG3 GLU 118 2HG GLU 118 -16.394 -0.344 -12.528 864 H ILE 119 H ILE 119 -13.911 0.576 -9.036 865 HA ILE 119 HA ILE 119 -13.482 2.492 -11.126 866 HB ILE 119 HB ILE 119 -12.878 4.318 -9.635 867 HG12 ILE 119 1HG1 ILE 119 -13.925 4.166 -7.278 868 HG13 ILE 119 2HG1 ILE 119 -13.802 2.431 -7.480 869 HG21 ILE 119 1HG2 ILE 119 -15.152 4.333 -10.609 870 HG22 ILE 119 2HG2 ILE 119 -15.775 3.568 -9.133 871 HG23 ILE 119 3HG2 ILE 119 -15.055 5.179 -9.064 872 HD11 ILE 119 3HD1 ILE 119 -11.888 3.900 -6.334 873 HD12 ILE 119 1HD1 ILE 119 -11.528 2.418 -7.235 874 HD13 ILE 119 2HD1 ILE 119 -11.319 4.022 -8.002 875 H SER 120 H SER 120 -11.281 3.226 -10.930 876 HA SER 120 HA SER 120 -9.421 2.016 -9.124 877 HB2 SER 120 1HB SER 120 -8.241 0.835 -11.221 878 HB3 SER 120 2HB SER 120 -9.390 0.047 -10.143 879 HG SER 120 HG SER 120 -9.684 0.788 -12.800 880 H THR 121 H THR 121 -10.141 4.554 -10.587 881 HA THR 121 HA THR 121 -7.394 5.374 -11.393 882 HB THR 121 HB THR 121 -9.039 6.531 -13.324 883 HG1 THR 121 1HG THR 121 -10.803 5.232 -13.002 884 HG21 THR 121 3HG2 THR 121 -8.062 4.890 -14.832 885 HG22 THR 121 1HG2 THR 121 -7.546 3.888 -13.455 886 HG23 THR 121 2HG2 THR 121 -6.836 5.502 -13.696 887 H ASP 122 H ASP 122 -9.680 6.401 -9.303 888 HA ASP 122 HA ASP 122 -8.142 8.811 -9.059 889 HB2 ASP 122 1HB ASP 122 -9.994 9.777 -10.385 890 HB3 ASP 122 2HB ASP 122 -11.146 9.244 -9.148 891 H ASP 123 H ASP 123 -7.618 6.914 -7.690 892 HA ASP 123 HA ASP 123 -8.920 7.066 -5.042 893 HB2 ASP 123 1HB ASP 123 -7.878 4.765 -4.755 894 HB3 ASP 123 2HB ASP 123 -9.376 4.894 -5.699 895 H LEU 124 H LEU 124 -5.838 5.686 -6.225 896 HA LEU 124 HA LEU 124 -4.337 7.481 -4.377 897 HB2 LEU 124 1HB LEU 124 -5.172 5.026 -3.594 898 HB3 LEU 124 2HB LEU 124 -3.729 4.559 -4.490 899 HG LEU 124 HG LEU 124 -2.479 6.286 -3.032 900 HD11 LEU 124 1HD1 LEU 124 -4.487 7.486 -2.188 901 HD12 LEU 124 2HD1 LEU 124 -3.661 6.715 -0.819 902 HD13 LEU 124 3HD1 LEU 124 -5.122 5.977 -1.502 903 HD21 LEU 124 3HD2 LEU 124 -3.771 3.838 -1.749 904 HD22 LEU 124 1HD2 LEU 124 -2.322 4.676 -1.150 905 HD23 LEU 124 2HD2 LEU 124 -2.282 3.858 -2.720 906 H ASN 125 H ASN 125 -2.723 8.364 -5.541 907 HA ASN 125 HA ASN 125 -1.114 6.584 -7.235 908 HB2 ASN 125 1HB ASN 125 -2.597 7.676 -8.878 909 HB3 ASN 125 2HB ASN 125 -2.038 9.267 -8.328 910 HD21 ASN 125 1HD2 ASN 125 -0.048 10.020 -9.186 911 HD22 ASN 125 2HD2 ASN 125 1.004 9.032 -10.196 912 H LEU 126 H LEU 126 0.249 6.654 -5.327 913 HA LEU 126 HA LEU 126 1.695 9.224 -5.022 914 HB2 LEU 126 1HB LEU 126 0.459 7.567 -3.074 915 HB3 LEU 126 2HB LEU 126 2.168 7.157 -3.012 916 HG LEU 126 HG LEU 126 2.672 9.633 -2.800 917 HD11 LEU 126 1HD1 LEU 126 0.810 11.092 -1.966 918 HD12 LEU 126 2HD1 LEU 126 -0.321 9.846 -2.549 919 HD13 LEU 126 3HD1 LEU 126 0.721 10.697 -3.694 920 HD21 LEU 126 3HD2 LEU 126 2.597 8.027 -0.915 921 HD22 LEU 126 1HD2 LEU 126 0.904 8.434 -0.655 922 HD23 LEU 126 2HD2 LEU 126 2.135 9.683 -0.435 923 H TYR 127 H TYR 127 3.960 9.081 -4.940 924 HA TYR 127 HA TYR 127 5.317 6.621 -5.677 925 HB2 TYR 127 1HB TYR 127 4.412 8.307 -7.751 926 HB3 TYR 127 2HB TYR 127 6.092 8.739 -7.543 927 HD1 TYR 127 2HD TYR 127 7.841 6.791 -7.522 928 HD2 TYR 127 1HD TYR 127 3.823 6.440 -9.065 929 HE1 TYR 127 2HE TYR 127 8.575 4.957 -9.013 930 HE2 TYR 127 1HE TYR 127 4.556 4.602 -10.534 931 HH TYR 127 HH TYR 127 7.873 3.867 -11.110 932 H TYR 128 H TYR 128 7.187 6.614 -4.613 933 HA TYR 128 HA TYR 128 8.329 9.160 -3.607 934 HB2 TYR 128 1HB TYR 128 7.781 6.504 -2.272 935 HB3 TYR 128 2HB TYR 128 9.263 7.346 -1.845 936 HD1 TYR 128 1HD TYR 128 9.211 9.718 -1.162 937 HD2 TYR 128 2HD TYR 128 5.686 7.264 -1.325 938 HE1 TYR 128 1HE TYR 128 7.979 11.428 0.185 939 HE2 TYR 128 2HE TYR 128 4.410 9.049 -0.085 940 HH TYR 128 HH TYR 128 4.542 11.588 0.211 941 H ASN 129 H ASN 129 10.592 9.059 -3.125 942 HA ASN 129 HA ASN 129 12.280 7.021 -4.004 943 HB2 ASN 129 1HB ASN 129 13.600 8.055 -5.495 944 HB3 ASN 129 2HB ASN 129 12.017 8.360 -6.189 945 HD21 ASN 129 1HD2 ASN 129 11.408 10.624 -4.402 946 HD22 ASN 129 2HD2 ASN 129 12.354 11.945 -5.064 Start of MODEL 12 1 H1 GLY 1 H GLY 1 31.744 -9.320 1.385 2 HA2 GLY 1 1HA GLY 1 34.197 -8.113 2.568 3 HA3 GLY 1 2HA GLY 1 34.043 -9.861 2.217 4 H ASP 2 H ASP 2 34.265 -6.540 0.701 5 HA ASP 2 HA ASP 2 34.449 -7.498 -1.976 6 HB2 ASP 2 1HB ASP 2 32.233 -5.631 -0.980 7 HB3 ASP 2 2HB ASP 2 32.557 -6.105 -2.640 8 H ASP 3 H ASP 3 35.463 -5.785 -3.052 9 HA ASP 3 HA ASP 3 36.342 -3.450 -1.494 10 HB2 ASP 3 1HB ASP 3 38.299 -3.454 -2.924 11 HB3 ASP 3 2HB ASP 3 38.091 -4.994 -2.095 12 H ASP 4 H ASP 4 33.804 -3.949 -3.156 13 HA ASP 4 HA ASP 4 33.777 -1.351 -4.529 14 HB2 ASP 4 1HB ASP 4 34.089 -2.966 -6.345 15 HB3 ASP 4 2HB ASP 4 32.790 -3.978 -5.719 16 H GLU 5 H GLU 5 31.519 -0.671 -4.775 17 HA GLU 5 HA GLU 5 29.355 -2.020 -3.578 18 HB2 GLU 5 1HB GLU 5 30.086 -1.054 -1.420 19 HB3 GLU 5 2HB GLU 5 30.007 0.580 -2.119 20 HG2 GLU 5 1HG GLU 5 27.553 0.124 -2.693 21 HG3 GLU 5 2HG GLU 5 27.705 -1.432 -1.894 22 HA PRO 6 HA PRO 6 28.863 0.809 -7.131 23 HB2 PRO 6 1HB PRO 6 27.717 -0.841 -8.902 24 HB3 PRO 6 2HB PRO 6 29.407 -1.104 -8.362 25 HG2 PRO 6 1HG PRO 6 26.906 -2.470 -7.296 26 HG3 PRO 6 2HG PRO 6 28.415 -3.230 -7.904 27 HD2 PRO 6 1HD PRO 6 27.930 -2.657 -5.235 28 HD3 PRO 6 2HD PRO 6 29.569 -2.687 -5.924 29 H GLY 7 H GLY 7 26.660 1.116 -8.582 30 HA2 GLY 7 1HA GLY 7 24.343 1.182 -8.709 31 HA3 GLY 7 2HA GLY 7 24.212 0.547 -7.066 32 H GLY 8 H GLY 8 26.292 2.844 -6.395 33 HA2 GLY 8 1HA GLY 8 26.325 5.180 -6.124 34 HA3 GLY 8 2HA GLY 8 24.647 5.280 -6.691 35 H LYS 9 H LYS 9 23.280 5.853 -5.043 36 HA LYS 9 HA LYS 9 23.221 4.365 -2.601 37 HB2 LYS 9 1HB LYS 9 24.760 6.455 -2.212 38 HB3 LYS 9 2HB LYS 9 23.323 7.420 -2.548 39 HG2 LYS 9 1HG LYS 9 22.294 5.860 -0.601 40 HG3 LYS 9 2HG LYS 9 23.984 5.658 -0.210 41 HD2 LYS 9 1HD LYS 9 23.096 7.417 1.144 42 HD3 LYS 9 2HD LYS 9 24.155 8.186 -0.019 43 HE2 LYS 9 1HE LYS 9 22.401 9.235 -1.140 44 HE3 LYS 9 2HE LYS 9 21.320 7.861 -0.896 45 HZ1 LYS 9 3HZ LYS 9 20.457 9.588 0.356 46 HZ2 LYS 9 1HZ LYS 9 21.890 9.959 1.088 47 HZ3 LYS 9 2HZ LYS 9 21.092 8.543 1.429 48 H GLY 10 H GLY 10 20.978 4.778 -1.720 49 HA2 GLY 10 1HA GLY 10 19.568 7.040 -2.855 50 HA3 GLY 10 2HA GLY 10 18.735 5.509 -3.130 51 H ALA 11 H ALA 11 17.440 4.832 -1.625 52 HA ALA 11 HA ALA 11 17.451 6.199 1.039 53 HB1 ALA 11 1HB ALA 11 15.068 6.044 -0.848 54 HB2 ALA 11 2HB ALA 11 15.113 6.800 0.768 55 HB3 ALA 11 3HB ALA 11 16.062 7.486 -0.556 56 H MET 12 H MET 12 14.930 5.071 1.818 57 HA MET 12 HA MET 12 14.824 2.279 1.248 58 HB2 MET 12 1HB MET 12 14.693 3.280 4.136 59 HB3 MET 12 2HB MET 12 14.375 1.669 3.533 60 HG2 MET 12 1HG MET 12 16.768 1.806 2.584 61 HG3 MET 12 2HG MET 12 17.044 3.136 3.656 62 HE1 MET 12 3HE MET 12 15.474 -0.409 3.645 63 HE2 MET 12 1HE MET 12 15.970 -1.122 5.194 64 HE3 MET 12 2HE MET 12 14.747 0.166 5.145 65 H TYR 13 H TYR 13 12.511 1.614 1.844 66 HA TYR 13 HA TYR 13 10.730 3.868 2.427 67 HB2 TYR 13 1HB TYR 13 10.450 2.028 0.020 68 HB3 TYR 13 2HB TYR 13 9.155 3.010 0.677 69 HD1 TYR 13 2HD TYR 13 9.769 5.587 1.062 70 HD2 TYR 13 1HD TYR 13 11.539 2.973 -1.866 71 HE1 TYR 13 2HE TYR 13 10.289 7.537 -0.359 72 HE2 TYR 13 1HE TYR 13 11.969 4.902 -3.376 73 HH TYR 13 HH TYR 13 11.911 7.244 -3.551 74 H GLU 14 H GLU 14 8.881 3.228 3.504 75 HA GLU 14 HA GLU 14 8.324 0.422 4.108 76 HB2 GLU 14 1HB GLU 14 9.714 1.010 5.981 77 HB3 GLU 14 2HB GLU 14 9.168 2.668 5.952 78 HG2 GLU 14 1HG GLU 14 6.862 1.737 6.762 79 HG3 GLU 14 2HG GLU 14 7.761 0.239 7.068 80 H VAL 15 H VAL 15 6.156 0.252 4.187 81 HA VAL 15 HA VAL 15 4.457 2.710 4.407 82 HB VAL 15 HB VAL 15 4.510 2.025 1.953 83 HG11 VAL 15 1HG1 VAL 15 3.022 -0.467 2.927 84 HG12 VAL 15 2HG1 VAL 15 3.390 -0.013 1.259 85 HG13 VAL 15 3HG1 VAL 15 4.696 -0.456 2.350 86 HG21 VAL 15 3HG2 VAL 15 2.606 3.260 2.758 87 HG22 VAL 15 1HG2 VAL 15 2.174 2.106 1.502 88 HG23 VAL 15 2HG2 VAL 15 1.793 1.748 3.195 89 H THR 16 H THR 16 2.428 2.323 5.420 90 HA THR 16 HA THR 16 1.950 -0.454 6.410 91 HB THR 16 HB THR 16 0.703 0.828 8.311 92 HG1 THR 16 1HG THR 16 0.956 2.923 7.821 93 HG21 THR 16 3HG2 THR 16 3.739 0.565 8.196 94 HG22 THR 16 1HG2 THR 16 2.551 -0.624 8.795 95 HG23 THR 16 2HG2 THR 16 2.818 0.877 9.678 96 H ILE 17 H ILE 17 -0.311 -1.135 6.229 97 HA ILE 17 HA ILE 17 -2.104 1.067 5.559 98 HB ILE 17 HB ILE 17 -1.723 -0.799 3.846 99 HG12 ILE 17 1HG1 ILE 17 -4.625 -0.369 4.724 100 HG13 ILE 17 2HG1 ILE 17 -3.622 0.966 4.083 101 HG21 ILE 17 1HG2 ILE 17 -3.639 -2.388 5.581 102 HG22 ILE 17 2HG2 ILE 17 -2.873 -2.867 4.052 103 HG23 ILE 17 3HG2 ILE 17 -1.891 -2.646 5.501 104 HD11 ILE 17 3HD1 ILE 17 -4.717 0.049 2.313 105 HD12 ILE 17 1HD1 ILE 17 -3.012 -0.424 2.180 106 HD13 ILE 17 2HD1 ILE 17 -4.239 -1.625 2.709 107 H GLU 18 H GLU 18 -4.133 0.970 6.605 108 HA GLU 18 HA GLU 18 -4.669 -1.165 8.535 109 HB2 GLU 18 1HB GLU 18 -4.575 1.790 9.247 110 HB3 GLU 18 2HB GLU 18 -5.531 0.628 10.141 111 HG2 GLU 18 1HG GLU 18 -3.299 -0.797 10.255 112 HG3 GLU 18 2HG GLU 18 -2.497 0.659 9.671 113 H GLN 19 H GLN 19 -6.729 -1.793 8.369 114 HA GLN 19 HA GLN 19 -8.362 -0.567 6.204 115 HB2 GLN 19 1HB GLN 19 -7.905 -3.462 7.081 116 HB3 GLN 19 2HB GLN 19 -9.086 -2.962 5.868 117 HG2 GLN 19 1HG GLN 19 -7.341 -2.229 4.363 118 HG3 GLN 19 2HG GLN 19 -6.110 -2.406 5.605 119 HE21 GLN 19 1HE2 GLN 19 -8.701 -4.805 4.683 120 HE22 GLN 19 2HE2 GLN 19 -7.563 -6.043 4.258 121 H SER 20 H SER 20 -10.110 0.506 7.258 122 HA SER 20 HA SER 20 -11.697 -1.245 8.977 123 HB2 SER 20 1HB SER 20 -11.907 0.480 10.749 124 HB3 SER 20 2HB SER 20 -10.205 0.070 10.506 125 HG SER 20 HG SER 20 -10.102 2.196 10.423 126 H GLY 21 H GLY 21 -13.748 0.163 9.720 127 HA2 GLY 21 1HA GLY 21 -15.871 0.284 8.906 128 HA3 GLY 21 2HA GLY 21 -15.286 1.076 7.444 129 H ASP 22 H ASP 22 -16.621 -0.398 6.072 130 HA ASP 22 HA ASP 22 -16.446 -3.266 6.584 131 HB2 ASP 22 1HB ASP 22 -18.578 -2.091 6.137 132 HB3 ASP 22 2HB ASP 22 -18.050 -1.702 4.498 133 H PHE 23 H PHE 23 -14.548 -4.333 5.724 134 HA PHE 23 HA PHE 23 -13.739 -3.417 2.997 135 HB2 PHE 23 1HB PHE 23 -11.519 -3.839 3.496 136 HB3 PHE 23 2HB PHE 23 -12.198 -2.954 4.848 137 HD1 PHE 23 1HD PHE 23 -11.112 -6.377 3.721 138 HD2 PHE 23 2HD PHE 23 -11.898 -3.748 7.060 139 HE1 PHE 23 1HE PHE 23 -10.075 -7.999 5.244 140 HE2 PHE 23 2HE PHE 23 -10.862 -5.398 8.587 141 HZ PHE 23 HZ PHE 23 -9.957 -7.547 7.665 142 H ARG 24 H ARG 24 -15.385 -5.985 4.149 143 HA ARG 24 HA ARG 24 -13.847 -8.074 2.669 144 HB2 ARG 24 1HB ARG 24 -16.237 -8.704 4.377 145 HB3 ARG 24 2HB ARG 24 -14.936 -9.721 3.880 146 HG2 ARG 24 1HG ARG 24 -14.216 -9.456 5.984 147 HG3 ARG 24 2HG ARG 24 -13.494 -7.955 5.401 148 HD2 ARG 24 1HD ARG 24 -15.402 -6.663 6.163 149 HD3 ARG 24 2HD ARG 24 -16.361 -8.130 6.433 150 HE ARG 24 HE ARG 24 -14.096 -8.320 8.066 151 HH11 ARG 24 1HH1 ARG 24 -17.012 -6.311 7.729 152 HH12 ARG 24 2HH1 ARG 24 -17.270 -6.079 9.414 153 HH21 ARG 24 1HH2 ARG 24 -14.482 -8.106 10.328 154 HH22 ARG 24 2HH2 ARG 24 -15.789 -7.125 10.924 155 H SER 25 H SER 25 -15.220 -6.093 1.157 156 HA SER 25 HA SER 25 -17.433 -7.593 -0.149 157 HB2 SER 25 1HB SER 25 -17.557 -4.700 0.808 158 HB3 SER 25 2HB SER 25 -18.876 -5.622 0.068 159 HG SER 25 HG SER 25 -18.486 -5.281 2.548 160 H PHE 26 H PHE 26 -14.428 -6.431 -0.955 161 HA PHE 26 HA PHE 26 -15.342 -4.768 -3.218 162 HB2 PHE 26 1HB PHE 26 -13.453 -3.889 -1.002 163 HB3 PHE 26 2HB PHE 26 -13.718 -3.048 -2.547 164 HD1 PHE 26 1HD PHE 26 -16.245 -2.653 -3.215 165 HD2 PHE 26 2HD PHE 26 -14.817 -3.101 0.853 166 HE1 PHE 26 1HE PHE 26 -18.300 -1.692 -2.390 167 HE2 PHE 26 2HE PHE 26 -16.945 -2.102 1.662 168 HZ PHE 26 HZ PHE 26 -18.685 -1.390 0.057 169 H ILE 27 H ILE 27 -13.770 -4.480 -4.866 170 HA ILE 27 HA ILE 27 -11.757 -6.621 -4.921 171 HB ILE 27 HB ILE 27 -12.574 -4.548 -7.022 172 HG12 ILE 27 1HG1 ILE 27 -13.204 -7.533 -6.899 173 HG13 ILE 27 2HG1 ILE 27 -14.339 -6.244 -6.492 174 HG21 ILE 27 1HG2 ILE 27 -11.213 -5.915 -8.606 175 HG22 ILE 27 2HG2 ILE 27 -10.211 -5.284 -7.319 176 HG23 ILE 27 3HG2 ILE 27 -10.730 -6.976 -7.266 177 HD11 ILE 27 3HD1 ILE 27 -14.858 -6.948 -8.690 178 HD12 ILE 27 1HD1 ILE 27 -14.114 -5.344 -8.813 179 HD13 ILE 27 2HD1 ILE 27 -13.176 -6.797 -9.230 180 H LYS 28 H LYS 28 -10.142 -6.019 -3.523 181 HA LYS 28 HA LYS 28 -8.944 -3.308 -3.852 182 HB2 LYS 28 1HB LYS 28 -7.702 -3.719 -1.804 183 HB3 LYS 28 2HB LYS 28 -9.393 -3.632 -1.553 184 HG2 LYS 28 1HG LYS 28 -8.099 -6.347 -1.732 185 HG3 LYS 28 2HG LYS 28 -7.963 -5.341 -0.275 186 HD2 LYS 28 1HD LYS 28 -10.411 -5.138 -0.111 187 HD3 LYS 28 2HD LYS 28 -10.569 -6.155 -1.553 188 HE2 LYS 28 1HE LYS 28 -9.309 -7.960 -0.303 189 HE3 LYS 28 2HE LYS 28 -9.476 -6.978 1.160 190 HZ1 LYS 28 3HZ LYS 28 -11.916 -7.120 0.811 191 HZ2 LYS 28 1HZ LYS 28 -11.210 -8.609 0.929 192 HZ3 LYS 28 2HZ LYS 28 -11.652 -8.064 -0.533 193 H SER 29 H SER 29 -6.741 -3.121 -4.284 194 HA SER 29 HA SER 29 -5.269 -5.462 -5.417 195 HB2 SER 29 1HB SER 29 -6.511 -4.657 -7.324 196 HB3 SER 29 2HB SER 29 -6.254 -2.974 -6.849 197 HG SER 29 HG SER 29 -4.767 -3.096 -8.266 198 H VAL 30 H VAL 30 -2.937 -4.931 -5.651 199 HA VAL 30 HA VAL 30 -2.138 -2.239 -4.935 200 HB VAL 30 HB VAL 30 -0.698 -4.495 -3.525 201 HG11 VAL 30 1HG1 VAL 30 0.630 -2.475 -3.696 202 HG12 VAL 30 2HG1 VAL 30 -0.742 -1.447 -3.223 203 HG13 VAL 30 3HG1 VAL 30 0.053 -2.539 -2.065 204 HG21 VAL 30 3HG2 VAL 30 -2.857 -2.753 -2.274 205 HG22 VAL 30 1HG2 VAL 30 -2.903 -4.522 -2.511 206 HG23 VAL 30 2HG2 VAL 30 -1.747 -3.830 -1.391 207 H VAL 31 H VAL 31 0.157 -1.842 -5.674 208 HA VAL 31 HA VAL 31 1.504 -4.004 -7.025 209 HB VAL 31 HB VAL 31 0.661 -2.787 -8.877 210 HG11 VAL 31 1HG1 VAL 31 -0.137 -0.736 -7.905 211 HG12 VAL 31 2HG1 VAL 31 1.533 -0.196 -7.550 212 HG13 VAL 31 3HG1 VAL 31 0.965 -0.333 -9.219 213 HG21 VAL 31 3HG2 VAL 31 3.158 -3.280 -8.957 214 HG22 VAL 31 1HG2 VAL 31 2.607 -1.987 -10.028 215 HG23 VAL 31 2HG2 VAL 31 3.437 -1.591 -8.514 216 H VAL 32 H VAL 32 3.682 -4.011 -6.417 217 HA VAL 32 HA VAL 32 4.686 -1.813 -4.709 218 HB VAL 32 HB VAL 32 4.773 -4.816 -4.170 219 HG11 VAL 32 1HG1 VAL 32 5.809 -4.245 -2.023 220 HG12 VAL 32 2HG1 VAL 32 6.815 -3.714 -3.374 221 HG13 VAL 32 3HG1 VAL 32 5.838 -2.532 -2.472 222 HG21 VAL 32 3HG2 VAL 32 3.444 -4.166 -2.071 223 HG22 VAL 32 1HG2 VAL 32 3.153 -2.607 -2.854 224 HG23 VAL 32 2HG2 VAL 32 2.556 -4.103 -3.596 225 H VAL 33 H VAL 33 6.780 -1.275 -5.350 226 HA VAL 33 HA VAL 33 8.456 -3.229 -6.789 227 HB VAL 33 HB VAL 33 8.146 -0.337 -7.703 228 HG11 VAL 33 1HG1 VAL 33 9.383 -2.767 -9.083 229 HG12 VAL 33 2HG1 VAL 33 9.354 -1.099 -9.685 230 HG13 VAL 33 3HG1 VAL 33 10.282 -1.484 -8.246 231 HG21 VAL 33 3HG2 VAL 33 6.953 -1.157 -9.721 232 HG22 VAL 33 1HG2 VAL 33 6.739 -2.733 -8.947 233 HG23 VAL 33 2HG2 VAL 33 5.991 -1.288 -8.252 234 H ALA 34 H ALA 34 10.633 -2.984 -6.034 235 HA ALA 34 HA ALA 34 11.268 -0.649 -4.296 236 HB1 ALA 34 1HB ALA 34 12.237 -2.298 -2.682 237 HB2 ALA 34 2HB ALA 34 10.462 -2.318 -2.789 238 HB3 ALA 34 3HB ALA 34 11.436 -3.597 -3.572 239 H ASN 35 H ASN 35 12.628 0.109 -5.901 240 HA ASN 35 HA ASN 35 14.515 -1.228 -7.389 241 HB2 ASN 35 1HB ASN 35 13.742 1.128 -7.628 242 HB3 ASN 35 2HB ASN 35 14.792 1.634 -6.391 243 HD21 ASN 35 1HD2 ASN 35 14.691 2.265 -9.287 244 HD22 ASN 35 2HD2 ASN 35 16.277 1.860 -9.937 245 H GLY 36 H GLY 36 15.923 -2.671 -6.480 246 HA2 GLY 36 1HA GLY 36 18.312 -2.643 -6.238 247 HA3 GLY 36 2HA GLY 36 18.169 -1.342 -5.051 248 H THR 37 H THR 37 15.744 -3.582 -4.261 249 HA THR 37 HA THR 37 17.419 -5.266 -2.557 250 HB THR 37 HB THR 37 17.314 -2.989 -1.515 251 HG1 THR 37 1HG THR 37 17.688 -4.538 -0.107 252 HG21 THR 37 3HG2 THR 37 15.271 -2.148 -0.614 253 HG22 THR 37 1HG2 THR 37 14.371 -3.610 -1.088 254 HG23 THR 37 2HG2 THR 37 14.972 -2.478 -2.316 255 H GLN 38 H GLN 38 15.420 -5.955 -0.738 256 HA GLN 38 HA GLN 38 13.303 -7.205 -2.414 257 HB2 GLN 38 1HB GLN 38 15.200 -8.353 -0.360 258 HB3 GLN 38 2HB GLN 38 13.593 -9.057 -0.511 259 HG2 GLN 38 1HG GLN 38 13.917 -9.734 -2.745 260 HG3 GLN 38 2HG GLN 38 15.154 -8.544 -3.046 261 HE21 GLN 38 1HE2 GLN 38 15.533 -11.026 -3.946 262 HE22 GLN 38 2HE2 GLN 38 16.923 -11.718 -3.098 263 H LEU 39 H LEU 39 11.461 -7.825 -1.085 264 HA LEU 39 HA LEU 39 10.642 -5.576 0.697 265 HB2 LEU 39 1HB LEU 39 9.268 -7.354 -1.222 266 HB3 LEU 39 2HB LEU 39 8.476 -7.395 0.310 267 HG LEU 39 HG LEU 39 7.619 -5.755 -1.408 268 HD11 LEU 39 1HD1 LEU 39 6.970 -5.648 0.980 269 HD12 LEU 39 2HD1 LEU 39 7.030 -4.049 0.229 270 HD13 LEU 39 3HD1 LEU 39 8.338 -4.568 1.304 271 HD21 LEU 39 3HD2 LEU 39 10.003 -4.882 -1.937 272 HD22 LEU 39 1HD2 LEU 39 9.803 -3.889 -0.468 273 HD23 LEU 39 2HD2 LEU 39 8.676 -3.721 -1.827 274 H LYS 40 H LYS 40 9.469 -6.135 2.615 275 HA LYS 40 HA LYS 40 9.929 -8.853 3.745 276 HB2 LYS 40 1HB LYS 40 11.549 -7.251 4.619 277 HB3 LYS 40 2HB LYS 40 10.244 -6.119 5.029 278 HG2 LYS 40 1HG LYS 40 9.323 -7.888 6.594 279 HG3 LYS 40 2HG LYS 40 10.783 -8.856 6.265 280 HD2 LYS 40 1HD LYS 40 12.198 -6.968 7.047 281 HD3 LYS 40 2HD LYS 40 10.735 -5.984 7.284 282 HE2 LYS 40 1HE LYS 40 9.898 -7.705 8.894 283 HE3 LYS 40 2HE LYS 40 11.476 -8.525 8.776 284 HZ1 LYS 40 3HZ LYS 40 12.499 -6.491 9.594 285 HZ2 LYS 40 1HZ LYS 40 11.331 -6.981 10.650 286 HZ3 LYS 40 2HZ LYS 40 11.055 -5.718 9.612 287 H ASP 41 H ASP 41 7.983 -9.694 4.184 288 HA ASP 41 HA ASP 41 5.591 -7.956 4.477 289 HB2 ASP 41 1HB ASP 41 5.437 -10.292 3.409 290 HB3 ASP 41 2HB ASP 41 5.636 -10.942 5.028 291 H GLY 42 H GLY 42 5.323 -6.952 6.456 292 HA2 GLY 42 1HA GLY 42 6.878 -7.491 8.713 293 HA3 GLY 42 2HA GLY 42 5.385 -6.548 8.675 294 H ALA 43 H ALA 43 4.043 -9.331 7.654 295 HA ALA 43 HA ALA 43 2.866 -9.970 10.157 296 HB1 ALA 43 1HB ALA 43 1.941 -11.879 8.855 297 HB2 ALA 43 2HB ALA 43 1.787 -10.353 7.967 298 HB3 ALA 43 3HB ALA 43 3.050 -11.510 7.518 299 H THR 44 H THR 44 5.474 -11.414 8.240 300 HA THR 44 HA THR 44 6.255 -13.086 10.543 301 HB THR 44 HB THR 44 6.576 -14.621 8.111 302 HG1 THR 44 1HG THR 44 4.873 -13.608 7.069 303 HG21 THR 44 3HG2 THR 44 4.852 -15.987 9.355 304 HG22 THR 44 1HG2 THR 44 4.710 -14.614 10.490 305 HG23 THR 44 2HG2 THR 44 6.254 -15.483 10.340 306 H GLY 45 H GLY 45 7.400 -10.898 8.176 307 HA2 GLY 45 1HA GLY 45 9.553 -10.206 7.826 308 HA3 GLY 45 2HA GLY 45 10.172 -11.448 8.943 309 H GLU 46 H GLU 46 7.914 -12.122 6.256 310 HA GLU 46 HA GLU 46 9.773 -14.026 5.013 311 HB2 GLU 46 1HB GLU 46 7.118 -12.905 4.027 312 HB3 GLU 46 2HB GLU 46 8.092 -14.182 3.271 313 HG2 GLU 46 1HG GLU 46 6.867 -14.333 6.058 314 HG3 GLU 46 2HG GLU 46 6.133 -15.022 4.631 315 H SER 47 H SER 47 11.451 -13.264 3.840 316 HA SER 47 HA SER 47 11.424 -10.556 2.789 317 HB2 SER 47 1HB SER 47 13.758 -11.720 1.941 318 HB3 SER 47 2HB SER 47 13.482 -10.824 3.439 319 HG SER 47 HG SER 47 13.836 -13.563 3.067 320 H LEU 48 H LEU 48 10.256 -10.348 1.053 321 HA LEU 48 HA LEU 48 9.804 -12.636 -0.811 322 HB2 LEU 48 1HB LEU 48 8.398 -9.946 -0.679 323 HB3 LEU 48 2HB LEU 48 7.944 -11.315 -1.690 324 HG LEU 48 HG LEU 48 7.813 -11.182 1.343 325 HD11 LEU 48 1HD1 LEU 48 6.039 -10.002 0.167 326 HD12 LEU 48 2HD1 LEU 48 5.406 -11.427 0.996 327 HD13 LEU 48 3HD1 LEU 48 5.645 -11.465 -0.767 328 HD21 LEU 48 3HD2 LEU 48 7.192 -13.542 -0.486 329 HD22 LEU 48 1HD2 LEU 48 6.714 -13.417 1.227 330 HD23 LEU 48 2HD2 LEU 48 8.423 -13.480 0.796 331 H ALA 49 H ALA 49 9.368 -11.464 -3.219 332 HA ALA 49 HA ALA 49 11.897 -10.012 -3.890 333 HB1 ALA 49 1HB ALA 49 10.686 -12.458 -5.244 334 HB2 ALA 49 2HB ALA 49 11.975 -11.436 -5.904 335 HB3 ALA 49 3HB ALA 49 12.258 -12.353 -4.406 336 H SER 50 H SER 50 10.882 -7.985 -4.222 337 HA SER 50 HA SER 50 8.352 -7.753 -5.526 338 HB2 SER 50 1HB SER 50 8.480 -5.680 -4.791 339 HB3 SER 50 2HB SER 50 9.926 -6.150 -3.936 340 HG SER 50 HG SER 50 11.179 -5.362 -5.658 341 HA PRO 51 HA PRO 51 7.733 -5.745 -6.966 342 HB2 PRO 51 1HB PRO 51 6.407 -5.428 -9.310 343 HB3 PRO 51 2HB PRO 51 7.922 -4.576 -8.909 344 HG2 PRO 51 1HG PRO 51 7.619 -7.102 -10.574 345 HG3 PRO 51 2HG PRO 51 8.541 -5.615 -10.978 346 HD2 PRO 51 1HD PRO 51 9.718 -7.819 -9.855 347 HD3 PRO 51 2HD PRO 51 10.261 -6.158 -9.479 348 H VAL 52 H VAL 52 5.577 -6.204 -6.429 349 HA VAL 52 HA VAL 52 4.453 -8.884 -7.080 350 HB VAL 52 HB VAL 52 5.499 -7.964 -4.395 351 HG11 VAL 52 1HG1 VAL 52 3.197 -8.808 -3.965 352 HG12 VAL 52 2HG1 VAL 52 3.623 -10.332 -4.770 353 HG13 VAL 52 3HG1 VAL 52 4.429 -9.862 -3.274 354 HG21 VAL 52 3HG2 VAL 52 6.577 -10.174 -4.348 355 HG22 VAL 52 1HG2 VAL 52 5.776 -10.613 -5.867 356 HG23 VAL 52 2HG2 VAL 52 6.993 -9.350 -5.849 357 H ILE 53 H ILE 53 2.192 -9.083 -6.466 358 HA ILE 53 HA ILE 53 0.779 -6.475 -6.568 359 HB ILE 53 HB ILE 53 0.505 -8.817 -8.481 360 HG12 ILE 53 1HG1 ILE 53 2.572 -7.757 -9.018 361 HG13 ILE 53 2HG1 ILE 53 1.381 -7.396 -10.234 362 HG21 ILE 53 1HG2 ILE 53 -1.614 -7.539 -8.132 363 HG22 ILE 53 2HG2 ILE 53 -0.816 -6.081 -8.710 364 HG23 ILE 53 3HG2 ILE 53 -1.005 -7.475 -9.783 365 HD11 ILE 53 3HD1 ILE 53 2.651 -5.427 -9.919 366 HD12 ILE 53 1HD1 ILE 53 1.080 -5.097 -9.158 367 HD13 ILE 53 2HD1 ILE 53 2.485 -5.493 -8.171 368 H LEU 54 H LEU 54 -0.377 -6.724 -4.659 369 HA LEU 54 HA LEU 54 -1.337 -9.374 -3.709 370 HB2 LEU 54 1HB LEU 54 -1.347 -6.534 -2.617 371 HB3 LEU 54 2HB LEU 54 -2.272 -7.821 -1.872 372 HG LEU 54 HG LEU 54 -0.049 -7.316 -0.825 373 HD11 LEU 54 1HD1 LEU 54 -1.195 -9.403 -0.327 374 HD12 LEU 54 2HD1 LEU 54 0.543 -9.697 -0.441 375 HD13 LEU 54 3HD1 LEU 54 -0.498 -10.169 -1.790 376 HD21 LEU 54 3HD2 LEU 54 1.074 -8.866 -3.172 377 HD22 LEU 54 1HD2 LEU 54 1.971 -8.318 -1.756 378 HD23 LEU 54 2HD2 LEU 54 1.321 -7.112 -2.893 379 H SER 55 H SER 55 -3.368 -10.064 -3.657 380 HA SER 55 HA SER 55 -5.378 -8.452 -5.144 381 HB2 SER 55 1HB SER 55 -6.334 -10.662 -5.696 382 HB3 SER 55 2HB SER 55 -4.744 -10.404 -6.339 383 HG SER 55 HG SER 55 -3.855 -11.682 -4.711 384 H ASP 56 H ASP 56 -7.576 -9.980 -4.432 385 HA ASP 56 HA ASP 56 -8.527 -8.583 -2.143 386 HB2 ASP 56 1HB ASP 56 -9.913 -9.239 -4.041 387 HB3 ASP 56 2HB ASP 56 -9.601 -10.954 -3.748 388 H GLU 57 H GLU 57 -7.732 -11.983 -2.753 389 HA GLU 57 HA GLU 57 -8.524 -13.075 -0.249 390 HB2 GLU 57 1HB GLU 57 -6.608 -13.905 -2.470 391 HB3 GLU 57 2HB GLU 57 -6.694 -14.842 -0.983 392 HG2 GLU 57 1HG GLU 57 -9.112 -15.199 -1.288 393 HG3 GLU 57 2HG GLU 57 -9.078 -14.227 -2.771 394 H GLU 58 H GLU 58 -5.566 -11.363 -1.214 395 HA GLU 58 HA GLU 58 -4.097 -12.402 1.067 396 HB2 GLU 58 1HB GLU 58 -3.162 -10.363 -0.962 397 HB3 GLU 58 2HB GLU 58 -2.221 -11.601 -0.086 398 HG2 GLU 58 1HG GLU 58 -3.658 -13.328 -1.403 399 HG3 GLU 58 2HG GLU 58 -4.175 -11.941 -2.373 400 H LEU 59 H LEU 59 -6.080 -9.708 0.381 401 HA LEU 59 HA LEU 59 -4.999 -7.973 2.520 402 HB2 LEU 59 1HB LEU 59 -6.795 -7.777 0.130 403 HB3 LEU 59 2HB LEU 59 -7.194 -6.721 1.452 404 HG LEU 59 HG LEU 59 -5.694 -5.856 -0.351 405 HD11 LEU 59 1HD1 LEU 59 -4.537 -4.373 1.093 406 HD12 LEU 59 2HD1 LEU 59 -4.607 -5.525 2.454 407 HD13 LEU 59 3HD1 LEU 59 -6.084 -4.748 1.846 408 HD21 LEU 59 3HD2 LEU 59 -4.068 -7.746 -0.458 409 HD22 LEU 59 1HD2 LEU 59 -3.419 -7.250 1.117 410 HD23 LEU 59 2HD2 LEU 59 -3.311 -6.154 -0.272 411 H ALA 60 H ALA 60 -6.493 -10.642 2.965 412 HA ALA 60 HA ALA 60 -8.999 -9.988 4.245 413 HB1 ALA 60 1HB ALA 60 -9.011 -12.346 4.759 414 HB2 ALA 60 2HB ALA 60 -8.432 -12.105 3.094 415 HB3 ALA 60 3HB ALA 60 -7.268 -12.473 4.392 416 H VAL 61 H VAL 61 -7.065 -8.334 5.380 417 HA VAL 61 HA VAL 61 -6.747 -9.291 8.165 418 HB VAL 61 HB VAL 61 -4.433 -8.339 8.119 419 HG11 VAL 61 1HG1 VAL 61 -4.751 -10.600 6.108 420 HG12 VAL 61 2HG1 VAL 61 -3.373 -10.277 7.179 421 HG13 VAL 61 3HG1 VAL 61 -4.927 -10.795 7.857 422 HG21 VAL 61 3HG2 VAL 61 -4.572 -6.913 6.075 423 HG22 VAL 61 1HG2 VAL 61 -3.252 -8.094 5.994 424 HG23 VAL 61 2HG2 VAL 61 -4.726 -8.370 5.068 425 H GLU 62 H GLU 62 -6.280 -7.440 9.639 426 HA GLU 62 HA GLU 62 -7.892 -5.093 8.875 427 HB2 GLU 62 1HB GLU 62 -7.510 -4.471 11.232 428 HB3 GLU 62 2HB GLU 62 -8.309 -6.046 11.003 429 HG2 GLU 62 1HG GLU 62 -6.340 -7.259 11.605 430 HG3 GLU 62 2HG GLU 62 -5.331 -5.819 11.485 431 H LYS 63 H LYS 63 -4.585 -5.956 8.864 432 HA LYS 63 HA LYS 63 -3.589 -3.189 8.590 433 HB2 LYS 63 1HB LYS 63 -3.806 -4.019 11.084 434 HB3 LYS 63 2HB LYS 63 -2.519 -5.138 10.677 435 HG2 LYS 63 1HG LYS 63 -1.742 -2.431 9.898 436 HG3 LYS 63 2HG LYS 63 -2.447 -2.423 11.518 437 HD2 LYS 63 1HD LYS 63 -0.807 -4.373 12.002 438 HD3 LYS 63 2HD LYS 63 -0.029 -3.878 10.489 439 HE2 LYS 63 1HE LYS 63 1.046 -2.960 12.553 440 HE3 LYS 63 2HE LYS 63 0.598 -1.777 11.341 441 HZ1 LYS 63 3HZ LYS 63 -0.978 -2.377 13.779 442 HZ2 LYS 63 1HZ LYS 63 -1.345 -1.196 12.681 443 HZ3 LYS 63 2HZ LYS 63 -0.013 -1.066 13.593 444 H VAL 64 H VAL 64 -1.483 -3.163 7.654 445 HA VAL 64 HA VAL 64 -0.083 -5.664 7.417 446 HB VAL 64 HB VAL 64 -0.383 -4.016 4.863 447 HG11 VAL 64 1HG1 VAL 64 1.681 -5.418 5.129 448 HG12 VAL 64 2HG1 VAL 64 0.646 -6.850 5.174 449 HG13 VAL 64 3HG1 VAL 64 0.695 -5.833 3.734 450 HG21 VAL 64 3HG2 VAL 64 -1.780 -5.795 3.878 451 HG22 VAL 64 1HG2 VAL 64 -1.758 -6.662 5.418 452 HG23 VAL 64 2HG2 VAL 64 -2.607 -5.112 5.272 453 H THR 65 H THR 65 2.127 -5.206 7.532 454 HA THR 65 HA THR 65 3.046 -2.383 7.381 455 HB THR 65 HB THR 65 4.126 -4.567 9.211 456 HG1 THR 65 1HG THR 65 2.934 -3.825 10.725 457 HG21 THR 65 3HG2 THR 65 5.839 -2.922 8.513 458 HG22 THR 65 1HG2 THR 65 5.430 -2.699 10.222 459 HG23 THR 65 2HG2 THR 65 4.783 -1.587 8.989 460 H LEU 66 H LEU 66 4.773 -2.146 5.932 461 HA LEU 66 HA LEU 66 6.027 -4.577 4.799 462 HB2 LEU 66 1HB LEU 66 4.632 -2.352 3.300 463 HB3 LEU 66 2HB LEU 66 5.708 -3.520 2.533 464 HG LEU 66 HG LEU 66 3.101 -4.192 3.961 465 HD11 LEU 66 1HD1 LEU 66 2.758 -2.858 1.956 466 HD12 LEU 66 2HD1 LEU 66 2.208 -4.521 1.732 467 HD13 LEU 66 3HD1 LEU 66 3.755 -3.993 1.011 468 HD21 LEU 66 3HD2 LEU 66 4.580 -6.104 4.049 469 HD22 LEU 66 1HD2 LEU 66 5.077 -5.883 2.375 470 HD23 LEU 66 2HD2 LEU 66 3.415 -6.413 2.767 471 H SER 67 H SER 67 8.153 -4.148 3.995 472 HA SER 67 HA SER 67 9.129 -1.478 3.873 473 HB2 SER 67 1HB SER 67 10.670 -3.030 5.825 474 HB3 SER 67 2HB SER 67 10.217 -1.283 5.677 475 HG SER 67 HG SER 67 8.156 -1.908 6.489 476 H THR 68 H THR 68 11.577 -1.566 3.328 477 HA THR 68 HA THR 68 12.115 -4.018 1.788 478 HB THR 68 HB THR 68 14.087 -2.528 1.069 479 HG1 THR 68 1HG THR 68 14.000 -0.857 2.433 480 HG21 THR 68 3HG2 THR 68 12.676 -1.502 -0.658 481 HG22 THR 68 1HG2 THR 68 11.236 -1.750 0.324 482 HG23 THR 68 2HG2 THR 68 12.123 -3.142 -0.317 483 H THR 69 H THR 69 14.175 -5.154 1.938 484 HA THR 69 HA THR 69 15.162 -5.247 4.678 485 HB THR 69 HB THR 69 16.455 -7.142 3.905 486 HG1 THR 69 1HG THR 69 16.827 -7.539 1.938 487 HG21 THR 69 3HG2 THR 69 14.062 -7.498 4.492 488 HG22 THR 69 1HG2 THR 69 14.659 -8.655 3.286 489 HG23 THR 69 2HG2 THR 69 13.627 -7.311 2.776 490 H GLY 70 H GLY 70 15.926 -3.190 2.108 491 HA2 GLY 70 1HA GLY 70 18.291 -2.131 3.311 492 HA3 GLY 70 2HA GLY 70 18.665 -3.123 1.897 493 H LYS 71 H LYS 71 19.323 -1.190 0.707 494 HA LYS 71 HA LYS 71 17.856 1.151 0.790 495 HB2 LYS 71 1HB LYS 71 19.245 2.030 -0.965 496 HB3 LYS 71 2HB LYS 71 20.239 1.010 0.088 497 HG2 LYS 71 1HG LYS 71 20.982 0.185 -1.888 498 HG3 LYS 71 2HG LYS 71 19.565 -0.833 -1.807 499 HD2 LYS 71 1HD LYS 71 19.467 0.090 -3.969 500 HD3 LYS 71 2HD LYS 71 18.362 1.156 -3.087 501 HE2 LYS 71 1HE LYS 71 19.591 2.955 -3.421 502 HE3 LYS 71 2HE LYS 71 21.037 2.149 -2.781 503 HZ1 LYS 71 3HZ LYS 71 20.194 2.013 -5.622 504 HZ2 LYS 71 1HZ LYS 71 21.234 0.965 -4.962 505 HZ3 LYS 71 2HZ LYS 71 21.661 2.513 -4.970 506 H ALA 72 H ALA 72 16.319 2.092 -0.505 507 HA ALA 72 HA ALA 72 15.247 0.482 -2.720 508 HB1 ALA 72 1HB ALA 72 13.897 0.216 -0.598 509 HB2 ALA 72 2HB ALA 72 13.481 1.938 -0.723 510 HB3 ALA 72 3HB ALA 72 12.984 0.812 -2.012 511 H ILE 73 H ILE 73 14.765 1.765 -4.462 512 HA ILE 73 HA ILE 73 14.578 4.709 -4.086 513 HB ILE 73 HB ILE 73 15.934 3.753 -6.583 514 HG12 ILE 73 1HG1 ILE 73 17.291 3.898 -3.883 515 HG13 ILE 73 2HG1 ILE 73 17.384 2.637 -5.110 516 HG21 ILE 73 1HG2 ILE 73 16.774 5.951 -6.625 517 HG22 ILE 73 2HG2 ILE 73 15.102 6.138 -6.091 518 HG23 ILE 73 3HG2 ILE 73 16.397 6.211 -4.895 519 HD11 ILE 73 3HD1 ILE 73 18.655 4.218 -6.578 520 HD12 ILE 73 1HD1 ILE 73 18.583 5.459 -5.312 521 HD13 ILE 73 2HD1 ILE 73 19.462 4.006 -5.008 522 H GLU 74 H GLU 74 12.523 2.489 -4.473 523 HA GLU 74 HA GLU 74 10.921 3.961 -6.394 524 HB2 GLU 74 1HB GLU 74 11.529 0.995 -6.704 525 HB3 GLU 74 2HB GLU 74 9.927 1.628 -7.127 526 HG2 GLU 74 1HG GLU 74 10.787 3.113 -8.724 527 HG3 GLU 74 2HG GLU 74 12.380 3.009 -8.066 528 H PHE 75 H PHE 75 8.755 3.856 -5.509 529 HA PHE 75 HA PHE 75 7.949 1.532 -4.179 530 HB2 PHE 75 1HB PHE 75 8.931 3.226 -2.255 531 HB3 PHE 75 2HB PHE 75 7.260 3.719 -2.254 532 HD1 PHE 75 2HD PHE 75 8.759 0.277 -2.780 533 HD2 PHE 75 1HD PHE 75 6.596 2.803 0.011 534 HE1 PHE 75 2HE PHE 75 8.017 -1.692 -1.543 535 HE2 PHE 75 1HE PHE 75 6.095 0.839 1.307 536 HZ PHE 75 HZ PHE 75 6.596 -1.441 0.484 537 H ALA 76 H ALA 76 6.667 1.425 -5.950 538 HA ALA 76 HA ALA 76 4.743 3.544 -6.513 539 HB1 ALA 76 1HB ALA 76 4.941 0.723 -7.629 540 HB2 ALA 76 2HB ALA 76 3.955 2.046 -8.275 541 HB3 ALA 76 3HB ALA 76 5.719 2.168 -8.329 542 H VAL 77 H VAL 77 2.495 3.522 -6.050 543 HA VAL 77 HA VAL 77 1.311 1.068 -5.050 544 HB VAL 77 HB VAL 77 1.143 3.655 -3.435 545 HG11 VAL 77 1HG1 VAL 77 -1.106 2.615 -3.641 546 HG12 VAL 77 2HG1 VAL 77 -0.445 1.052 -3.126 547 HG13 VAL 77 3HG1 VAL 77 -0.476 2.434 -2.007 548 HG21 VAL 77 3HG2 VAL 77 3.068 2.297 -2.768 549 HG22 VAL 77 1HG2 VAL 77 1.826 2.091 -1.546 550 HG23 VAL 77 2HG2 VAL 77 2.073 0.829 -2.785 551 H SER 78 H SER 78 -0.072 0.777 -6.613 552 HA SER 78 HA SER 78 -2.152 2.806 -6.927 553 HB2 SER 78 1HB SER 78 -0.956 2.070 -9.154 554 HB3 SER 78 2HB SER 78 -1.901 0.595 -8.960 555 HG SER 78 HG SER 78 -3.085 3.187 -8.785 556 H GLY 79 H GLY 79 -4.314 1.477 -7.257 557 HA2 GLY 79 1HA GLY 79 -5.057 -0.926 -6.345 558 HA3 GLY 79 2HA GLY 79 -4.563 -0.100 -4.849 559 H GLY 80 H GLY 80 -7.004 -0.356 -4.463 560 HA2 GLY 80 1HA GLY 80 -8.286 1.905 -4.015 561 HA3 GLY 80 2HA GLY 80 -8.662 1.741 -5.735 562 H VAL 81 H VAL 81 -10.799 1.716 -3.906 563 HA VAL 81 HA VAL 81 -11.864 -0.950 -4.448 564 HB VAL 81 HB VAL 81 -13.014 -0.874 -2.141 565 HG11 VAL 81 1HG1 VAL 81 -11.322 -2.277 -1.156 566 HG12 VAL 81 2HG1 VAL 81 -11.369 -2.577 -2.899 567 HG13 VAL 81 3HG1 VAL 81 -10.068 -1.583 -2.217 568 HG21 VAL 81 3HG2 VAL 81 -12.225 1.260 -1.253 569 HG22 VAL 81 1HG2 VAL 81 -11.638 -0.097 -0.277 570 HG23 VAL 81 2HG2 VAL 81 -10.526 0.715 -1.397 571 H VAL 82 H VAL 82 -13.633 -0.537 -5.621 572 HA VAL 82 HA VAL 82 -14.910 2.137 -5.436 573 HB VAL 82 HB VAL 82 -15.948 1.501 -7.539 574 HG11 VAL 82 1HG1 VAL 82 -13.023 0.713 -7.653 575 HG12 VAL 82 2HG1 VAL 82 -14.043 1.258 -8.995 576 HG13 VAL 82 3HG1 VAL 82 -13.666 2.370 -7.675 577 HG21 VAL 82 3HG2 VAL 82 -15.590 -0.647 -8.630 578 HG22 VAL 82 1HG2 VAL 82 -14.678 -1.250 -7.230 579 HG23 VAL 82 2HG2 VAL 82 -16.399 -0.854 -7.066 580 H ASP 83 H ASP 83 -17.417 1.935 -5.828 581 HA ASP 83 HA ASP 83 -18.645 -0.405 -4.810 582 HB2 ASP 83 1HB ASP 83 -18.069 0.676 -2.636 583 HB3 ASP 83 2HB ASP 83 -18.909 2.119 -3.127 584 H GLY 84 H GLY 84 -19.720 -0.307 -6.824 585 HA2 GLY 84 1HA GLY 84 -21.269 2.189 -7.473 586 HA3 GLY 84 2HA GLY 84 -20.376 1.239 -8.672 587 H GLU 85 H GLU 85 -22.152 -0.193 -5.993 588 HA GLU 85 HA GLU 85 -23.595 -1.842 -7.989 589 HB2 GLU 85 1HB GLU 85 -21.991 -2.325 -5.484 590 HB3 GLU 85 2HB GLU 85 -23.404 -3.331 -5.688 591 HG2 GLU 85 1HG GLU 85 -21.276 -4.317 -6.638 592 HG3 GLU 85 2HG GLU 85 -22.661 -4.244 -7.725 593 H ASP 86 H ASP 86 -25.646 -2.698 -7.383 594 HA ASP 86 HA ASP 86 -27.184 -0.886 -5.592 595 HB2 ASP 86 1HB ASP 86 -27.860 -2.246 -8.231 596 HB3 ASP 86 2HB ASP 86 -29.106 -1.544 -7.207 597 H GLY 87 H GLY 87 -26.059 -3.955 -5.598 598 HA2 GLY 87 1HA GLY 87 -28.448 -5.113 -4.221 599 HA3 GLY 87 2HA GLY 87 -27.156 -6.028 -5.003 600 H VAL 88 H VAL 88 -24.868 -4.685 -4.051 601 HA VAL 88 HA VAL 88 -24.890 -5.769 -1.310 602 HB VAL 88 HB VAL 88 -22.471 -4.881 -2.903 603 HG11 VAL 88 1HG1 VAL 88 -21.347 -6.516 -1.321 604 HG12 VAL 88 2HG1 VAL 88 -22.067 -5.147 -0.470 605 HG13 VAL 88 3HG1 VAL 88 -22.895 -6.715 -0.481 606 HG21 VAL 88 3HG2 VAL 88 -23.560 -6.608 -4.215 607 HG22 VAL 88 1HG2 VAL 88 -22.177 -7.316 -3.392 608 HG23 VAL 88 2HG2 VAL 88 -23.817 -7.598 -2.761 609 H VAL 89 H VAL 89 -26.284 -3.987 -0.653 610 HA VAL 89 HA VAL 89 -25.164 -1.391 -0.042 611 HB VAL 89 HB VAL 89 -27.563 -1.744 -0.059 612 HG11 VAL 89 1HG1 VAL 89 -27.757 -4.113 0.547 613 HG12 VAL 89 2HG1 VAL 89 -27.200 -3.766 2.187 614 HG13 VAL 89 3HG1 VAL 89 -28.755 -3.126 1.611 615 HG21 VAL 89 3HG2 VAL 89 -26.661 -0.069 1.541 616 HG22 VAL 89 1HG2 VAL 89 -28.209 -0.752 2.053 617 HG23 VAL 89 2HG2 VAL 89 -26.710 -1.295 2.831 618 H ASN 90 H ASN 90 -24.038 -0.786 1.897 619 HA ASN 90 HA ASN 90 -23.781 -2.625 4.044 620 HB2 ASN 90 1HB ASN 90 -21.848 -3.116 2.135 621 HB3 ASN 90 2HB ASN 90 -21.012 -1.942 3.128 622 HD21 ASN 90 1HD2 ASN 90 -21.435 -5.164 2.749 623 HD22 ASN 90 2HD2 ASN 90 -21.170 -5.715 4.396 624 H GLU 91 H GLU 91 -21.583 -1.384 5.326 625 HA GLU 91 HA GLU 91 -22.334 1.504 5.456 626 HB2 GLU 91 1HB GLU 91 -20.746 -0.325 7.314 627 HB3 GLU 91 2HB GLU 91 -20.592 1.425 7.384 628 HG2 GLU 91 1HG GLU 91 -23.339 1.211 7.410 629 HG3 GLU 91 2HG GLU 91 -22.881 -0.276 8.235 630 HA PRO 92 HA PRO 92 -18.684 2.312 3.113 631 HB2 PRO 92 1HB PRO 92 -17.850 4.801 3.934 632 HB3 PRO 92 2HB PRO 92 -19.439 4.540 3.159 633 HG2 PRO 92 1HG PRO 92 -18.880 4.650 6.134 634 HG3 PRO 92 2HG PRO 92 -20.070 5.614 5.198 635 HD2 PRO 92 1HD PRO 92 -20.828 3.322 6.445 636 HD3 PRO 92 2HD PRO 92 -21.443 3.721 4.818 637 H MET 93 H MET 93 -16.218 3.052 3.296 638 HA MET 93 HA MET 93 -14.967 1.880 5.689 639 HB2 MET 93 1HB MET 93 -13.594 0.474 4.359 640 HB3 MET 93 2HB MET 93 -15.265 0.072 4.015 641 HG2 MET 93 1HG MET 93 -15.145 1.445 1.929 642 HG3 MET 93 2HG MET 93 -13.472 1.827 2.292 643 HE1 MET 93 3HE MET 93 -11.629 -0.381 2.699 644 HE2 MET 93 1HE MET 93 -12.850 -1.351 3.517 645 HE3 MET 93 2HE MET 93 -12.008 -1.995 2.088 646 H GLN 94 H GLN 94 -12.601 2.146 5.674 647 HA GLN 94 HA GLN 94 -11.571 4.419 4.114 648 HB2 GLN 94 1HB GLN 94 -12.008 4.347 7.111 649 HB3 GLN 94 2HB GLN 94 -10.546 5.136 6.499 650 HG2 GLN 94 1HG GLN 94 -11.724 6.717 5.246 651 HG3 GLN 94 2HG GLN 94 -13.241 5.805 5.293 652 HE21 GLN 94 1HE2 GLN 94 -14.744 6.669 6.588 653 HE22 GLN 94 2HE2 GLN 94 -14.469 7.750 7.938 654 H TRP 95 H TRP 95 -9.296 4.550 4.171 655 HA TRP 95 HA TRP 95 -7.801 2.115 5.023 656 HB2 TRP 95 1HB TRP 95 -8.031 3.443 2.318 657 HB3 TRP 95 2HB TRP 95 -6.431 3.011 2.866 658 HD1 TRP 95 HD TRP 95 -8.995 0.431 3.821 659 HE1 TRP 95 1HE TRP 95 -8.590 -1.669 2.429 660 HE3 TRP 95 3HE TRP 95 -5.591 2.330 0.512 661 HZ2 TRP 95 2HZ TRP 95 -6.687 -2.522 0.384 662 HZ3 TRP 95 3HZ TRP 95 -4.343 0.800 -0.966 663 HH2 TRP 95 HH TRP 95 -4.813 -1.574 -0.982 664 H VAL 96 H VAL 96 -6.178 2.781 6.401 665 HA VAL 96 HA VAL 96 -5.217 5.593 6.046 666 HB VAL 96 HB VAL 96 -4.406 3.774 8.326 667 HG11 VAL 96 1HG1 VAL 96 -2.954 5.669 7.859 668 HG12 VAL 96 2HG1 VAL 96 -4.331 6.783 7.796 669 HG13 VAL 96 3HG1 VAL 96 -3.866 6.023 9.329 670 HG21 VAL 96 3HG2 VAL 96 -6.828 3.967 8.593 671 HG22 VAL 96 1HG2 VAL 96 -6.033 5.006 9.755 672 HG23 VAL 96 2HG2 VAL 96 -6.758 5.726 8.303 673 H VAL 97 H VAL 97 -3.447 5.709 4.789 674 HA VAL 97 HA VAL 97 -1.560 3.493 4.734 675 HB VAL 97 HB VAL 97 -2.577 3.016 2.699 676 HG11 VAL 97 1HG1 VAL 97 -2.681 5.969 2.014 677 HG12 VAL 97 2HG1 VAL 97 -3.177 4.630 0.948 678 HG13 VAL 97 3HG1 VAL 97 -4.093 4.967 2.420 679 HG21 VAL 97 3HG2 VAL 97 -0.936 3.665 1.002 680 HG22 VAL 97 1HG2 VAL 97 -0.442 5.076 1.959 681 HG23 VAL 97 2HG2 VAL 97 -0.082 3.445 2.543 682 H THR 98 H THR 98 0.496 4.285 4.905 683 HA THR 98 HA THR 98 1.016 7.141 4.675 684 HB THR 98 HB THR 98 1.693 5.662 7.239 685 HG1 THR 98 1HG THR 98 -0.367 5.769 7.624 686 HG21 THR 98 3HG2 THR 98 2.971 7.710 6.714 687 HG22 THR 98 1HG2 THR 98 1.928 7.969 8.123 688 HG23 THR 98 2HG2 THR 98 1.458 8.632 6.541 689 H VAL 99 H VAL 99 3.239 7.418 4.175 690 HA VAL 99 HA VAL 99 4.861 4.935 3.945 691 HB VAL 99 HB VAL 99 5.223 7.379 2.197 692 HG11 VAL 99 1HG1 VAL 99 6.278 5.687 0.664 693 HG12 VAL 99 2HG1 VAL 99 7.121 5.808 2.212 694 HG13 VAL 99 3HG1 VAL 99 6.022 4.449 1.892 695 HG21 VAL 99 3HG2 VAL 99 2.920 6.565 1.786 696 HG22 VAL 99 1HG2 VAL 99 3.976 6.273 0.416 697 HG23 VAL 99 2HG2 VAL 99 3.550 4.941 1.522 698 H TYR 100 H TYR 100 6.927 5.027 4.522 699 HA TYR 100 HA TYR 100 8.006 7.368 5.979 700 HB2 TYR 100 1HB TYR 100 8.186 4.414 6.677 701 HB3 TYR 100 2HB TYR 100 8.891 5.716 7.599 702 HD1 TYR 100 2HD TYR 100 5.593 4.269 6.445 703 HD2 TYR 100 1HD TYR 100 7.663 6.515 9.477 704 HE1 TYR 100 2HE TYR 100 3.514 4.421 7.736 705 HE2 TYR 100 1HE TYR 100 5.560 6.678 10.792 706 HH TYR 100 HH TYR 100 3.343 5.747 11.010 707 H LYS 101 H LYS 101 10.106 7.829 5.385 708 HA LYS 101 HA LYS 101 11.253 6.266 3.137 709 HB2 LYS 101 1HB LYS 101 10.967 8.836 3.265 710 HB3 LYS 101 2HB LYS 101 12.439 8.835 4.228 711 HG2 LYS 101 1HG LYS 101 13.738 8.065 2.354 712 HG3 LYS 101 2HG LYS 101 12.340 7.282 1.624 713 HD2 LYS 101 1HD LYS 101 12.589 8.984 0.185 714 HD3 LYS 101 2HD LYS 101 11.391 9.647 1.269 715 HE2 LYS 101 1HE LYS 101 13.596 10.568 2.521 716 HE3 LYS 101 2HE LYS 101 14.269 10.430 0.897 717 HZ1 LYS 101 3HZ LYS 101 13.416 12.596 1.242 718 HZ2 LYS 101 1HZ LYS 101 11.954 12.095 1.753 719 HZ3 LYS 101 2HZ LYS 101 12.346 11.897 0.190 720 H ASN 102 H ASN 102 13.990 6.676 3.691 721 HA ASN 102 HA ASN 102 14.676 4.840 5.795 722 HB2 ASN 102 1HB ASN 102 16.896 5.239 5.439 723 HB3 ASN 102 2HB ASN 102 16.133 5.089 3.894 724 HD21 ASN 102 1HD2 ASN 102 15.389 8.127 3.809 725 HD22 ASN 102 2HD2 ASN 102 16.941 8.760 3.397 726 H GLY 103 H GLY 103 13.327 5.881 7.435 727 HA2 GLY 103 1HA GLY 103 14.633 6.637 9.596 728 HA3 GLY 103 2HA GLY 103 14.504 8.230 8.884 729 H LYS 104 H LYS 104 11.848 8.492 8.024 730 HA LYS 104 HA LYS 104 9.988 7.352 9.827 731 HB2 LYS 104 1HB LYS 104 9.322 9.158 11.094 732 HB3 LYS 104 2HB LYS 104 11.066 8.992 11.195 733 HG2 LYS 104 1HG LYS 104 11.157 11.103 10.930 734 HG3 LYS 104 2HG LYS 104 10.984 10.808 9.215 735 HD2 LYS 104 1HD LYS 104 9.459 12.474 9.503 736 HD3 LYS 104 2HD LYS 104 8.406 11.088 9.690 737 HE2 LYS 104 1HE LYS 104 9.647 12.526 12.042 738 HE3 LYS 104 2HE LYS 104 8.176 13.079 11.245 739 HZ1 LYS 104 3HZ LYS 104 7.565 11.829 13.099 740 HZ2 LYS 104 1HZ LYS 104 8.485 10.554 12.720 741 HZ3 LYS 104 2HZ LYS 104 7.118 10.957 11.817 742 H GLU 105 H GLU 105 7.909 8.764 9.540 743 HA GLU 105 HA GLU 105 6.624 8.476 7.195 744 HB2 GLU 105 1HB GLU 105 5.749 8.959 9.451 745 HB3 GLU 105 2HB GLU 105 6.313 10.614 9.327 746 HG2 GLU 105 1HG GLU 105 4.728 11.012 7.457 747 HG3 GLU 105 2HG GLU 105 4.160 9.340 7.630 748 H ILE 106 H ILE 106 6.428 9.560 5.276 749 HA ILE 106 HA ILE 106 7.336 12.374 4.989 750 HB ILE 106 HB ILE 106 8.260 11.769 2.774 751 HG12 ILE 106 1HG1 ILE 106 8.665 8.900 3.455 752 HG13 ILE 106 2HG1 ILE 106 7.012 9.312 3.021 753 HG21 ILE 106 1HG2 ILE 106 10.412 10.997 3.579 754 HG22 ILE 106 2HG2 ILE 106 9.705 12.158 4.691 755 HG23 ILE 106 3HG2 ILE 106 9.687 10.435 5.106 756 HD11 ILE 106 3HD1 ILE 106 8.495 8.635 1.089 757 HD12 ILE 106 1HD1 ILE 106 7.611 10.171 0.906 758 HD13 ILE 106 2HD1 ILE 106 9.332 10.192 1.291 759 H GLU 107 H GLU 107 4.765 10.243 4.757 760 HA GLU 107 HA GLU 107 3.457 11.774 2.576 761 HB2 GLU 107 1HB GLU 107 4.324 9.529 1.919 762 HB3 GLU 107 2HB GLU 107 3.325 8.792 3.134 763 HG2 GLU 107 1HG GLU 107 1.811 10.527 1.242 764 HG3 GLU 107 2HG GLU 107 2.671 9.203 0.460 765 H LYS 108 H LYS 108 0.985 11.447 2.873 766 HA LYS 108 HA LYS 108 -0.015 10.738 5.466 767 HB2 LYS 108 1HB LYS 108 0.994 13.081 5.799 768 HB3 LYS 108 2HB LYS 108 -0.251 13.703 4.729 769 HG2 LYS 108 1HG LYS 108 -1.914 13.414 6.302 770 HG3 LYS 108 2HG LYS 108 -1.146 11.982 7.023 771 HD2 LYS 108 1HD LYS 108 0.372 13.210 8.275 772 HD3 LYS 108 2HD LYS 108 0.059 14.731 7.426 773 HE2 LYS 108 1HE LYS 108 -2.011 13.200 9.042 774 HE3 LYS 108 2HE LYS 108 -0.987 14.457 9.747 775 HZ1 LYS 108 3HZ LYS 108 -2.748 14.974 7.433 776 HZ2 LYS 108 1HZ LYS 108 -2.021 16.072 8.431 777 HZ3 LYS 108 2HZ LYS 108 -3.221 15.127 9.009 778 H LYS 109 H LYS 109 -0.516 10.019 2.679 779 HA LYS 109 HA LYS 109 -2.947 11.426 1.724 780 HB2 LYS 109 1HB LYS 109 -1.005 9.450 0.562 781 HB3 LYS 109 2HB LYS 109 -2.669 9.366 0.056 782 HG2 LYS 109 1HG LYS 109 -1.565 12.086 -0.018 783 HG3 LYS 109 2HG LYS 109 -0.820 10.941 -1.143 784 HD2 LYS 109 1HD LYS 109 -3.805 11.521 -0.930 785 HD3 LYS 109 2HD LYS 109 -2.709 12.156 -2.154 786 HE2 LYS 109 1HE LYS 109 -3.332 10.456 -3.430 787 HE3 LYS 109 2HE LYS 109 -2.228 9.475 -2.476 788 HZ1 LYS 109 3HZ LYS 109 -4.583 8.688 -2.870 789 HZ2 LYS 109 1HZ LYS 109 -5.096 9.817 -1.812 790 HZ3 LYS 109 2HZ LYS 109 -4.073 8.599 -1.320 791 H SER 110 H SER 110 -4.406 10.974 3.299 792 HA SER 110 HA SER 110 -5.203 8.247 4.016 793 HB2 SER 110 1HB SER 110 -7.188 9.754 4.898 794 HB3 SER 110 2HB SER 110 -5.628 9.686 5.738 795 HG SER 110 HG SER 110 -6.655 11.786 5.332 796 H LEU 111 H LEU 111 -7.493 7.517 3.533 797 HA LEU 111 HA LEU 111 -8.611 8.483 0.960 798 HB2 LEU 111 1HB LEU 111 -7.947 5.609 1.686 799 HB3 LEU 111 2HB LEU 111 -8.876 6.118 0.280 800 HG LEU 111 HG LEU 111 -5.955 6.845 0.722 801 HD11 LEU 111 1HD1 LEU 111 -6.274 4.420 0.513 802 HD12 LEU 111 2HD1 LEU 111 -5.443 5.101 -0.888 803 HD13 LEU 111 3HD1 LEU 111 -7.151 4.655 -1.026 804 HD21 LEU 111 3HD2 LEU 111 -7.094 8.406 -0.824 805 HD22 LEU 111 1HD2 LEU 111 -7.762 7.042 -1.744 806 HD23 LEU 111 2HD2 LEU 111 -6.017 7.342 -1.719 807 H VAL 112 H VAL 112 -10.876 8.295 0.957 808 HA VAL 112 HA VAL 112 -12.180 6.931 3.191 809 HB VAL 112 HB VAL 112 -11.524 9.012 4.098 810 HG11 VAL 112 1HG1 VAL 112 -11.251 10.480 2.181 811 HG12 VAL 112 2HG1 VAL 112 -13.000 10.497 1.905 812 HG13 VAL 112 3HG1 VAL 112 -12.337 11.213 3.373 813 HG21 VAL 112 3HG2 VAL 112 -13.835 7.993 4.576 814 HG22 VAL 112 1HG2 VAL 112 -13.544 9.675 5.066 815 HG23 VAL 112 2HG2 VAL 112 -14.489 9.295 3.600 816 H PHE 113 H PHE 113 -12.905 5.520 1.725 817 HA PHE 113 HA PHE 113 -14.415 6.260 -0.643 818 HB2 PHE 113 1HB PHE 113 -13.834 3.651 0.813 819 HB3 PHE 113 2HB PHE 113 -14.673 3.763 -0.714 820 HD1 PHE 113 1HD PHE 113 -13.468 4.491 -2.796 821 HD2 PHE 113 2HD PHE 113 -11.397 3.962 0.941 822 HE1 PHE 113 1HE PHE 113 -11.334 4.394 -4.006 823 HE2 PHE 113 2HE PHE 113 -9.242 3.879 -0.265 824 HZ PHE 113 HZ PHE 113 -9.192 4.080 -2.756 825 H ARG 114 H ARG 114 -16.670 5.151 -0.878 826 HA ARG 114 HA ARG 114 -18.257 5.414 1.594 827 HB2 ARG 114 1HB ARG 114 -18.946 6.951 -0.942 828 HB3 ARG 114 2HB ARG 114 -19.873 6.903 0.564 829 HG2 ARG 114 1HG ARG 114 -17.820 7.915 1.726 830 HG3 ARG 114 2HG ARG 114 -17.136 8.131 0.118 831 HD2 ARG 114 1HD ARG 114 -18.117 10.189 0.492 832 HD3 ARG 114 2HD ARG 114 -19.369 9.363 -0.451 833 HE ARG 114 HE ARG 114 -19.791 8.869 2.316 834 HH11 ARG 114 1HH1 ARG 114 -19.953 11.574 0.043 835 HH12 ARG 114 2HH1 ARG 114 -21.077 12.496 0.991 836 HH21 ARG 114 1HH2 ARG 114 -21.166 10.214 3.685 837 HH22 ARG 114 2HH2 ARG 114 -21.747 11.725 3.035 838 H ASP 115 H ASP 115 -20.533 4.715 1.216 839 HA ASP 115 HA ASP 115 -20.751 2.390 -0.545 840 HB2 ASP 115 1HB ASP 115 -22.905 2.133 0.536 841 HB3 ASP 115 2HB ASP 115 -21.683 2.390 1.780 842 H GLY 116 H GLY 116 -22.096 2.388 -2.368 843 HA2 GLY 116 1HA GLY 116 -23.945 2.876 -3.528 844 HA3 GLY 116 2HA GLY 116 -24.222 4.288 -2.494 845 H LYS 117 H LYS 117 -21.345 3.800 -4.718 846 HA LYS 117 HA LYS 117 -22.418 5.871 -6.449 847 HB2 LYS 117 1HB LYS 117 -20.977 6.641 -4.067 848 HB3 LYS 117 2HB LYS 117 -19.934 7.013 -5.426 849 HG2 LYS 117 1HG LYS 117 -22.874 7.796 -5.224 850 HG3 LYS 117 2HG LYS 117 -21.545 8.857 -4.781 851 HD2 LYS 117 1HD LYS 117 -21.771 7.650 -7.588 852 HD3 LYS 117 2HD LYS 117 -22.519 9.166 -7.139 853 HE2 LYS 117 1HE LYS 117 -20.390 10.171 -6.577 854 HE3 LYS 117 2HE LYS 117 -19.550 8.630 -6.721 855 HZ1 LYS 117 3HZ LYS 117 -19.822 8.643 -9.033 856 HZ2 LYS 117 1HZ LYS 117 -19.342 10.155 -8.636 857 HZ3 LYS 117 2HZ LYS 117 -20.911 9.885 -9.028 858 H GLU 118 H GLU 118 -21.835 5.259 -8.469 859 HA GLU 118 HA GLU 118 -19.554 3.807 -9.192 860 HB2 GLU 118 1HB GLU 118 -19.751 4.873 -11.437 861 HB3 GLU 118 2HB GLU 118 -21.107 3.912 -10.856 862 HG2 GLU 118 1HG GLU 118 -22.527 5.650 -10.726 863 HG3 GLU 118 2HG GLU 118 -21.318 6.833 -10.283 864 H ILE 119 H ILE 119 -17.429 4.250 -8.999 865 HA ILE 119 HA ILE 119 -16.403 6.882 -9.663 866 HB ILE 119 HB ILE 119 -14.965 7.059 -7.781 867 HG12 ILE 119 1HG1 ILE 119 -15.864 5.366 -5.791 868 HG13 ILE 119 2HG1 ILE 119 -15.886 4.294 -7.163 869 HG21 ILE 119 1HG2 ILE 119 -17.141 8.157 -7.624 870 HG22 ILE 119 2HG2 ILE 119 -17.793 6.749 -6.756 871 HG23 ILE 119 3HG2 ILE 119 -16.495 7.699 -6.039 872 HD11 ILE 119 3HD1 ILE 119 -13.697 4.224 -6.034 873 HD12 ILE 119 1HD1 ILE 119 -13.526 4.906 -7.671 874 HD13 ILE 119 2HD1 ILE 119 -13.512 5.977 -6.263 875 H SER 120 H SER 120 -14.094 6.810 -10.092 876 HA SER 120 HA SER 120 -12.686 4.278 -10.127 877 HB2 SER 120 1HB SER 120 -12.415 4.366 -12.687 878 HB3 SER 120 2HB SER 120 -13.996 3.851 -12.099 879 HG SER 120 HG SER 120 -14.426 5.286 -13.611 880 H THR 121 H THR 121 -12.385 7.262 -9.627 881 HA THR 121 HA THR 121 -9.665 7.629 -10.853 882 HB THR 121 HB THR 121 -10.677 9.976 -11.621 883 HG1 THR 121 1HG THR 121 -12.685 9.953 -10.863 884 HG21 THR 121 3HG2 THR 121 -11.455 7.467 -13.138 885 HG22 THR 121 1HG2 THR 121 -9.846 8.220 -13.149 886 HG23 THR 121 2HG2 THR 121 -11.242 9.112 -13.772 887 H ASP 122 H ASP 122 -10.806 7.769 -7.889 888 HA ASP 122 HA ASP 122 -8.612 9.593 -7.333 889 HB2 ASP 122 1HB ASP 122 -10.663 11.080 -7.240 890 HB3 ASP 122 2HB ASP 122 -11.199 10.152 -5.844 891 H ASP 123 H ASP 123 -7.899 7.347 -7.164 892 HA ASP 123 HA ASP 123 -8.300 6.448 -4.358 893 HB2 ASP 123 1HB ASP 123 -7.902 4.094 -5.004 894 HB3 ASP 123 2HB ASP 123 -9.486 4.782 -5.338 895 H LEU 124 H LEU 124 -6.008 5.235 -6.859 896 HA LEU 124 HA LEU 124 -3.819 6.221 -5.103 897 HB2 LEU 124 1HB LEU 124 -4.542 3.338 -5.620 898 HB3 LEU 124 2HB LEU 124 -2.894 3.811 -5.223 899 HG LEU 124 HG LEU 124 -5.242 4.528 -3.440 900 HD11 LEU 124 1HD1 LEU 124 -3.379 2.140 -3.253 901 HD12 LEU 124 2HD1 LEU 124 -5.129 2.121 -3.582 902 HD13 LEU 124 3HD1 LEU 124 -4.534 2.691 -2.019 903 HD21 LEU 124 3HD2 LEU 124 -3.337 5.946 -2.990 904 HD22 LEU 124 1HD2 LEU 124 -2.202 4.586 -3.099 905 HD23 LEU 124 2HD2 LEU 124 -3.335 4.691 -1.747 906 H ASN 125 H ASN 125 -2.881 7.447 -6.424 907 HA ASN 125 HA ASN 125 -1.674 6.377 -8.914 908 HB2 ASN 125 1HB ASN 125 -3.636 7.803 -9.398 909 HB3 ASN 125 2HB ASN 125 -2.951 9.093 -8.435 910 HD21 ASN 125 1HD2 ASN 125 -0.519 7.392 -10.537 911 HD22 ASN 125 2HD2 ASN 125 -0.724 8.514 -11.824 912 H LEU 126 H LEU 126 -0.287 6.007 -6.614 913 HA LEU 126 HA LEU 126 1.564 8.315 -6.353 914 HB2 LEU 126 1HB LEU 126 0.354 6.512 -4.349 915 HB3 LEU 126 2HB LEU 126 2.109 6.432 -4.331 916 HG LEU 126 HG LEU 126 2.287 8.882 -4.122 917 HD11 LEU 126 1HD1 LEU 126 -0.748 8.771 -3.843 918 HD12 LEU 126 2HD1 LEU 126 0.167 9.615 -5.111 919 HD13 LEU 126 3HD1 LEU 126 0.267 10.181 -3.443 920 HD21 LEU 126 3HD2 LEU 126 2.318 7.404 -2.144 921 HD22 LEU 126 1HD2 LEU 126 0.558 7.517 -2.008 922 HD23 LEU 126 2HD2 LEU 126 1.570 8.959 -1.757 923 H TYR 127 H TYR 127 3.674 7.987 -6.796 924 HA TYR 127 HA TYR 127 4.714 5.300 -7.318 925 HB2 TYR 127 1HB TYR 127 3.567 5.967 -9.407 926 HB3 TYR 127 2HB TYR 127 4.565 7.398 -9.468 927 HD1 TYR 127 2HD TYR 127 4.455 3.744 -9.854 928 HD2 TYR 127 1HD TYR 127 6.961 7.251 -10.119 929 HE1 TYR 127 2HE TYR 127 6.193 2.414 -11.009 930 HE2 TYR 127 1HE TYR 127 8.639 5.956 -11.353 931 HH TYR 127 HH TYR 127 9.382 3.658 -11.838 932 H TYR 128 H TYR 128 6.174 5.621 -5.618 933 HA TYR 128 HA TYR 128 7.811 8.090 -5.592 934 HB2 TYR 128 1HB TYR 128 7.704 5.659 -3.755 935 HB3 TYR 128 2HB TYR 128 8.846 6.951 -3.604 936 HD1 TYR 128 2HD TYR 128 5.821 8.578 -4.619 937 HD2 TYR 128 1HD TYR 128 7.632 6.562 -1.228 938 HE1 TYR 128 2HE TYR 128 4.459 9.921 -3.093 939 HE2 TYR 128 1HE TYR 128 6.356 8.080 0.289 940 HH TYR 128 HH TYR 128 4.656 10.920 -0.971 941 H ASN 129 H ASN 129 10.042 8.022 -5.730 942 HA ASN 129 HA ASN 129 11.516 5.692 -6.576 943 HB2 ASN 129 1HB ASN 129 10.480 7.571 -8.543 944 HB3 ASN 129 2HB ASN 129 12.250 7.583 -8.410 945 HD21 ASN 129 1HD2 ASN 129 13.213 5.215 -8.363 946 HD22 ASN 129 2HD2 ASN 129 12.700 4.383 -9.826 Start of MODEL 13 1 H1 GLY 1 H GLY 1 27.602 -15.661 -0.007 2 HA2 GLY 1 1HA GLY 1 29.677 -14.410 0.231 3 HA3 GLY 1 2HA GLY 1 28.408 -13.419 -0.517 4 H ASP 2 H ASP 2 30.528 -12.065 0.840 5 HA ASP 2 HA ASP 2 28.890 -10.532 2.575 6 HB2 ASP 2 1HB ASP 2 30.133 -12.383 4.070 7 HB3 ASP 2 2HB ASP 2 31.466 -11.242 3.973 8 H ASP 3 H ASP 3 29.191 -8.699 1.362 9 HA ASP 3 HA ASP 3 31.629 -7.701 0.133 10 HB2 ASP 3 1HB ASP 3 31.659 -9.898 -0.841 11 HB3 ASP 3 2HB ASP 3 29.918 -9.901 -0.953 12 H ASP 4 H ASP 4 30.912 -5.624 -0.701 13 HA ASP 4 HA ASP 4 28.117 -5.061 -1.272 14 HB2 ASP 4 1HB ASP 4 28.076 -5.125 1.201 15 HB3 ASP 4 2HB ASP 4 29.439 -4.014 1.267 16 H GLU 5 H GLU 5 28.251 -3.467 -2.873 17 HA GLU 5 HA GLU 5 30.354 -1.445 -2.864 18 HB2 GLU 5 1HB GLU 5 31.219 -2.056 -5.117 19 HB3 GLU 5 2HB GLU 5 31.767 -2.969 -3.740 20 HG2 GLU 5 1HG GLU 5 31.618 -4.581 -5.343 21 HG3 GLU 5 2HG GLU 5 30.148 -4.814 -4.408 22 HA PRO 6 HA PRO 6 26.503 -0.097 -4.898 23 HB2 PRO 6 1HB PRO 6 25.911 2.077 -3.428 24 HB3 PRO 6 2HB PRO 6 25.711 0.403 -2.812 25 HG2 PRO 6 1HG PRO 6 28.037 2.286 -2.281 26 HG3 PRO 6 2HG PRO 6 27.064 1.384 -1.090 27 HD2 PRO 6 1HD PRO 6 29.445 0.441 -2.118 28 HD3 PRO 6 2HD PRO 6 28.119 -0.642 -1.608 29 H GLY 7 H GLY 7 26.434 1.259 -6.671 30 HA2 GLY 7 1HA GLY 7 28.409 3.475 -6.902 31 HA3 GLY 7 2HA GLY 7 27.594 2.631 -8.233 32 H GLY 8 H GLY 8 26.912 4.662 -5.320 33 HA2 GLY 8 1HA GLY 8 25.703 6.787 -6.272 34 HA3 GLY 8 2HA GLY 8 24.375 5.618 -6.459 35 H LYS 9 H LYS 9 23.332 7.250 -4.936 36 HA LYS 9 HA LYS 9 23.418 5.928 -2.378 37 HB2 LYS 9 1HB LYS 9 24.269 8.437 -2.261 38 HB3 LYS 9 2HB LYS 9 22.550 8.817 -2.479 39 HG2 LYS 9 1HG LYS 9 22.126 7.158 -0.530 40 HG3 LYS 9 2HG LYS 9 23.858 7.123 -0.295 41 HD2 LYS 9 1HD LYS 9 23.884 9.466 0.305 42 HD3 LYS 9 2HD LYS 9 22.189 9.677 -0.169 43 HE2 LYS 9 1HE LYS 9 23.099 7.714 1.975 44 HE3 LYS 9 2HE LYS 9 22.637 9.377 2.343 45 HZ1 LYS 9 3HZ LYS 9 20.820 7.421 1.038 46 HZ2 LYS 9 1HZ LYS 9 20.447 8.940 1.553 47 HZ3 LYS 9 2HZ LYS 9 20.830 7.764 2.636 48 H GLY 10 H GLY 10 21.182 6.200 -1.504 49 HA2 GLY 10 1HA GLY 10 18.988 7.084 -2.910 50 HA3 GLY 10 2HA GLY 10 18.970 5.319 -3.061 51 H ALA 11 H ALA 11 17.325 4.833 -1.548 52 HA ALA 11 HA ALA 11 17.597 5.853 1.234 53 HB1 ALA 11 1HB ALA 11 15.234 6.606 1.236 54 HB2 ALA 11 2HB ALA 11 16.148 7.475 -0.018 55 HB3 ALA 11 3HB ALA 11 15.063 6.128 -0.467 56 H MET 12 H MET 12 15.475 4.809 2.421 57 HA MET 12 HA MET 12 14.922 2.120 1.427 58 HB2 MET 12 1HB MET 12 14.901 3.022 4.340 59 HB3 MET 12 2HB MET 12 14.351 1.485 3.708 60 HG2 MET 12 1HG MET 12 16.734 1.227 2.757 61 HG3 MET 12 2HG MET 12 17.194 2.543 3.822 62 HE1 MET 12 3HE MET 12 15.413 -1.492 5.105 63 HE2 MET 12 1HE MET 12 15.102 -0.578 3.613 64 HE3 MET 12 2HE MET 12 16.598 -1.505 3.782 65 H TYR 13 H TYR 13 12.526 1.701 1.986 66 HA TYR 13 HA TYR 13 10.922 4.070 2.563 67 HB2 TYR 13 1HB TYR 13 10.693 2.406 0.026 68 HB3 TYR 13 2HB TYR 13 9.456 3.455 0.677 69 HD1 TYR 13 2HD TYR 13 9.709 5.906 0.796 70 HD2 TYR 13 1HD TYR 13 12.349 3.396 -1.511 71 HE1 TYR 13 2HE TYR 13 10.160 7.787 -0.747 72 HE2 TYR 13 1HE TYR 13 12.781 5.266 -3.081 73 HH TYR 13 HH TYR 13 12.278 7.526 -3.631 74 H GLU 14 H GLU 14 9.009 3.449 3.592 75 HA GLU 14 HA GLU 14 8.284 0.593 3.829 76 HB2 GLU 14 1HB GLU 14 9.739 0.776 5.665 77 HB3 GLU 14 2HB GLU 14 9.250 2.427 6.027 78 HG2 GLU 14 1HG GLU 14 7.027 1.555 6.820 79 HG3 GLU 14 2HG GLU 14 7.599 -0.091 6.508 80 H VAL 15 H VAL 15 6.127 0.544 3.463 81 HA VAL 15 HA VAL 15 4.501 2.994 3.973 82 HB VAL 15 HB VAL 15 4.689 2.300 1.614 83 HG11 VAL 15 1HG1 VAL 15 4.956 -0.165 1.921 84 HG12 VAL 15 2HG1 VAL 15 3.247 -0.262 2.394 85 HG13 VAL 15 3HG1 VAL 15 3.696 0.260 0.767 86 HG21 VAL 15 3HG2 VAL 15 2.415 2.379 0.966 87 HG22 VAL 15 1HG2 VAL 15 1.846 1.803 2.531 88 HG23 VAL 15 2HG2 VAL 15 2.606 3.411 2.400 89 H THR 16 H THR 16 2.302 2.552 4.600 90 HA THR 16 HA THR 16 1.906 0.153 6.269 91 HB THR 16 HB THR 16 0.947 1.844 7.969 92 HG1 THR 16 1HG THR 16 2.516 3.549 6.331 93 HG21 THR 16 3HG2 THR 16 2.991 0.704 8.507 94 HG22 THR 16 1HG2 THR 16 3.109 2.399 8.991 95 HG23 THR 16 2HG2 THR 16 3.956 1.846 7.536 96 H ILE 17 H ILE 17 -0.281 -0.414 6.467 97 HA ILE 17 HA ILE 17 -2.257 1.223 5.120 98 HB ILE 17 HB ILE 17 -1.532 -0.288 3.378 99 HG12 ILE 17 1HG1 ILE 17 -3.592 -1.633 2.934 100 HG13 ILE 17 2HG1 ILE 17 -4.110 -1.392 4.612 101 HG21 ILE 17 1HG2 ILE 17 -1.604 -2.723 3.473 102 HG22 ILE 17 2HG2 ILE 17 -0.383 -2.009 4.525 103 HG23 ILE 17 3HG2 ILE 17 -1.910 -2.646 5.223 104 HD11 ILE 17 3HD1 ILE 17 -5.249 0.118 3.122 105 HD12 ILE 17 1HD1 ILE 17 -4.206 1.090 4.178 106 HD13 ILE 17 2HD1 ILE 17 -3.696 0.765 2.493 107 H GLU 18 H GLU 18 -4.010 1.326 6.396 108 HA GLU 18 HA GLU 18 -4.549 -0.738 8.465 109 HB2 GLU 18 1HB GLU 18 -4.384 2.293 8.551 110 HB3 GLU 18 2HB GLU 18 -5.510 1.476 9.618 111 HG2 GLU 18 1HG GLU 18 -2.692 0.406 9.623 112 HG3 GLU 18 2HG GLU 18 -2.926 2.010 10.259 113 H GLN 19 H GLN 19 -6.600 -1.553 8.153 114 HA GLN 19 HA GLN 19 -8.367 -0.195 6.184 115 HB2 GLN 19 1HB GLN 19 -8.193 -3.074 7.220 116 HB3 GLN 19 2HB GLN 19 -9.370 -2.483 6.055 117 HG2 GLN 19 1HG GLN 19 -7.535 -1.878 4.485 118 HG3 GLN 19 2HG GLN 19 -6.359 -2.542 5.623 119 HE21 GLN 19 1HE2 GLN 19 -6.142 -4.862 5.782 120 HE22 GLN 19 2HE2 GLN 19 -6.943 -5.921 4.623 121 H SER 20 H SER 20 -10.464 0.543 6.848 122 HA SER 20 HA SER 20 -11.576 -0.608 9.326 123 HB2 SER 20 1HB SER 20 -11.664 2.353 8.609 124 HB3 SER 20 2HB SER 20 -12.377 1.590 10.039 125 HG SER 20 HG SER 20 -10.165 0.964 10.592 126 H GLY 21 H GLY 21 -14.049 0.014 9.444 127 HA2 GLY 21 1HA GLY 21 -16.090 0.318 8.460 128 HA3 GLY 21 2HA GLY 21 -15.279 0.780 6.956 129 H ASP 22 H ASP 22 -16.704 -0.424 5.678 130 HA ASP 22 HA ASP 22 -16.602 -3.380 5.791 131 HB2 ASP 22 1HB ASP 22 -18.596 -2.446 4.871 132 HB3 ASP 22 2HB ASP 22 -17.691 -1.382 3.800 133 H PHE 23 H PHE 23 -14.430 -3.850 5.774 134 HA PHE 23 HA PHE 23 -13.016 -3.050 3.281 135 HB2 PHE 23 1HB PHE 23 -10.909 -3.400 4.377 136 HB3 PHE 23 2HB PHE 23 -11.853 -2.162 5.164 137 HD1 PHE 23 2HD PHE 23 -12.802 -2.454 7.377 138 HD2 PHE 23 1HD PHE 23 -10.305 -5.460 5.603 139 HE1 PHE 23 2HE PHE 23 -12.123 -3.195 9.644 140 HE2 PHE 23 1HE PHE 23 -9.645 -6.229 7.886 141 HZ PHE 23 HZ PHE 23 -10.531 -5.098 9.896 142 H ARG 24 H ARG 24 -15.053 -5.207 3.771 143 HA ARG 24 HA ARG 24 -13.384 -7.655 3.405 144 HB2 ARG 24 1HB ARG 24 -16.232 -7.079 4.353 145 HB3 ARG 24 2HB ARG 24 -15.789 -8.672 3.735 146 HG2 ARG 24 1HG ARG 24 -13.994 -8.892 5.357 147 HG3 ARG 24 2HG ARG 24 -14.319 -7.260 5.996 148 HD2 ARG 24 1HD ARG 24 -16.517 -7.947 6.754 149 HD3 ARG 24 2HD ARG 24 -16.341 -9.514 5.954 150 HE ARG 24 HE ARG 24 -14.526 -8.522 8.121 151 HH11 ARG 24 1HH1 ARG 24 -16.331 -11.255 6.745 152 HH12 ARG 24 2HH1 ARG 24 -16.041 -12.318 8.073 153 HH21 ARG 24 1HH2 ARG 24 -13.753 -10.078 9.527 154 HH22 ARG 24 2HH2 ARG 24 -14.596 -11.607 9.770 155 H SER 25 H SER 25 -15.790 -5.529 1.927 156 HA SER 25 HA SER 25 -16.530 -7.599 0.039 157 HB2 SER 25 1HB SER 25 -17.859 -4.976 0.648 158 HB3 SER 25 2HB SER 25 -18.582 -6.465 0.074 159 HG SER 25 HG SER 25 -17.789 -5.658 2.610 160 H PHE 26 H PHE 26 -14.096 -5.886 -0.600 161 HA PHE 26 HA PHE 26 -15.106 -4.557 -3.071 162 HB2 PHE 26 1HB PHE 26 -13.078 -3.444 -1.079 163 HB3 PHE 26 2HB PHE 26 -13.411 -2.807 -2.684 164 HD1 PHE 26 1HD PHE 26 -15.432 -1.513 -3.151 165 HD2 PHE 26 2HD PHE 26 -14.708 -3.113 0.783 166 HE1 PHE 26 1HE PHE 26 -17.312 -0.170 -2.270 167 HE2 PHE 26 2HE PHE 26 -16.562 -1.721 1.652 168 HZ PHE 26 HZ PHE 26 -17.900 -0.345 0.185 169 H ILE 27 H ILE 27 -13.815 -4.729 -4.805 170 HA ILE 27 HA ILE 27 -11.669 -6.694 -4.636 171 HB ILE 27 HB ILE 27 -12.384 -4.988 -7.048 172 HG12 ILE 27 1HG1 ILE 27 -13.389 -7.537 -7.543 173 HG13 ILE 27 2HG1 ILE 27 -13.793 -7.321 -5.837 174 HG21 ILE 27 1HG2 ILE 27 -11.168 -6.749 -8.236 175 HG22 ILE 27 2HG2 ILE 27 -10.143 -6.140 -6.964 176 HG23 ILE 27 3HG2 ILE 27 -10.972 -7.686 -6.750 177 HD11 ILE 27 3HD1 ILE 27 -15.072 -5.319 -6.340 178 HD12 ILE 27 1HD1 ILE 27 -14.573 -5.376 -8.043 179 HD13 ILE 27 2HD1 ILE 27 -15.611 -6.643 -7.373 180 H LYS 28 H LYS 28 -10.276 -5.842 -3.243 181 HA LYS 28 HA LYS 28 -9.146 -3.157 -3.606 182 HB2 LYS 28 1HB LYS 28 -8.125 -3.568 -1.393 183 HB3 LYS 28 2HB LYS 28 -9.858 -3.789 -1.407 184 HG2 LYS 28 1HG LYS 28 -9.496 -6.265 -1.598 185 HG3 LYS 28 2HG LYS 28 -7.757 -5.987 -1.360 186 HD2 LYS 28 1HD LYS 28 -8.151 -5.140 0.884 187 HD3 LYS 28 2HD LYS 28 -9.908 -5.014 0.572 188 HE2 LYS 28 1HE LYS 28 -9.876 -7.529 0.123 189 HE3 LYS 28 2HE LYS 28 -8.264 -7.572 0.846 190 HZ1 LYS 28 3HZ LYS 28 -10.705 -6.542 2.167 191 HZ2 LYS 28 1HZ LYS 28 -9.215 -6.813 2.891 192 HZ3 LYS 28 2HZ LYS 28 -10.164 -8.067 2.297 193 H SER 29 H SER 29 -6.892 -2.762 -3.885 194 HA SER 29 HA SER 29 -5.285 -4.956 -5.022 195 HB2 SER 29 1HB SER 29 -6.550 -3.891 -6.868 196 HB3 SER 29 2HB SER 29 -5.929 -2.307 -6.398 197 HG SER 29 HG SER 29 -4.837 -3.510 -8.141 198 H VAL 30 H VAL 30 -3.070 -4.538 -4.802 199 HA VAL 30 HA VAL 30 -2.248 -1.785 -4.214 200 HB VAL 30 HB VAL 30 -1.025 -4.043 -2.578 201 HG11 VAL 30 1HG1 VAL 30 -0.651 -1.014 -2.457 202 HG12 VAL 30 2HG1 VAL 30 0.199 -2.235 -1.486 203 HG13 VAL 30 3HG1 VAL 30 0.484 -2.131 -3.221 204 HG21 VAL 30 3HG2 VAL 30 -2.892 -1.806 -1.669 205 HG22 VAL 30 1HG2 VAL 30 -3.230 -3.549 -1.635 206 HG23 VAL 30 2HG2 VAL 30 -1.978 -2.887 -0.595 207 H VAL 31 H VAL 31 -1.294 -1.413 -6.093 208 HA VAL 31 HA VAL 31 0.546 -3.199 -7.446 209 HB VAL 31 HB VAL 31 0.207 -0.158 -7.558 210 HG11 VAL 31 1HG1 VAL 31 1.489 -2.072 -9.560 211 HG12 VAL 31 2HG1 VAL 31 1.278 -0.312 -9.759 212 HG13 VAL 31 3HG1 VAL 31 2.349 -0.931 -8.505 213 HG21 VAL 31 3HG2 VAL 31 -1.935 -1.232 -8.168 214 HG22 VAL 31 1HG2 VAL 31 -1.170 -0.475 -9.549 215 HG23 VAL 31 2HG2 VAL 31 -1.099 -2.244 -9.363 216 H VAL 32 H VAL 32 2.431 -3.745 -6.431 217 HA VAL 32 HA VAL 32 3.808 -1.738 -4.712 218 HB VAL 32 HB VAL 32 3.889 -4.794 -4.666 219 HG11 VAL 32 1HG1 VAL 32 5.447 -2.693 -3.126 220 HG12 VAL 32 2HG1 VAL 32 5.249 -4.377 -2.555 221 HG13 VAL 32 3HG1 VAL 32 6.071 -4.039 -4.084 222 HG21 VAL 32 3HG2 VAL 32 2.713 -2.808 -2.686 223 HG22 VAL 32 1HG2 VAL 32 1.829 -4.011 -3.656 224 HG23 VAL 32 2HG2 VAL 32 2.921 -4.543 -2.383 225 H VAL 33 H VAL 33 5.623 -0.910 -5.706 226 HA VAL 33 HA VAL 33 7.318 -2.866 -7.087 227 HB VAL 33 HB VAL 33 7.018 -0.007 -8.090 228 HG11 VAL 33 1HG1 VAL 33 9.250 -0.901 -8.558 229 HG12 VAL 33 2HG1 VAL 33 8.541 -2.431 -9.151 230 HG13 VAL 33 3HG1 VAL 33 8.330 -0.918 -10.045 231 HG21 VAL 33 3HG2 VAL 33 5.746 -2.553 -9.141 232 HG22 VAL 33 1HG2 VAL 33 4.984 -0.998 -8.774 233 HG23 VAL 33 2HG2 VAL 33 6.057 -1.158 -10.171 234 H ALA 34 H ALA 34 9.569 -2.334 -6.800 235 HA ALA 34 HA ALA 34 10.354 -0.046 -5.204 236 HB1 ALA 34 1HB ALA 34 10.119 -1.612 -3.368 237 HB2 ALA 34 2HB ALA 34 10.992 -2.884 -4.270 238 HB3 ALA 34 3HB ALA 34 11.841 -1.425 -3.719 239 H ASN 35 H ASN 35 12.006 0.766 -6.372 240 HA ASN 35 HA ASN 35 13.330 -0.757 -8.511 241 HB2 ASN 35 1HB ASN 35 12.751 1.642 -8.756 242 HB3 ASN 35 2HB ASN 35 13.828 2.034 -7.387 243 HD21 ASN 35 1HD2 ASN 35 13.931 3.178 -9.986 244 HD22 ASN 35 2HD2 ASN 35 15.620 2.927 -10.444 245 H GLY 36 H GLY 36 14.887 -2.272 -7.805 246 HA2 GLY 36 1HA GLY 36 17.145 -2.505 -7.453 247 HA3 GLY 36 2HA GLY 36 17.200 -0.976 -6.608 248 H THR 37 H THR 37 14.874 -3.182 -5.217 249 HA THR 37 HA THR 37 16.699 -4.914 -3.974 250 HB THR 37 HB THR 37 17.081 -2.983 -2.494 251 HG1 THR 37 1HG THR 37 17.412 -4.866 -1.494 252 HG21 THR 37 3HG2 THR 37 14.270 -3.395 -1.452 253 HG22 THR 37 1HG2 THR 37 14.619 -2.188 -2.694 254 HG23 THR 37 2HG2 THR 37 15.407 -2.063 -1.111 255 H GLN 38 H GLN 38 15.080 -6.064 -2.053 256 HA GLN 38 HA GLN 38 12.422 -6.302 -3.327 257 HB2 GLN 38 1HB GLN 38 14.027 -8.511 -2.059 258 HB3 GLN 38 2HB GLN 38 12.291 -8.590 -2.080 259 HG2 GLN 38 1HG GLN 38 14.180 -8.780 -4.254 260 HG3 GLN 38 2HG GLN 38 12.741 -9.734 -4.014 261 HE21 GLN 38 1HE2 GLN 38 14.005 -8.230 -6.480 262 HE22 GLN 38 2HE2 GLN 38 12.780 -7.062 -6.932 263 H LEU 39 H LEU 39 10.913 -7.214 -1.979 264 HA LEU 39 HA LEU 39 10.365 -5.168 0.163 265 HB2 LEU 39 1HB LEU 39 8.718 -6.716 -1.783 266 HB3 LEU 39 2HB LEU 39 8.007 -6.586 -0.190 267 HG LEU 39 HG LEU 39 7.350 -4.932 -1.979 268 HD11 LEU 39 1HD1 LEU 39 6.688 -4.701 0.355 269 HD12 LEU 39 2HD1 LEU 39 7.049 -3.113 -0.338 270 HD13 LEU 39 3HD1 LEU 39 8.219 -3.886 0.736 271 HD21 LEU 39 3HD2 LEU 39 9.756 -4.348 -2.615 272 HD22 LEU 39 1HD2 LEU 39 9.788 -3.378 -1.107 273 HD23 LEU 39 2HD2 LEU 39 8.617 -3.024 -2.407 274 H LYS 40 H LYS 40 9.130 -5.944 2.101 275 HA LYS 40 HA LYS 40 9.608 -8.752 2.865 276 HB2 LYS 40 1HB LYS 40 11.437 -7.150 3.635 277 HB3 LYS 40 2HB LYS 40 10.243 -6.407 4.697 278 HG2 LYS 40 1HG LYS 40 9.823 -8.633 5.727 279 HG3 LYS 40 2HG LYS 40 11.021 -9.363 4.658 280 HD2 LYS 40 1HD LYS 40 12.821 -8.152 5.659 281 HD3 LYS 40 2HD LYS 40 11.726 -7.087 6.545 282 HE2 LYS 40 1HE LYS 40 11.286 -9.962 7.124 283 HE3 LYS 40 2HE LYS 40 12.925 -9.423 7.517 284 HZ1 LYS 40 3HZ LYS 40 11.424 -9.130 9.382 285 HZ2 LYS 40 1HZ LYS 40 10.470 -8.095 8.507 286 HZ3 LYS 40 2HZ LYS 40 12.040 -7.702 8.864 287 H ASP 41 H ASP 41 7.824 -9.567 3.647 288 HA ASP 41 HA ASP 41 5.396 -8.023 3.945 289 HB2 ASP 41 1HB ASP 41 5.722 -10.489 3.185 290 HB3 ASP 41 2HB ASP 41 5.712 -10.891 4.890 291 H GLY 42 H GLY 42 4.492 -7.090 5.841 292 HA2 GLY 42 1HA GLY 42 5.892 -7.165 8.338 293 HA3 GLY 42 2HA GLY 42 4.281 -6.514 8.025 294 H ALA 43 H ALA 43 3.537 -9.394 6.918 295 HA ALA 43 HA ALA 43 2.378 -10.432 9.306 296 HB1 ALA 43 1HB ALA 43 1.546 -11.022 7.026 297 HB2 ALA 43 2HB ALA 43 3.067 -11.837 6.671 298 HB3 ALA 43 3HB ALA 43 2.003 -12.472 7.935 299 H THR 44 H THR 44 5.109 -11.686 7.369 300 HA THR 44 HA THR 44 6.135 -13.134 9.735 301 HB THR 44 HB THR 44 6.289 -14.986 7.747 302 HG1 THR 44 1HG THR 44 4.817 -14.653 6.205 303 HG21 THR 44 3HG2 THR 44 5.271 -15.149 10.029 304 HG22 THR 44 1HG2 THR 44 4.340 -15.982 8.787 305 HG23 THR 44 2HG2 THR 44 3.783 -14.409 9.389 306 H GLY 45 H GLY 45 7.092 -10.895 7.519 307 HA2 GLY 45 1HA GLY 45 9.119 -10.137 7.149 308 HA3 GLY 45 2HA GLY 45 9.833 -11.483 8.058 309 H GLU 46 H GLU 46 7.707 -12.399 5.514 310 HA GLU 46 HA GLU 46 9.714 -13.859 4.115 311 HB2 GLU 46 1HB GLU 46 6.864 -13.160 3.243 312 HB3 GLU 46 2HB GLU 46 7.885 -14.467 2.615 313 HG2 GLU 46 1HG GLU 46 8.010 -15.336 5.042 314 HG3 GLU 46 2HG GLU 46 6.787 -14.112 5.413 315 H SER 47 H SER 47 10.969 -13.273 2.431 316 HA SER 47 HA SER 47 11.154 -10.537 1.584 317 HB2 SER 47 1HB SER 47 12.289 -12.918 0.123 318 HB3 SER 47 2HB SER 47 13.010 -11.318 0.333 319 HG SER 47 HG SER 47 13.784 -13.256 1.596 320 H LEU 48 H LEU 48 9.966 -9.633 -0.070 321 HA LEU 48 HA LEU 48 8.240 -11.432 -1.721 322 HB2 LEU 48 1HB LEU 48 7.725 -8.545 -1.056 323 HB3 LEU 48 2HB LEU 48 6.641 -9.667 -1.859 324 HG LEU 48 HG LEU 48 7.538 -9.793 1.061 325 HD11 LEU 48 1HD1 LEU 48 6.091 -7.911 0.563 326 HD12 LEU 48 2HD1 LEU 48 5.176 -9.129 1.467 327 HD13 LEU 48 3HD1 LEU 48 4.951 -8.995 -0.282 328 HD21 LEU 48 3HD2 LEU 48 5.825 -11.606 1.280 329 HD22 LEU 48 1HD2 LEU 48 7.097 -12.072 0.146 330 HD23 LEU 48 2HD2 LEU 48 5.520 -11.515 -0.480 331 H ALA 49 H ALA 49 8.390 -11.314 -3.794 332 HA ALA 49 HA ALA 49 10.680 -9.757 -4.911 333 HB1 ALA 49 1HB ALA 49 10.755 -12.189 -5.139 334 HB2 ALA 49 2HB ALA 49 9.149 -12.205 -5.909 335 HB3 ALA 49 3HB ALA 49 10.528 -11.460 -6.751 336 H SER 50 H SER 50 9.680 -7.765 -5.199 337 HA SER 50 HA SER 50 7.316 -7.046 -6.390 338 HB2 SER 50 1HB SER 50 10.048 -5.672 -6.352 339 HB3 SER 50 2HB SER 50 8.468 -4.912 -6.555 340 HG SER 50 HG SER 50 9.636 -6.106 -4.315 341 HA PRO 51 HA PRO 51 6.704 -5.300 -7.802 342 HB2 PRO 51 1HB PRO 51 5.093 -4.971 -9.938 343 HB3 PRO 51 2HB PRO 51 6.747 -4.262 -9.879 344 HG2 PRO 51 1HG PRO 51 5.894 -6.784 -11.235 345 HG3 PRO 51 2HG PRO 51 6.889 -5.458 -11.909 346 HD2 PRO 51 1HD PRO 51 7.963 -7.752 -10.780 347 HD3 PRO 51 2HD PRO 51 8.799 -6.176 -10.749 348 H VAL 52 H VAL 52 4.437 -5.710 -7.115 349 HA VAL 52 HA VAL 52 3.310 -8.396 -7.627 350 HB VAL 52 HB VAL 52 3.953 -7.238 -4.855 351 HG11 VAL 52 1HG1 VAL 52 1.733 -8.293 -4.757 352 HG12 VAL 52 2HG1 VAL 52 2.370 -9.764 -5.522 353 HG13 VAL 52 3HG1 VAL 52 2.908 -9.281 -3.899 354 HG21 VAL 52 3HG2 VAL 52 5.211 -9.313 -4.463 355 HG22 VAL 52 1HG2 VAL 52 4.835 -9.865 -6.115 356 HG23 VAL 52 2HG2 VAL 52 5.869 -8.460 -5.847 357 H ILE 53 H ILE 53 1.074 -8.440 -7.446 358 HA ILE 53 HA ILE 53 -0.218 -5.798 -7.037 359 HB ILE 53 HB ILE 53 -1.083 -7.877 -9.041 360 HG12 ILE 53 1HG1 ILE 53 0.970 -7.103 -9.970 361 HG13 ILE 53 2HG1 ILE 53 -0.384 -6.391 -10.814 362 HG21 ILE 53 1HG2 ILE 53 -2.846 -6.423 -8.163 363 HG22 ILE 53 2HG2 ILE 53 -1.904 -4.973 -8.515 364 HG23 ILE 53 3HG2 ILE 53 -2.501 -5.998 -9.845 365 HD11 ILE 53 3HD1 ILE 53 0.010 -4.244 -9.489 366 HD12 ILE 53 1HD1 ILE 53 1.528 -4.993 -8.944 367 HD13 ILE 53 2HD1 ILE 53 1.263 -4.703 -10.658 368 H LEU 54 H LEU 54 -0.525 -6.396 -4.863 369 HA LEU 54 HA LEU 54 -1.590 -9.011 -4.063 370 HB2 LEU 54 1HB LEU 54 -1.420 -6.346 -2.597 371 HB3 LEU 54 2HB LEU 54 -2.133 -7.805 -1.910 372 HG LEU 54 HG LEU 54 0.774 -7.459 -2.719 373 HD11 LEU 54 1HD1 LEU 54 -0.587 -7.869 -0.024 374 HD12 LEU 54 2HD1 LEU 54 0.111 -6.345 -0.623 375 HD13 LEU 54 3HD1 LEU 54 1.155 -7.742 -0.293 376 HD21 LEU 54 3HD2 LEU 54 -0.782 -9.916 -1.806 377 HD22 LEU 54 1HD2 LEU 54 0.979 -9.773 -1.600 378 HD23 LEU 54 2HD2 LEU 54 0.260 -9.755 -3.209 379 H SER 55 H SER 55 -3.534 -9.708 -3.838 380 HA SER 55 HA SER 55 -5.743 -8.047 -4.864 381 HB2 SER 55 1HB SER 55 -5.566 -11.068 -4.610 382 HB3 SER 55 2HB SER 55 -6.649 -10.108 -5.629 383 HG SER 55 HG SER 55 -3.817 -10.318 -5.906 384 H ASP 56 H ASP 56 -7.865 -9.001 -4.090 385 HA ASP 56 HA ASP 56 -8.473 -8.165 -1.590 386 HB2 ASP 56 1HB ASP 56 -10.095 -8.427 -3.323 387 HB3 ASP 56 2HB ASP 56 -9.766 -10.148 -3.477 388 H GLU 57 H GLU 57 -7.731 -11.616 -2.343 389 HA GLU 57 HA GLU 57 -8.407 -12.413 0.379 390 HB2 GLU 57 1HB GLU 57 -6.914 -13.810 -1.881 391 HB3 GLU 57 2HB GLU 57 -7.198 -14.514 -0.280 392 HG2 GLU 57 1HG GLU 57 -9.667 -14.175 -0.596 393 HG3 GLU 57 2HG GLU 57 -9.337 -13.707 -2.276 394 H GLU 58 H GLU 58 -5.377 -11.517 -1.348 395 HA GLU 58 HA GLU 58 -3.634 -12.291 0.772 396 HB2 GLU 58 1HB GLU 58 -3.115 -10.206 -1.381 397 HB3 GLU 58 2HB GLU 58 -1.940 -11.213 -0.521 398 HG2 GLU 58 1HG GLU 58 -2.747 -13.218 -1.703 399 HG3 GLU 58 2HG GLU 58 -4.000 -12.230 -2.468 400 H LEU 59 H LEU 59 -5.828 -9.748 0.442 401 HA LEU 59 HA LEU 59 -4.471 -7.985 2.425 402 HB2 LEU 59 1HB LEU 59 -6.263 -7.454 0.040 403 HB3 LEU 59 2HB LEU 59 -5.960 -6.217 1.259 404 HG LEU 59 HG LEU 59 -3.636 -7.620 -0.127 405 HD11 LEU 59 1HD1 LEU 59 -5.190 -5.222 -1.109 406 HD12 LEU 59 2HD1 LEU 59 -5.041 -6.768 -1.924 407 HD13 LEU 59 3HD1 LEU 59 -3.618 -5.750 -1.759 408 HD21 LEU 59 3HD2 LEU 59 -3.125 -6.248 1.880 409 HD22 LEU 59 1HD2 LEU 59 -3.922 -4.847 1.117 410 HD23 LEU 59 2HD2 LEU 59 -2.446 -5.543 0.406 411 H ALA 60 H ALA 60 -6.672 -10.339 2.476 412 HA ALA 60 HA ALA 60 -8.848 -9.102 3.933 413 HB1 ALA 60 1HB ALA 60 -9.595 -11.363 4.336 414 HB2 ALA 60 2HB ALA 60 -9.112 -11.192 2.641 415 HB3 ALA 60 3HB ALA 60 -8.046 -12.032 3.787 416 H VAL 61 H VAL 61 -5.779 -9.029 4.830 417 HA VAL 61 HA VAL 61 -5.879 -9.698 7.620 418 HB VAL 61 HB VAL 61 -3.876 -8.221 7.755 419 HG11 VAL 61 1HG1 VAL 61 -2.397 -9.587 6.430 420 HG12 VAL 61 2HG1 VAL 61 -3.653 -10.593 7.162 421 HG13 VAL 61 3HG1 VAL 61 -3.744 -10.184 5.433 422 HG21 VAL 61 3HG2 VAL 61 -4.482 -6.536 6.018 423 HG22 VAL 61 1HG2 VAL 61 -2.884 -7.245 5.760 424 HG23 VAL 61 2HG2 VAL 61 -4.239 -7.769 4.757 425 H GLU 62 H GLU 62 -5.254 -7.455 9.029 426 HA GLU 62 HA GLU 62 -7.406 -5.422 8.583 427 HB2 GLU 62 1HB GLU 62 -7.341 -4.961 10.942 428 HB3 GLU 62 2HB GLU 62 -7.615 -6.686 10.684 429 HG2 GLU 62 1HG GLU 62 -5.146 -7.077 11.083 430 HG3 GLU 62 2HG GLU 62 -4.991 -5.358 11.434 431 H LYS 63 H LYS 63 -3.899 -5.869 9.119 432 HA LYS 63 HA LYS 63 -3.291 -3.143 8.151 433 HB2 LYS 63 1HB LYS 63 -3.401 -3.036 10.678 434 HB3 LYS 63 2HB LYS 63 -2.207 -4.327 10.742 435 HG2 LYS 63 1HG LYS 63 -0.860 -2.606 9.121 436 HG3 LYS 63 2HG LYS 63 -1.867 -1.454 9.927 437 HD2 LYS 63 1HD LYS 63 -0.396 -3.346 11.723 438 HD3 LYS 63 2HD LYS 63 0.583 -2.308 10.685 439 HE2 LYS 63 1HE LYS 63 0.363 -1.226 12.786 440 HE3 LYS 63 2HE LYS 63 -0.460 -0.298 11.530 441 HZ1 LYS 63 3HZ LYS 63 -2.560 -1.183 12.327 442 HZ2 LYS 63 1HZ LYS 63 -1.744 -0.378 13.495 443 HZ3 LYS 63 2HZ LYS 63 -1.789 -2.031 13.518 444 H VAL 64 H VAL 64 -1.287 -3.398 6.828 445 HA VAL 64 HA VAL 64 0.519 -5.400 7.878 446 HB VAL 64 HB VAL 64 -0.724 -6.707 6.363 447 HG11 VAL 64 1HG1 VAL 64 -0.710 -6.541 3.953 448 HG12 VAL 64 2HG1 VAL 64 -1.505 -5.141 4.675 449 HG13 VAL 64 3HG1 VAL 64 0.142 -4.996 4.025 450 HG21 VAL 64 3HG2 VAL 64 2.074 -6.246 5.265 451 HG22 VAL 64 1HG2 VAL 64 1.696 -7.135 6.756 452 HG23 VAL 64 2HG2 VAL 64 1.136 -7.741 5.204 453 H THR 65 H THR 65 2.156 -4.010 8.452 454 HA THR 65 HA THR 65 2.983 -1.834 6.771 455 HB THR 65 HB THR 65 4.476 -3.302 8.988 456 HG1 THR 65 1HG THR 65 2.842 -0.996 9.165 457 HG21 THR 65 3HG2 THR 65 5.970 -1.862 7.787 458 HG22 THR 65 1HG2 THR 65 5.499 -0.979 9.261 459 HG23 THR 65 2HG2 THR 65 4.784 -0.552 7.696 460 H LEU 66 H LEU 66 4.563 -1.772 5.161 461 HA LEU 66 HA LEU 66 5.935 -4.325 4.435 462 HB2 LEU 66 1HB LEU 66 4.158 -2.550 2.756 463 HB3 LEU 66 2HB LEU 66 5.410 -3.526 2.007 464 HG LEU 66 HG LEU 66 3.588 -4.965 3.936 465 HD11 LEU 66 1HD1 LEU 66 2.057 -3.560 2.795 466 HD12 LEU 66 2HD1 LEU 66 1.901 -5.217 2.143 467 HD13 LEU 66 3HD1 LEU 66 2.790 -3.971 1.199 468 HD21 LEU 66 3HD2 LEU 66 4.634 -5.733 1.176 469 HD22 LEU 66 1HD2 LEU 66 3.854 -6.793 2.366 470 HD23 LEU 66 2HD2 LEU 66 5.458 -6.118 2.704 471 H SER 67 H SER 67 7.864 -3.978 3.258 472 HA SER 67 HA SER 67 9.075 -1.311 3.356 473 HB2 SER 67 1HB SER 67 8.753 -1.913 5.766 474 HB3 SER 67 2HB SER 67 9.688 -3.387 5.509 475 HG SER 67 HG SER 67 10.872 -1.668 6.430 476 H THR 68 H THR 68 11.384 -1.422 2.858 477 HA THR 68 HA THR 68 11.929 -3.683 1.055 478 HB THR 68 HB THR 68 14.018 -2.184 0.636 479 HG1 THR 68 1HG THR 68 13.048 -0.656 2.459 480 HG21 THR 68 3HG2 THR 68 12.696 -1.016 -1.092 481 HG22 THR 68 1HG2 THR 68 11.200 -1.291 -0.181 482 HG23 THR 68 2HG2 THR 68 12.082 -2.650 -0.911 483 H THR 69 H THR 69 13.756 -4.937 1.058 484 HA THR 69 HA THR 69 14.848 -5.616 3.667 485 HB THR 69 HB THR 69 15.983 -7.432 2.333 486 HG1 THR 69 1HG THR 69 14.401 -6.410 0.201 487 HG21 THR 69 3HG2 THR 69 13.778 -7.872 3.327 488 HG22 THR 69 1HG2 THR 69 13.965 -8.711 1.778 489 HG23 THR 69 2HG2 THR 69 12.982 -7.239 1.868 490 H GLY 70 H GLY 70 15.861 -3.672 0.961 491 HA2 GLY 70 1HA GLY 70 18.492 -3.153 2.192 492 HA3 GLY 70 2HA GLY 70 18.390 -3.700 0.504 493 H LYS 71 H LYS 71 19.356 -1.539 -0.005 494 HA LYS 71 HA LYS 71 17.664 0.853 0.425 495 HB2 LYS 71 1HB LYS 71 20.279 0.751 0.324 496 HB3 LYS 71 2HB LYS 71 20.049 0.518 -1.416 497 HG2 LYS 71 1HG LYS 71 18.633 2.694 -1.349 498 HG3 LYS 71 2HG LYS 71 19.291 2.902 0.293 499 HD2 LYS 71 1HD LYS 71 20.806 4.070 -1.007 500 HD3 LYS 71 2HD LYS 71 21.575 2.497 -0.871 501 HE2 LYS 71 1HE LYS 71 20.237 1.964 -3.102 502 HE3 LYS 71 2HE LYS 71 20.052 3.731 -3.178 503 HZ1 LYS 71 3HZ LYS 71 22.022 3.160 -4.384 504 HZ2 LYS 71 1HZ LYS 71 22.499 2.084 -3.249 505 HZ3 LYS 71 2HZ LYS 71 22.626 3.655 -2.903 506 H ALA 72 H ALA 72 16.368 1.776 -1.171 507 HA ALA 72 HA ALA 72 16.470 0.611 -3.859 508 HB1 ALA 72 1HB ALA 72 14.381 -0.005 -2.110 509 HB2 ALA 72 2HB ALA 72 13.729 1.295 -3.123 510 HB3 ALA 72 3HB ALA 72 14.352 -0.200 -3.840 511 H ILE 73 H ILE 73 15.093 2.016 -5.298 512 HA ILE 73 HA ILE 73 15.952 4.837 -4.851 513 HB ILE 73 HB ILE 73 15.606 3.644 -7.567 514 HG12 ILE 73 1HG1 ILE 73 16.917 1.849 -6.655 515 HG13 ILE 73 2HG1 ILE 73 17.869 2.806 -7.732 516 HG21 ILE 73 1HG2 ILE 73 16.177 6.020 -7.268 517 HG22 ILE 73 2HG2 ILE 73 17.689 5.554 -6.489 518 HG23 ILE 73 3HG2 ILE 73 17.399 5.138 -8.187 519 HD11 ILE 73 3HD1 ILE 73 18.977 3.909 -5.741 520 HD12 ILE 73 1HD1 ILE 73 18.091 2.803 -4.695 521 HD13 ILE 73 2HD1 ILE 73 19.228 2.158 -5.864 522 H GLU 74 H GLU 74 13.098 2.926 -5.253 523 HA GLU 74 HA GLU 74 11.494 5.288 -5.696 524 HB2 GLU 74 1HB GLU 74 11.286 2.916 -7.617 525 HB3 GLU 74 2HB GLU 74 10.162 4.262 -7.532 526 HG2 GLU 74 1HG GLU 74 12.029 5.814 -8.095 527 HG3 GLU 74 2HG GLU 74 13.078 4.416 -8.345 528 H PHE 75 H PHE 75 9.143 4.731 -5.277 529 HA PHE 75 HA PHE 75 8.520 2.031 -4.422 530 HB2 PHE 75 1HB PHE 75 9.676 3.296 -2.453 531 HB3 PHE 75 2HB PHE 75 8.223 4.241 -2.336 532 HD1 PHE 75 1HD PHE 75 8.779 0.511 -2.928 533 HD2 PHE 75 2HD PHE 75 7.322 3.581 -0.239 534 HE1 PHE 75 1HE PHE 75 8.183 -1.196 -1.268 535 HE2 PHE 75 2HE PHE 75 6.809 1.858 1.406 536 HZ PHE 75 HZ PHE 75 7.198 -0.550 0.915 537 H ALA 76 H ALA 76 7.050 2.224 -6.184 538 HA ALA 76 HA ALA 76 5.079 4.405 -6.142 539 HB1 ALA 76 1HB ALA 76 5.898 3.585 -8.306 540 HB2 ALA 76 2HB ALA 76 5.275 1.953 -7.943 541 HB3 ALA 76 3HB ALA 76 4.153 3.317 -8.152 542 H VAL 77 H VAL 77 2.853 4.230 -5.748 543 HA VAL 77 HA VAL 77 1.750 1.612 -5.003 544 HB VAL 77 HB VAL 77 1.280 4.109 -3.320 545 HG11 VAL 77 1HG1 VAL 77 0.479 1.185 -2.917 546 HG12 VAL 77 2HG1 VAL 77 0.110 2.540 -1.830 547 HG13 VAL 77 3HG1 VAL 77 -0.610 2.488 -3.439 548 HG21 VAL 77 3HG2 VAL 77 2.980 1.662 -2.693 549 HG22 VAL 77 1HG2 VAL 77 3.526 3.349 -2.839 550 HG23 VAL 77 2HG2 VAL 77 2.441 2.879 -1.509 551 H SER 78 H SER 78 -0.058 1.323 -6.128 552 HA SER 78 HA SER 78 -2.013 3.419 -6.232 553 HB2 SER 78 1HB SER 78 -2.605 2.538 -8.677 554 HB3 SER 78 2HB SER 78 -1.568 3.940 -8.373 555 HG SER 78 HG SER 78 0.212 2.480 -8.466 556 H GLY 79 H GLY 79 -4.195 2.294 -6.752 557 HA2 GLY 79 1HA GLY 79 -4.381 -0.536 -6.770 558 HA3 GLY 79 2HA GLY 79 -4.616 0.034 -5.106 559 H GLY 80 H GLY 80 -6.776 0.157 -4.672 560 HA2 GLY 80 1HA GLY 80 -8.498 1.979 -5.183 561 HA3 GLY 80 2HA GLY 80 -8.638 1.174 -6.751 562 H VAL 81 H VAL 81 -10.943 1.270 -5.532 563 HA VAL 81 HA VAL 81 -11.539 -1.449 -4.836 564 HB VAL 81 HB VAL 81 -13.052 -0.687 -2.900 565 HG11 VAL 81 1HG1 VAL 81 -10.085 -0.742 -2.266 566 HG12 VAL 81 2HG1 VAL 81 -11.429 -1.231 -1.222 567 HG13 VAL 81 3HG1 VAL 81 -11.052 -2.180 -2.670 568 HG21 VAL 81 3HG2 VAL 81 -12.307 1.075 -1.462 569 HG22 VAL 81 1HG2 VAL 81 -11.002 1.518 -2.597 570 HG23 VAL 81 2HG2 VAL 81 -12.705 1.751 -3.046 571 H VAL 82 H VAL 82 -13.299 -1.952 -5.939 572 HA VAL 82 HA VAL 82 -15.545 -0.050 -5.925 573 HB VAL 82 HB VAL 82 -16.334 -1.402 -8.034 574 HG11 VAL 82 1HG1 VAL 82 -15.483 0.387 -9.462 575 HG12 VAL 82 2HG1 VAL 82 -16.109 0.941 -7.895 576 HG13 VAL 82 3HG1 VAL 82 -14.340 0.864 -8.166 577 HG21 VAL 82 3HG2 VAL 82 -13.339 -1.588 -8.516 578 HG22 VAL 82 1HG2 VAL 82 -14.414 -2.960 -8.134 579 HG23 VAL 82 2HG2 VAL 82 -14.638 -2.025 -9.636 580 H ASP 83 H ASP 83 -17.588 -1.094 -5.882 581 HA ASP 83 HA ASP 83 -17.719 -3.426 -4.176 582 HB2 ASP 83 1HB ASP 83 -19.273 -1.581 -4.042 583 HB3 ASP 83 2HB ASP 83 -19.665 -1.687 -5.736 584 H GLY 84 H GLY 84 -18.655 -5.405 -4.808 585 HA2 GLY 84 1HA GLY 84 -18.452 -6.170 -7.687 586 HA3 GLY 84 2HA GLY 84 -17.962 -7.207 -6.350 587 H GLU 85 H GLU 85 -20.956 -5.173 -6.102 588 HA GLU 85 HA GLU 85 -22.608 -7.462 -6.900 589 HB2 GLU 85 1HB GLU 85 -22.960 -5.812 -4.359 590 HB3 GLU 85 2HB GLU 85 -24.185 -6.873 -5.056 591 HG2 GLU 85 1HG GLU 85 -22.152 -8.656 -4.911 592 HG3 GLU 85 2HG GLU 85 -21.713 -7.599 -3.564 593 H ASP 86 H ASP 86 -25.039 -6.023 -6.487 594 HA ASP 86 HA ASP 86 -24.822 -3.428 -7.756 595 HB2 ASP 86 1HB ASP 86 -26.319 -5.759 -9.025 596 HB3 ASP 86 2HB ASP 86 -26.842 -4.084 -9.229 597 H GLY 87 H GLY 87 -25.826 -2.352 -6.086 598 HA2 GLY 87 1HA GLY 87 -27.721 -1.627 -4.967 599 HA3 GLY 87 2HA GLY 87 -28.589 -3.083 -5.467 600 H VAL 88 H VAL 88 -25.483 -3.554 -3.922 601 HA VAL 88 HA VAL 88 -26.582 -4.810 -1.612 602 HB VAL 88 HB VAL 88 -24.443 -5.415 -2.526 603 HG11 VAL 88 1HG1 VAL 88 -23.505 -2.651 -1.692 604 HG12 VAL 88 2HG1 VAL 88 -22.445 -3.974 -2.206 605 HG13 VAL 88 3HG1 VAL 88 -23.603 -3.290 -3.349 606 HG21 VAL 88 3HG2 VAL 88 -23.225 -5.678 -0.517 607 HG22 VAL 88 1HG2 VAL 88 -23.962 -4.264 0.243 608 HG23 VAL 88 2HG2 VAL 88 -24.915 -5.741 -0.078 609 H VAL 89 H VAL 89 -26.361 -4.058 0.571 610 HA VAL 89 HA VAL 89 -26.255 -1.118 0.949 611 HB VAL 89 HB VAL 89 -28.235 -2.985 2.335 612 HG11 VAL 89 1HG1 VAL 89 -27.882 0.050 2.462 613 HG12 VAL 89 2HG1 VAL 89 -29.150 -0.901 3.294 614 HG13 VAL 89 3HG1 VAL 89 -27.452 -1.095 3.744 615 HG21 VAL 89 3HG2 VAL 89 -29.993 -1.688 1.145 616 HG22 VAL 89 1HG2 VAL 89 -28.721 -0.857 0.196 617 HG23 VAL 89 2HG2 VAL 89 -28.981 -2.600 0.030 618 H ASN 90 H ASN 90 -24.074 -1.383 1.411 619 HA ASN 90 HA ASN 90 -23.470 -2.694 4.002 620 HB2 ASN 90 1HB ASN 90 -22.314 -3.438 1.723 621 HB3 ASN 90 2HB ASN 90 -21.263 -2.076 2.078 622 HD21 ASN 90 1HD2 ASN 90 -21.034 -5.131 2.258 623 HD22 ASN 90 2HD2 ASN 90 -20.391 -5.460 3.862 624 H GLU 91 H GLU 91 -20.857 -1.099 4.003 625 HA GLU 91 HA GLU 91 -21.877 1.649 4.327 626 HB2 GLU 91 1HB GLU 91 -20.597 -0.108 6.454 627 HB3 GLU 91 2HB GLU 91 -20.206 1.598 6.437 628 HG2 GLU 91 1HG GLU 91 -22.902 1.825 6.134 629 HG3 GLU 91 2HG GLU 91 -22.831 0.292 6.986 630 HA PRO 92 HA PRO 92 -18.107 2.663 2.452 631 HB2 PRO 92 1HB PRO 92 -17.456 5.123 3.466 632 HB3 PRO 92 2HB PRO 92 -18.942 4.880 2.509 633 HG2 PRO 92 1HG PRO 92 -18.682 4.850 5.532 634 HG3 PRO 92 2HG PRO 92 -19.790 5.853 4.534 635 HD2 PRO 92 1HD PRO 92 -20.621 3.514 5.571 636 HD3 PRO 92 2HD PRO 92 -21.077 3.953 3.903 637 H MET 93 H MET 93 -15.736 3.450 2.942 638 HA MET 93 HA MET 93 -14.760 2.474 5.553 639 HB2 MET 93 1HB MET 93 -13.019 1.198 4.505 640 HB3 MET 93 2HB MET 93 -14.562 0.496 4.088 641 HG2 MET 93 1HG MET 93 -14.039 0.651 1.910 642 HG3 MET 93 2HG MET 93 -13.795 2.393 2.036 643 HE1 MET 93 3HE MET 93 -10.595 -0.867 2.675 644 HE2 MET 93 1HE MET 93 -11.771 -0.459 3.927 645 HE3 MET 93 2HE MET 93 -12.324 -1.125 2.370 646 H GLN 94 H GLN 94 -12.364 2.921 5.709 647 HA GLN 94 HA GLN 94 -11.382 5.119 4.071 648 HB2 GLN 94 1HB GLN 94 -11.651 5.209 7.095 649 HB3 GLN 94 2HB GLN 94 -10.446 6.164 6.211 650 HG2 GLN 94 1HG GLN 94 -12.205 7.236 4.864 651 HG3 GLN 94 2HG GLN 94 -13.452 6.338 5.739 652 HE21 GLN 94 1HE2 GLN 94 -13.938 6.932 7.882 653 HE22 GLN 94 2HE2 GLN 94 -13.306 8.400 8.638 654 H TRP 95 H TRP 95 -9.111 5.188 4.155 655 HA TRP 95 HA TRP 95 -7.678 2.923 5.464 656 HB2 TRP 95 1HB TRP 95 -7.201 4.247 2.761 657 HB3 TRP 95 2HB TRP 95 -5.971 3.382 3.636 658 HD1 TRP 95 HD TRP 95 -8.936 1.274 3.982 659 HE1 TRP 95 1HE TRP 95 -8.759 -0.686 2.259 660 HE3 TRP 95 3HE TRP 95 -5.122 3.046 1.096 661 HZ2 TRP 95 2HZ TRP 95 -7.090 -1.391 0.076 662 HZ3 TRP 95 3HZ TRP 95 -4.221 1.691 -0.768 663 HH2 TRP 95 HH TRP 95 -5.156 -0.500 -1.285 664 H VAL 96 H VAL 96 -6.103 3.683 6.737 665 HA VAL 96 HA VAL 96 -4.996 6.400 6.170 666 HB VAL 96 HB VAL 96 -4.151 4.619 8.486 667 HG11 VAL 96 1HG1 VAL 96 -3.876 7.616 7.927 668 HG12 VAL 96 2HG1 VAL 96 -3.227 6.741 9.335 669 HG13 VAL 96 3HG1 VAL 96 -2.587 6.411 7.715 670 HG21 VAL 96 3HG2 VAL 96 -5.489 6.147 9.942 671 HG22 VAL 96 1HG2 VAL 96 -6.271 6.817 8.479 672 HG23 VAL 96 2HG2 VAL 96 -6.483 5.110 8.935 673 H VAL 97 H VAL 97 -3.049 6.371 4.954 674 HA VAL 97 HA VAL 97 -1.483 3.934 4.886 675 HB VAL 97 HB VAL 97 -1.155 4.547 2.429 676 HG11 VAL 97 1HG1 VAL 97 -2.879 3.081 1.637 677 HG12 VAL 97 2HG1 VAL 97 -2.194 2.495 3.160 678 HG13 VAL 97 3HG1 VAL 97 -3.786 3.289 3.165 679 HG21 VAL 97 3HG2 VAL 97 -2.998 5.532 1.165 680 HG22 VAL 97 1HG2 VAL 97 -3.938 5.781 2.650 681 HG23 VAL 97 2HG2 VAL 97 -2.441 6.701 2.369 682 H THR 98 H THR 98 0.651 4.544 5.257 683 HA THR 98 HA THR 98 1.335 7.425 4.872 684 HB THR 98 HB THR 98 2.134 5.794 7.286 685 HG1 THR 98 1HG THR 98 0.114 6.016 7.894 686 HG21 THR 98 3HG2 THR 98 1.959 8.803 6.842 687 HG22 THR 98 1HG2 THR 98 3.462 7.843 6.848 688 HG23 THR 98 2HG2 THR 98 2.493 7.982 8.317 689 H VAL 99 H VAL 99 3.580 7.773 4.423 690 HA VAL 99 HA VAL 99 5.079 5.284 3.784 691 HB VAL 99 HB VAL 99 5.340 7.833 2.173 692 HG11 VAL 99 1HG1 VAL 99 6.200 4.939 1.701 693 HG12 VAL 99 2HG1 VAL 99 6.439 6.283 0.568 694 HG13 VAL 99 3HG1 VAL 99 7.271 6.291 2.125 695 HG21 VAL 99 3HG2 VAL 99 3.658 5.368 1.534 696 HG22 VAL 99 1HG2 VAL 99 3.054 7.031 1.755 697 HG23 VAL 99 2HG2 VAL 99 4.083 6.638 0.373 698 H TYR 100 H TYR 100 6.944 5.113 4.613 699 HA TYR 100 HA TYR 100 8.328 7.328 5.967 700 HB2 TYR 100 1HB TYR 100 8.208 4.361 6.680 701 HB3 TYR 100 2HB TYR 100 9.223 5.541 7.484 702 HD1 TYR 100 1HD TYR 100 5.702 4.438 6.940 703 HD2 TYR 100 2HD TYR 100 8.340 6.987 9.210 704 HE1 TYR 100 1HE TYR 100 3.824 5.050 8.445 705 HE2 TYR 100 2HE TYR 100 6.456 7.633 10.681 706 HH TYR 100 HH TYR 100 3.870 7.853 10.288 707 H LYS 101 H LYS 101 10.649 6.863 6.043 708 HA LYS 101 HA LYS 101 11.725 5.906 3.490 709 HB2 LYS 101 1HB LYS 101 11.433 8.353 3.981 710 HB3 LYS 101 2HB LYS 101 12.630 8.218 5.269 711 HG2 LYS 101 1HG LYS 101 14.388 7.867 3.698 712 HG3 LYS 101 2HG LYS 101 13.251 7.284 2.478 713 HD2 LYS 101 1HD LYS 101 12.500 9.408 1.932 714 HD3 LYS 101 2HD LYS 101 13.129 10.158 3.428 715 HE2 LYS 101 1HE LYS 101 15.379 10.071 2.643 716 HE3 LYS 101 2HE LYS 101 14.950 8.956 1.325 717 HZ1 LYS 101 3HZ LYS 101 14.093 11.776 1.492 718 HZ2 LYS 101 1HZ LYS 101 13.693 10.667 0.298 719 HZ3 LYS 101 2HZ LYS 101 15.246 11.135 0.493 720 H ASN 102 H ASN 102 14.433 6.473 4.682 721 HA ASN 102 HA ASN 102 14.869 4.031 6.285 722 HB2 ASN 102 1HB ASN 102 17.169 4.555 6.412 723 HB3 ASN 102 2HB ASN 102 16.648 4.472 4.744 724 HD21 ASN 102 1HD2 ASN 102 16.274 6.621 3.618 725 HD22 ASN 102 2HD2 ASN 102 17.376 7.898 4.002 726 H GLY 103 H GLY 103 13.399 4.581 7.897 727 HA2 GLY 103 1HA GLY 103 13.222 4.910 10.125 728 HA3 GLY 103 2HA GLY 103 14.758 5.768 10.106 729 H LYS 104 H LYS 104 12.229 7.177 8.036 730 HA LYS 104 HA LYS 104 11.075 8.679 10.206 731 HB2 LYS 104 1HB LYS 104 11.745 10.845 9.638 732 HB3 LYS 104 2HB LYS 104 13.177 9.836 9.727 733 HG2 LYS 104 1HG LYS 104 13.758 10.690 7.899 734 HG3 LYS 104 2HG LYS 104 12.655 9.657 7.038 735 HD2 LYS 104 1HD LYS 104 11.252 11.393 6.503 736 HD3 LYS 104 2HD LYS 104 11.493 12.247 8.024 737 HE2 LYS 104 1HE LYS 104 13.406 12.236 5.658 738 HE3 LYS 104 2HE LYS 104 12.338 13.553 6.178 739 HZ1 LYS 104 3HZ LYS 104 14.684 12.511 7.625 740 HZ2 LYS 104 1HZ LYS 104 13.585 13.526 8.318 741 HZ3 LYS 104 2HZ LYS 104 14.488 14.004 7.032 742 H GLU 105 H GLU 105 9.512 10.318 9.281 743 HA GLU 105 HA GLU 105 7.745 8.834 7.351 744 HB2 GLU 105 1HB GLU 105 7.022 9.669 9.704 745 HB3 GLU 105 2HB GLU 105 7.012 11.280 8.989 746 HG2 GLU 105 1HG GLU 105 5.417 10.421 7.229 747 HG3 GLU 105 2HG GLU 105 5.402 8.858 8.032 748 H ILE 106 H ILE 106 7.099 9.715 5.339 749 HA ILE 106 HA ILE 106 8.151 12.433 4.684 750 HB ILE 106 HB ILE 106 8.659 11.553 2.412 751 HG12 ILE 106 1HG1 ILE 106 8.451 8.778 3.655 752 HG13 ILE 106 2HG1 ILE 106 7.256 9.478 2.554 753 HG21 ILE 106 1HG2 ILE 106 10.356 11.972 4.183 754 HG22 ILE 106 2HG2 ILE 106 10.274 10.254 4.631 755 HG23 ILE 106 3HG2 ILE 106 10.835 10.749 3.012 756 HD11 ILE 106 3HD1 ILE 106 9.073 9.725 0.830 757 HD12 ILE 106 1HD1 ILE 106 10.140 8.798 1.913 758 HD13 ILE 106 2HD1 ILE 106 8.667 8.058 1.274 759 H GLU 107 H GLU 107 5.403 10.291 4.585 760 HA GLU 107 HA GLU 107 3.958 12.393 3.049 761 HB2 GLU 107 1HB GLU 107 4.486 10.518 1.501 762 HB3 GLU 107 2HB GLU 107 3.727 9.393 2.608 763 HG2 GLU 107 1HG GLU 107 2.339 9.906 0.652 764 HG3 GLU 107 2HG GLU 107 1.543 10.277 2.163 765 H LYS 108 H LYS 108 1.652 12.350 3.547 766 HA LYS 108 HA LYS 108 0.621 10.732 5.742 767 HB2 LYS 108 1HB LYS 108 1.801 12.409 7.053 768 HB3 LYS 108 2HB LYS 108 1.167 13.708 6.048 769 HG2 LYS 108 1HG LYS 108 -1.120 12.309 7.066 770 HG3 LYS 108 2HG LYS 108 0.014 12.411 8.412 771 HD2 LYS 108 1HD LYS 108 -0.880 14.754 6.681 772 HD3 LYS 108 2HD LYS 108 -1.580 14.351 8.253 773 HE2 LYS 108 1HE LYS 108 0.249 15.064 9.451 774 HE3 LYS 108 2HE LYS 108 1.408 14.650 8.176 775 HZ1 LYS 108 3HZ LYS 108 1.015 16.590 7.064 776 HZ2 LYS 108 1HZ LYS 108 0.952 17.074 8.614 777 HZ3 LYS 108 2HZ LYS 108 -0.465 16.870 7.784 778 H LYS 109 H LYS 109 -0.825 10.102 4.067 779 HA LYS 109 HA LYS 109 -2.911 12.105 3.510 780 HB2 LYS 109 1HB LYS 109 -3.261 11.370 1.258 781 HB3 LYS 109 2HB LYS 109 -1.685 12.108 1.420 782 HG2 LYS 109 1HG LYS 109 -0.593 10.258 0.700 783 HG3 LYS 109 2HG LYS 109 -1.518 9.200 1.753 784 HD2 LYS 109 1HD LYS 109 -2.002 8.418 -0.364 785 HD3 LYS 109 2HD LYS 109 -3.432 9.331 0.070 786 HE2 LYS 109 1HE LYS 109 -1.230 10.097 -1.913 787 HE3 LYS 109 2HE LYS 109 -2.909 9.670 -2.256 788 HZ1 LYS 109 3HZ LYS 109 -1.871 12.160 -1.138 789 HZ2 LYS 109 1HZ LYS 109 -3.476 11.704 -0.912 790 HZ3 LYS 109 2HZ LYS 109 -2.906 11.919 -2.406 791 H SER 110 H SER 110 -5.023 11.011 3.019 792 HA SER 110 HA SER 110 -5.159 8.238 4.029 793 HB2 SER 110 1HB SER 110 -5.437 10.040 5.821 794 HB3 SER 110 2HB SER 110 -6.913 10.541 4.987 795 HG SER 110 HG SER 110 -7.886 8.831 5.729 796 H LEU 111 H LEU 111 -7.402 7.373 3.499 797 HA LEU 111 HA LEU 111 -8.425 8.546 0.953 798 HB2 LEU 111 1HB LEU 111 -8.210 5.588 1.423 799 HB3 LEU 111 2HB LEU 111 -8.611 6.425 -0.058 800 HG LEU 111 HG LEU 111 -5.860 6.391 1.257 801 HD11 LEU 111 1HD1 LEU 111 -5.201 4.827 -0.302 802 HD12 LEU 111 2HD1 LEU 111 -6.536 5.145 -1.404 803 HD13 LEU 111 3HD1 LEU 111 -6.837 4.266 0.107 804 HD21 LEU 111 3HD2 LEU 111 -6.837 7.566 -1.376 805 HD22 LEU 111 1HD2 LEU 111 -5.124 7.302 -0.995 806 HD23 LEU 111 2HD2 LEU 111 -6.059 8.448 -0.047 807 H VAL 112 H VAL 112 -10.572 7.917 0.441 808 HA VAL 112 HA VAL 112 -12.293 7.019 2.636 809 HB VAL 112 HB VAL 112 -11.897 9.395 3.039 810 HG11 VAL 112 1HG1 VAL 112 -11.298 10.158 0.741 811 HG12 VAL 112 2HG1 VAL 112 -13.025 10.101 0.312 812 HG13 VAL 112 3HG1 VAL 112 -12.452 11.188 1.579 813 HG21 VAL 112 3HG2 VAL 112 -14.693 8.843 1.983 814 HG22 VAL 112 1HG2 VAL 112 -14.071 8.665 3.644 815 HG23 VAL 112 2HG2 VAL 112 -14.237 10.267 2.938 816 H PHE 113 H PHE 113 -13.533 5.498 1.627 817 HA PHE 113 HA PHE 113 -14.376 5.999 -1.194 818 HB2 PHE 113 1HB PHE 113 -13.606 3.312 -0.026 819 HB3 PHE 113 2HB PHE 113 -14.149 3.621 -1.664 820 HD1 PHE 113 2HD PHE 113 -12.588 5.878 -2.660 821 HD2 PHE 113 1HD PHE 113 -11.365 2.686 -0.038 822 HE1 PHE 113 2HE PHE 113 -10.241 6.225 -3.316 823 HE2 PHE 113 1HE PHE 113 -9.004 3.076 -0.639 824 HZ PHE 113 HZ PHE 113 -8.445 4.843 -2.328 825 H ARG 114 H ARG 114 -16.357 4.437 -1.670 826 HA ARG 114 HA ARG 114 -17.924 4.023 0.744 827 HB2 ARG 114 1HB ARG 114 -19.146 5.506 -1.605 828 HB3 ARG 114 2HB ARG 114 -19.924 5.078 -0.089 829 HG2 ARG 114 1HG ARG 114 -18.178 6.620 1.062 830 HG3 ARG 114 2HG ARG 114 -17.770 7.171 -0.570 831 HD2 ARG 114 1HD ARG 114 -19.319 8.733 0.363 832 HD3 ARG 114 2HD ARG 114 -20.185 7.827 -0.874 833 HE ARG 114 HE ARG 114 -21.422 6.682 0.707 834 HH11 ARG 114 1HH1 ARG 114 -19.504 9.265 2.193 835 HH12 ARG 114 2HH1 ARG 114 -20.550 9.384 3.559 836 HH21 ARG 114 1HH2 ARG 114 -22.357 6.414 2.806 837 HH22 ARG 114 2HH2 ARG 114 -21.997 7.543 4.075 838 H ASP 115 H ASP 115 -19.782 2.758 0.371 839 HA ASP 115 HA ASP 115 -19.308 0.367 -1.126 840 HB2 ASP 115 1HB ASP 115 -20.361 0.483 1.092 841 HB3 ASP 115 2HB ASP 115 -21.658 1.486 0.446 842 H GLY 116 H GLY 116 -20.868 -0.591 -2.576 843 HA2 GLY 116 1HA GLY 116 -21.981 -0.674 -4.550 844 HA3 GLY 116 2HA GLY 116 -22.733 0.854 -4.108 845 H LYS 117 H LYS 117 -21.076 2.767 -4.423 846 HA LYS 117 HA LYS 117 -20.111 2.605 -7.176 847 HB2 LYS 117 1HB LYS 117 -22.974 2.783 -6.587 848 HB3 LYS 117 2HB LYS 117 -22.534 4.144 -7.582 849 HG2 LYS 117 1HG LYS 117 -22.001 1.233 -8.165 850 HG3 LYS 117 2HG LYS 117 -23.171 2.261 -8.979 851 HD2 LYS 117 1HD LYS 117 -21.577 3.288 -10.306 852 HD3 LYS 117 2HD LYS 117 -20.321 3.236 -9.060 853 HE2 LYS 117 1HE LYS 117 -19.827 1.729 -10.994 854 HE3 LYS 117 2HE LYS 117 -19.889 0.918 -9.435 855 HZ1 LYS 117 3HZ LYS 117 -22.137 0.178 -9.970 856 HZ2 LYS 117 1HZ LYS 117 -21.047 -0.404 -10.996 857 HZ3 LYS 117 2HZ LYS 117 -22.040 0.835 -11.473 858 H GLU 118 H GLU 118 -18.898 4.052 -5.187 859 HA GLU 118 HA GLU 118 -18.878 6.754 -6.367 860 HB2 GLU 118 1HB GLU 118 -19.604 6.486 -3.435 861 HB3 GLU 118 2HB GLU 118 -19.200 7.980 -4.257 862 HG2 GLU 118 1HG GLU 118 -21.198 7.710 -5.711 863 HG3 GLU 118 2HG GLU 118 -21.630 6.237 -4.809 864 H ILE 119 H ILE 119 -16.806 6.188 -6.996 865 HA ILE 119 HA ILE 119 -14.680 6.968 -5.125 866 HB ILE 119 HB ILE 119 -13.262 5.194 -5.581 867 HG12 ILE 119 1HG1 ILE 119 -15.051 3.142 -6.589 868 HG13 ILE 119 2HG1 ILE 119 -15.142 4.514 -7.695 869 HG21 ILE 119 1HG2 ILE 119 -14.144 3.455 -4.219 870 HG22 ILE 119 2HG2 ILE 119 -14.672 5.029 -3.581 871 HG23 ILE 119 3HG2 ILE 119 -15.810 3.997 -4.473 872 HD11 ILE 119 3HD1 ILE 119 -12.571 3.316 -6.664 873 HD12 ILE 119 1HD1 ILE 119 -13.272 2.995 -8.276 874 HD13 ILE 119 2HD1 ILE 119 -12.723 4.645 -7.832 875 H SER 120 H SER 120 -12.511 6.801 -6.687 876 HA SER 120 HA SER 120 -13.118 7.325 -9.447 877 HB2 SER 120 1HB SER 120 -13.458 9.587 -8.352 878 HB3 SER 120 2HB SER 120 -11.745 9.574 -7.899 879 HG SER 120 HG SER 120 -11.251 10.062 -9.900 880 H THR 121 H THR 121 -11.269 7.100 -10.748 881 HA THR 121 HA THR 121 -9.266 5.323 -9.844 882 HB THR 121 HB THR 121 -8.610 5.657 -12.352 883 HG1 THR 121 1HG THR 121 -11.065 6.500 -12.991 884 HG21 THR 121 3HG2 THR 121 -9.833 3.717 -11.811 885 HG22 THR 121 1HG2 THR 121 -10.700 4.461 -13.145 886 HG23 THR 121 2HG2 THR 121 -11.307 4.634 -11.482 887 H ASP 122 H ASP 122 -8.951 7.834 -8.533 888 HA ASP 122 HA ASP 122 -6.066 7.926 -8.933 889 HB2 ASP 122 1HB ASP 122 -6.839 10.115 -9.919 890 HB3 ASP 122 2HB ASP 122 -7.498 10.540 -8.328 891 H ASP 123 H ASP 123 -7.203 6.172 -7.491 892 HA ASP 123 HA ASP 123 -8.131 6.938 -4.884 893 HB2 ASP 123 1HB ASP 123 -6.971 4.262 -5.002 894 HB3 ASP 123 2HB ASP 123 -8.585 4.769 -4.614 895 H LEU 124 H LEU 124 -5.055 5.500 -6.119 896 HA LEU 124 HA LEU 124 -3.584 7.094 -4.127 897 HB2 LEU 124 1HB LEU 124 -3.762 4.164 -4.254 898 HB3 LEU 124 2HB LEU 124 -2.102 4.702 -4.469 899 HG LEU 124 HG LEU 124 -3.802 5.876 -2.236 900 HD11 LEU 124 1HD1 LEU 124 -3.955 3.504 -1.889 901 HD12 LEU 124 2HD1 LEU 124 -2.842 4.194 -0.694 902 HD13 LEU 124 3HD1 LEU 124 -2.198 3.299 -2.081 903 HD21 LEU 124 3HD2 LEU 124 -0.820 5.413 -2.661 904 HD22 LEU 124 1HD2 LEU 124 -1.551 6.126 -1.196 905 HD23 LEU 124 2HD2 LEU 124 -1.685 6.976 -2.760 906 H ASN 125 H ASN 125 -1.660 7.853 -4.799 907 HA ASN 125 HA ASN 125 -1.060 7.888 -7.668 908 HB2 ASN 125 1HB ASN 125 -1.520 10.363 -7.559 909 HB3 ASN 125 2HB ASN 125 -2.930 9.350 -7.359 910 HD21 ASN 125 1HD2 ASN 125 -4.205 10.220 -5.976 911 HD22 ASN 125 2HD2 ASN 125 -3.869 10.979 -4.436 912 H LEU 126 H LEU 126 0.364 7.068 -5.392 913 HA LEU 126 HA LEU 126 2.483 9.142 -4.901 914 HB2 LEU 126 1HB LEU 126 1.975 6.523 -3.427 915 HB3 LEU 126 2HB LEU 126 3.215 7.714 -3.041 916 HG LEU 126 HG LEU 126 0.206 8.190 -2.853 917 HD11 LEU 126 1HD1 LEU 126 1.094 6.590 -1.177 918 HD12 LEU 126 2HD1 LEU 126 0.577 8.111 -0.420 919 HD13 LEU 126 3HD1 LEU 126 2.305 7.788 -0.691 920 HD21 LEU 126 3HD2 LEU 126 2.538 9.944 -2.027 921 HD22 LEU 126 1HD2 LEU 126 0.845 10.248 -1.597 922 HD23 LEU 126 2HD2 LEU 126 1.344 10.309 -3.294 923 H TYR 127 H TYR 127 4.385 8.876 -5.941 924 HA TYR 127 HA TYR 127 5.048 6.252 -7.193 925 HB2 TYR 127 1HB TYR 127 4.913 8.829 -8.757 926 HB3 TYR 127 2HB TYR 127 5.339 7.242 -9.365 927 HD1 TYR 127 2HD TYR 127 3.538 5.393 -9.318 928 HD2 TYR 127 1HD TYR 127 2.646 9.559 -8.709 929 HE1 TYR 127 2HE TYR 127 1.150 4.997 -10.011 930 HE2 TYR 127 1HE TYR 127 0.335 9.201 -9.474 931 HH TYR 127 HH TYR 127 -1.039 7.676 -10.645 932 H TYR 128 H TYR 128 6.244 7.092 -5.015 933 HA TYR 128 HA TYR 128 8.071 9.208 -5.134 934 HB2 TYR 128 1HB TYR 128 7.770 6.761 -3.403 935 HB3 TYR 128 2HB TYR 128 9.299 7.592 -3.346 936 HD1 TYR 128 2HD TYR 128 8.937 10.379 -3.363 937 HD2 TYR 128 1HD TYR 128 6.461 7.349 -1.524 938 HE1 TYR 128 2HE TYR 128 8.065 12.054 -1.798 939 HE2 TYR 128 1HE TYR 128 5.569 9.046 0.039 940 HH TYR 128 HH TYR 128 6.366 12.502 -0.232 941 H ASN 129 H ASN 129 10.118 9.491 -5.715 942 HA ASN 129 HA ASN 129 11.815 7.216 -6.384 943 HB2 ASN 129 1HB ASN 129 12.685 8.020 -8.380 944 HB3 ASN 129 2HB ASN 129 10.944 8.061 -8.600 945 HD21 ASN 129 1HD2 ASN 129 10.008 10.386 -7.877 946 HD22 ASN 129 2HD2 ASN 129 10.876 11.724 -8.595 Start of MODEL 14 1 H1 GLY 1 H GLY 1 22.459 -8.917 11.798 2 HA2 GLY 1 1HA GLY 1 24.019 -10.054 10.260 3 HA3 GLY 1 2HA GLY 1 23.656 -11.055 11.688 4 H ASP 2 H ASP 2 23.504 -10.853 8.263 5 HA ASP 2 HA ASP 2 21.549 -13.063 7.921 6 HB2 ASP 2 1HB ASP 2 21.183 -10.259 6.803 7 HB3 ASP 2 2HB ASP 2 20.200 -11.661 6.432 8 H ASP 3 H ASP 3 23.148 -10.426 6.132 9 HA ASP 3 HA ASP 3 24.731 -12.010 4.359 10 HB2 ASP 3 1HB ASP 3 23.378 -11.491 2.427 11 HB3 ASP 3 2HB ASP 3 22.331 -12.299 3.615 12 H ASP 4 H ASP 4 25.796 -10.374 2.977 13 HA ASP 4 HA ASP 4 25.712 -7.593 4.008 14 HB2 ASP 4 1HB ASP 4 27.835 -9.574 4.655 15 HB3 ASP 4 2HB ASP 4 28.427 -8.041 4.011 16 H GLU 5 H GLU 5 25.057 -6.804 2.101 17 HA GLU 5 HA GLU 5 27.041 -6.637 -0.061 18 HB2 GLU 5 1HB GLU 5 25.454 -7.297 -1.777 19 HB3 GLU 5 2HB GLU 5 25.838 -8.630 -0.715 20 HG2 GLU 5 1HG GLU 5 23.700 -8.853 0.075 21 HG3 GLU 5 2HG GLU 5 23.395 -7.123 0.084 22 HA PRO 6 HA PRO 6 24.414 -2.874 0.926 23 HB2 PRO 6 1HB PRO 6 26.341 -1.119 1.741 24 HB3 PRO 6 2HB PRO 6 25.438 -2.260 2.764 25 HG2 PRO 6 1HG PRO 6 28.194 -2.625 1.535 26 HG3 PRO 6 2HG PRO 6 27.734 -2.886 3.249 27 HD2 PRO 6 1HD PRO 6 27.877 -4.937 1.456 28 HD3 PRO 6 2HD PRO 6 26.616 -4.891 2.723 29 H GLY 7 H GLY 7 23.868 -2.276 -0.994 30 HA2 GLY 7 1HA GLY 7 25.657 -2.605 -3.042 31 HA3 GLY 7 2HA GLY 7 23.983 -2.032 -3.213 32 H GLY 8 H GLY 8 24.322 0.486 -1.778 33 HA2 GLY 8 1HA GLY 8 26.348 2.166 -2.673 34 HA3 GLY 8 2HA GLY 8 25.120 2.136 -3.959 35 H LYS 9 H LYS 9 24.609 4.456 -3.403 36 HA LYS 9 HA LYS 9 23.223 4.797 -0.856 37 HB2 LYS 9 1HB LYS 9 23.599 7.134 -1.019 38 HB3 LYS 9 2HB LYS 9 25.091 6.242 -0.851 39 HG2 LYS 9 1HG LYS 9 24.079 7.431 -3.476 40 HG3 LYS 9 2HG LYS 9 25.087 8.295 -2.350 41 HD2 LYS 9 1HD LYS 9 25.959 5.752 -3.784 42 HD3 LYS 9 2HD LYS 9 26.369 7.409 -4.235 43 HE2 LYS 9 1HE LYS 9 27.334 7.727 -1.918 44 HE3 LYS 9 2HE LYS 9 27.101 5.997 -1.634 45 HZ1 LYS 9 3HZ LYS 9 28.767 7.138 -3.790 46 HZ2 LYS 9 1HZ LYS 9 28.620 5.541 -3.422 47 HZ3 LYS 9 2HZ LYS 9 29.332 6.550 -2.357 48 H GLY 10 H GLY 10 21.258 5.103 -0.969 49 HA2 GLY 10 1HA GLY 10 19.914 6.862 -2.830 50 HA3 GLY 10 2HA GLY 10 19.296 5.205 -2.954 51 H ALA 11 H ALA 11 17.513 4.934 -1.705 52 HA ALA 11 HA ALA 11 17.501 6.052 1.056 53 HB1 ALA 11 1HB ALA 11 16.223 7.631 -0.352 54 HB2 ALA 11 2HB ALA 11 15.198 6.288 -0.918 55 HB3 ALA 11 3HB ALA 11 15.169 6.779 0.789 56 H MET 12 H MET 12 15.976 4.930 2.498 57 HA MET 12 HA MET 12 15.025 2.291 1.557 58 HB2 MET 12 1HB MET 12 14.858 3.471 4.364 59 HB3 MET 12 2HB MET 12 14.418 1.847 3.843 60 HG2 MET 12 1HG MET 12 16.966 1.953 2.919 61 HG3 MET 12 2HG MET 12 17.132 3.041 4.253 62 HE1 MET 12 3HE MET 12 16.426 -1.430 4.116 63 HE2 MET 12 1HE MET 12 14.898 -0.562 4.383 64 HE3 MET 12 2HE MET 12 15.894 -0.214 2.953 65 H TYR 13 H TYR 13 12.828 1.853 1.804 66 HA TYR 13 HA TYR 13 10.926 4.099 1.685 67 HB2 TYR 13 1HB TYR 13 11.822 2.236 -0.533 68 HB3 TYR 13 2HB TYR 13 10.137 2.680 -0.423 69 HD1 TYR 13 1HD TYR 13 9.596 5.217 -0.101 70 HD2 TYR 13 2HD TYR 13 13.148 3.674 -1.979 71 HE1 TYR 13 1HE TYR 13 9.929 7.384 -1.207 72 HE2 TYR 13 2HE TYR 13 13.401 5.845 -3.237 73 HH TYR 13 HH TYR 13 12.691 8.117 -3.374 74 H GLU 14 H GLU 14 9.395 3.502 3.174 75 HA GLU 14 HA GLU 14 8.366 0.762 3.173 76 HB2 GLU 14 1HB GLU 14 9.669 0.967 5.196 77 HB3 GLU 14 2HB GLU 14 9.006 2.573 5.523 78 HG2 GLU 14 1HG GLU 14 6.732 1.494 5.817 79 HG3 GLU 14 2HG GLU 14 7.537 -0.080 5.693 80 H VAL 15 H VAL 15 6.145 0.755 3.180 81 HA VAL 15 HA VAL 15 4.581 3.243 3.507 82 HB VAL 15 HB VAL 15 5.005 2.955 1.119 83 HG11 VAL 15 1HG1 VAL 15 3.660 0.216 1.161 84 HG12 VAL 15 2HG1 VAL 15 4.421 1.044 -0.206 85 HG13 VAL 15 3HG1 VAL 15 5.398 0.399 1.122 86 HG21 VAL 15 3HG2 VAL 15 2.176 2.048 1.718 87 HG22 VAL 15 1HG2 VAL 15 2.745 3.709 1.887 88 HG23 VAL 15 2HG2 VAL 15 2.735 2.926 0.294 89 H THR 16 H THR 16 2.691 2.929 4.705 90 HA THR 16 HA THR 16 2.071 0.139 5.524 91 HB THR 16 HB THR 16 0.638 1.396 7.215 92 HG1 THR 16 1HG THR 16 0.996 3.542 7.499 93 HG21 THR 16 3HG2 THR 16 3.636 1.940 7.345 94 HG22 THR 16 1HG2 THR 16 2.810 0.456 7.870 95 HG23 THR 16 2HG2 THR 16 2.488 1.988 8.699 96 H ILE 17 H ILE 17 -0.124 -0.483 5.621 97 HA ILE 17 HA ILE 17 -2.018 1.270 4.228 98 HB ILE 17 HB ILE 17 -1.283 -0.187 2.513 99 HG12 ILE 17 1HG1 ILE 17 -3.351 -1.368 1.896 100 HG13 ILE 17 2HG1 ILE 17 -3.906 -1.345 3.572 101 HG21 ILE 17 1HG2 ILE 17 -1.335 -2.604 2.503 102 HG22 ILE 17 2HG2 ILE 17 -0.233 -2.013 3.745 103 HG23 ILE 17 3HG2 ILE 17 -1.840 -2.630 4.199 104 HD11 ILE 17 3HD1 ILE 17 -5.018 0.325 2.266 105 HD12 ILE 17 1HD1 ILE 17 -4.053 1.152 3.468 106 HD13 ILE 17 2HD1 ILE 17 -3.481 1.087 1.779 107 H GLU 18 H GLU 18 -3.479 1.708 5.828 108 HA GLU 18 HA GLU 18 -4.013 -0.429 7.838 109 HB2 GLU 18 1HB GLU 18 -4.399 2.556 8.167 110 HB3 GLU 18 2HB GLU 18 -4.510 1.287 9.384 111 HG2 GLU 18 1HG GLU 18 -1.983 0.819 8.627 112 HG3 GLU 18 2HG GLU 18 -2.053 2.460 8.029 113 H GLN 19 H GLN 19 -6.093 -1.075 8.171 114 HA GLN 19 HA GLN 19 -7.992 -0.134 6.162 115 HB2 GLN 19 1HB GLN 19 -7.609 -2.906 7.368 116 HB3 GLN 19 2HB GLN 19 -8.636 -2.484 6.015 117 HG2 GLN 19 1HG GLN 19 -6.754 -2.086 4.573 118 HG3 GLN 19 2HG GLN 19 -5.610 -2.091 5.915 119 HE21 GLN 19 1HE2 GLN 19 -8.105 -4.351 4.554 120 HE22 GLN 19 2HE2 GLN 19 -7.044 -5.739 4.686 121 H SER 20 H SER 20 -9.696 0.889 7.087 122 HA SER 20 HA SER 20 -10.804 -0.248 9.573 123 HB2 SER 20 1HB SER 20 -10.938 2.681 8.695 124 HB3 SER 20 2HB SER 20 -11.404 2.056 10.285 125 HG SER 20 HG SER 20 -9.212 1.513 10.625 126 H GLY 21 H GLY 21 -13.030 0.831 10.037 127 HA2 GLY 21 1HA GLY 21 -15.237 0.902 9.646 128 HA3 GLY 21 2HA GLY 21 -14.887 1.149 7.941 129 H ASP 22 H ASP 22 -15.053 -0.568 6.507 130 HA ASP 22 HA ASP 22 -15.511 -3.308 7.511 131 HB2 ASP 22 1HB ASP 22 -17.479 -1.493 6.267 132 HB3 ASP 22 2HB ASP 22 -17.188 -2.910 5.281 133 H PHE 23 H PHE 23 -13.855 -4.407 6.547 134 HA PHE 23 HA PHE 23 -12.963 -3.404 3.886 135 HB2 PHE 23 1HB PHE 23 -10.699 -3.958 4.515 136 HB3 PHE 23 2HB PHE 23 -11.438 -2.775 5.547 137 HD1 PHE 23 1HD PHE 23 -10.911 -6.548 5.556 138 HD2 PHE 23 2HD PHE 23 -10.875 -2.835 7.774 139 HE1 PHE 23 1HE PHE 23 -9.953 -7.702 7.500 140 HE2 PHE 23 2HE PHE 23 -9.901 -4.001 9.705 141 HZ PHE 23 HZ PHE 23 -9.399 -6.444 9.575 142 H ARG 24 H ARG 24 -14.838 -5.733 4.699 143 HA ARG 24 HA ARG 24 -13.339 -8.033 3.556 144 HB2 ARG 24 1HB ARG 24 -16.045 -8.083 4.940 145 HB3 ARG 24 2HB ARG 24 -14.950 -9.433 4.672 146 HG2 ARG 24 1HG ARG 24 -13.321 -8.483 6.266 147 HG3 ARG 24 2HG ARG 24 -14.413 -7.108 6.549 148 HD2 ARG 24 1HD ARG 24 -16.198 -8.751 7.239 149 HD3 ARG 24 2HD ARG 24 -14.959 -10.025 7.198 150 HE ARG 24 HE ARG 24 -13.760 -8.118 8.708 151 HH11 ARG 24 1HH1 ARG 24 -17.029 -9.618 9.087 152 HH12 ARG 24 2HH1 ARG 24 -17.018 -9.289 10.786 153 HH21 ARG 24 1HH2 ARG 24 -13.996 -7.516 10.814 154 HH22 ARG 24 2HH2 ARG 24 -15.411 -7.911 11.737 155 H SER 25 H SER 25 -15.382 -5.752 2.276 156 HA SER 25 HA SER 25 -15.660 -7.365 -0.085 157 HB2 SER 25 1HB SER 25 -18.053 -6.070 1.299 158 HB3 SER 25 2HB SER 25 -18.010 -6.379 -0.445 159 HG SER 25 HG SER 25 -17.569 -8.508 -0.063 160 H PHE 26 H PHE 26 -14.117 -6.173 -0.911 161 HA PHE 26 HA PHE 26 -14.500 -3.753 -2.123 162 HB2 PHE 26 1HB PHE 26 -13.070 -3.406 0.541 163 HB3 PHE 26 2HB PHE 26 -12.539 -2.502 -0.821 164 HD1 PHE 26 2HD PHE 26 -14.429 -1.296 -2.249 165 HD2 PHE 26 1HD PHE 26 -14.789 -2.306 1.932 166 HE1 PHE 26 2HE PHE 26 -15.932 0.642 -1.912 167 HE2 PHE 26 1HE PHE 26 -16.325 -0.419 2.255 168 HZ PHE 26 HZ PHE 26 -16.896 1.092 0.355 169 H ILE 27 H ILE 27 -13.416 -4.384 -3.860 170 HA ILE 27 HA ILE 27 -11.290 -6.309 -3.938 171 HB ILE 27 HB ILE 27 -11.226 -5.514 -6.383 172 HG12 ILE 27 1HG1 ILE 27 -13.981 -4.395 -5.997 173 HG13 ILE 27 2HG1 ILE 27 -12.593 -3.336 -5.739 174 HG21 ILE 27 1HG2 ILE 27 -13.371 -6.791 -6.871 175 HG22 ILE 27 2HG2 ILE 27 -12.206 -7.584 -5.813 176 HG23 ILE 27 3HG2 ILE 27 -13.653 -6.815 -5.121 177 HD11 ILE 27 3HD1 ILE 27 -11.761 -3.742 -7.987 178 HD12 ILE 27 1HD1 ILE 27 -13.088 -4.881 -8.305 179 HD13 ILE 27 2HD1 ILE 27 -13.433 -3.166 -8.041 180 H LYS 28 H LYS 28 -9.568 -5.449 -2.647 181 HA LYS 28 HA LYS 28 -8.384 -2.905 -3.267 182 HB2 LYS 28 1HB LYS 28 -6.722 -5.130 -2.098 183 HB3 LYS 28 2HB LYS 28 -6.599 -3.405 -1.869 184 HG2 LYS 28 1HG LYS 28 -7.521 -3.896 0.150 185 HG3 LYS 28 2HG LYS 28 -9.046 -3.764 -0.731 186 HD2 LYS 28 1HD LYS 28 -9.032 -6.227 -1.071 187 HD3 LYS 28 2HD LYS 28 -7.452 -6.348 -0.324 188 HE2 LYS 28 1HE LYS 28 -8.450 -6.711 1.637 189 HE3 LYS 28 2HE LYS 28 -8.954 -5.008 1.622 190 HZ1 LYS 28 3HZ LYS 28 -10.888 -6.458 1.845 191 HZ2 LYS 28 1HZ LYS 28 -10.444 -7.310 0.518 192 HZ3 LYS 28 2HZ LYS 28 -10.927 -5.787 0.331 193 H SER 29 H SER 29 -6.579 -2.332 -4.643 194 HA SER 29 HA SER 29 -5.067 -4.442 -5.950 195 HB2 SER 29 1HB SER 29 -6.766 -2.306 -7.333 196 HB3 SER 29 2HB SER 29 -5.365 -3.062 -8.082 197 HG SER 29 HG SER 29 -6.342 -5.006 -8.045 198 H VAL 30 H VAL 30 -2.936 -3.750 -5.812 199 HA VAL 30 HA VAL 30 -2.391 -0.868 -5.898 200 HB VAL 30 HB VAL 30 -0.941 -2.526 -3.858 201 HG11 VAL 30 1HG1 VAL 30 -0.513 -0.371 -2.783 202 HG12 VAL 30 2HG1 VAL 30 -0.223 -0.135 -4.516 203 HG13 VAL 30 3HG1 VAL 30 -1.720 0.438 -3.796 204 HG21 VAL 30 3HG2 VAL 30 -3.512 -1.021 -3.196 205 HG22 VAL 30 1HG2 VAL 30 -3.269 -2.766 -3.076 206 HG23 VAL 30 2HG2 VAL 30 -2.378 -1.699 -2.007 207 H VAL 31 H VAL 31 0.068 -0.559 -6.301 208 HA VAL 31 HA VAL 31 0.994 -2.555 -8.259 209 HB VAL 31 HB VAL 31 0.582 0.456 -8.526 210 HG11 VAL 31 1HG1 VAL 31 1.443 0.416 -10.559 211 HG12 VAL 31 2HG1 VAL 31 2.085 -1.189 -10.212 212 HG13 VAL 31 3HG1 VAL 31 0.541 -1.018 -11.063 213 HG21 VAL 31 3HG2 VAL 31 -1.354 -1.668 -9.484 214 HG22 VAL 31 1HG2 VAL 31 -1.658 -0.363 -8.333 215 HG23 VAL 31 2HG2 VAL 31 -1.353 0.025 -10.017 216 H VAL 32 H VAL 32 2.670 -2.657 -6.026 217 HA VAL 32 HA VAL 32 4.239 -0.284 -5.747 218 HB VAL 32 HB VAL 32 3.885 -1.736 -3.856 219 HG11 VAL 32 1HG1 VAL 32 4.115 -3.896 -5.035 220 HG12 VAL 32 2HG1 VAL 32 5.872 -3.633 -5.102 221 HG13 VAL 32 3HG1 VAL 32 5.048 -3.786 -3.526 222 HG21 VAL 32 3HG2 VAL 32 6.031 -1.518 -2.856 223 HG22 VAL 32 1HG2 VAL 32 6.831 -1.394 -4.435 224 HG23 VAL 32 2HG2 VAL 32 5.729 -0.114 -3.880 225 H VAL 33 H VAL 33 6.114 0.340 -6.501 226 HA VAL 33 HA VAL 33 7.601 -1.427 -8.329 227 HB VAL 33 HB VAL 33 7.250 1.611 -8.433 228 HG11 VAL 33 1HG1 VAL 33 8.875 -0.222 -10.249 229 HG12 VAL 33 2HG1 VAL 33 8.513 1.480 -10.586 230 HG13 VAL 33 3HG1 VAL 33 9.500 1.066 -9.191 231 HG21 VAL 33 3HG2 VAL 33 6.149 1.225 -10.620 232 HG22 VAL 33 1HG2 VAL 33 6.255 -0.528 -10.364 233 HG23 VAL 33 2HG2 VAL 33 5.249 0.478 -9.301 234 H ALA 34 H ALA 34 9.981 -1.244 -8.027 235 HA ALA 34 HA ALA 34 10.980 0.545 -5.988 236 HB1 ALA 34 1HB ALA 34 12.188 -1.233 -4.753 237 HB2 ALA 34 2HB ALA 34 10.436 -1.370 -4.568 238 HB3 ALA 34 3HB ALA 34 11.308 -2.476 -5.661 239 H ASN 35 H ASN 35 12.914 1.208 -6.610 240 HA ASN 35 HA ASN 35 14.179 0.052 -9.052 241 HB2 ASN 35 1HB ASN 35 13.421 2.420 -9.001 242 HB3 ASN 35 2HB ASN 35 14.611 2.715 -7.693 243 HD21 ASN 35 1HD2 ASN 35 14.492 4.092 -10.294 244 HD22 ASN 35 2HD2 ASN 35 15.974 3.710 -11.106 245 H GLY 36 H GLY 36 15.186 -1.690 -7.740 246 HA2 GLY 36 1HA GLY 36 17.754 -1.684 -7.915 247 HA3 GLY 36 2HA GLY 36 17.654 -0.709 -6.435 248 H THR 37 H THR 37 16.464 -1.703 -4.669 249 HA THR 37 HA THR 37 17.332 -4.469 -4.195 250 HB THR 37 HB THR 37 17.688 -2.668 -2.531 251 HG1 THR 37 1HG THR 37 17.734 -4.638 -1.674 252 HG21 THR 37 3HG2 THR 37 14.703 -2.888 -2.031 253 HG22 THR 37 1HG2 THR 37 15.470 -1.526 -2.858 254 HG23 THR 37 2HG2 THR 37 15.874 -1.871 -1.163 255 H GLN 38 H GLN 38 15.547 -5.660 -2.729 256 HA GLN 38 HA GLN 38 13.104 -5.932 -4.413 257 HB2 GLN 38 1HB GLN 38 14.815 -7.847 -2.849 258 HB3 GLN 38 2HB GLN 38 13.080 -8.139 -2.837 259 HG2 GLN 38 1HG GLN 38 12.993 -8.056 -5.276 260 HG3 GLN 38 2HG GLN 38 14.692 -7.669 -5.386 261 HE21 GLN 38 1HE2 GLN 38 13.004 -10.194 -3.364 262 HE22 GLN 38 2HE2 GLN 38 13.952 -11.498 -4.027 263 H LEU 39 H LEU 39 11.231 -6.739 -3.117 264 HA LEU 39 HA LEU 39 10.587 -4.742 -1.025 265 HB2 LEU 39 1HB LEU 39 9.167 -6.257 -3.128 266 HB3 LEU 39 2HB LEU 39 8.358 -6.397 -1.607 267 HG LEU 39 HG LEU 39 7.669 -4.549 -3.258 268 HD11 LEU 39 1HD1 LEU 39 8.142 -3.855 -0.340 269 HD12 LEU 39 2HD1 LEU 39 6.752 -4.717 -1.013 270 HD13 LEU 39 3HD1 LEU 39 7.033 -3.018 -1.436 271 HD21 LEU 39 3HD2 LEU 39 10.055 -3.690 -3.528 272 HD22 LEU 39 1HD2 LEU 39 9.859 -2.928 -1.926 273 HD23 LEU 39 2HD2 LEU 39 8.780 -2.494 -3.276 274 H LYS 40 H LYS 40 9.294 -5.622 0.835 275 HA LYS 40 HA LYS 40 9.820 -8.443 1.540 276 HB2 LYS 40 1HB LYS 40 11.520 -7.227 2.721 277 HB3 LYS 40 2HB LYS 40 10.312 -6.149 3.459 278 HG2 LYS 40 1HG LYS 40 9.412 -8.119 4.689 279 HG3 LYS 40 2HG LYS 40 10.630 -9.154 3.897 280 HD2 LYS 40 1HD LYS 40 12.449 -7.784 4.901 281 HD3 LYS 40 2HD LYS 40 11.230 -6.732 5.653 282 HE2 LYS 40 1HE LYS 40 10.317 -8.833 6.791 283 HE3 LYS 40 2HE LYS 40 11.775 -9.672 6.216 284 HZ1 LYS 40 3HZ LYS 40 13.104 -8.176 7.518 285 HZ2 LYS 40 1HZ LYS 40 11.965 -8.807 8.483 286 HZ3 LYS 40 2HZ LYS 40 11.775 -7.259 7.946 287 H ASP 41 H ASP 41 8.119 -9.430 2.180 288 HA ASP 41 HA ASP 41 5.608 -8.051 2.093 289 HB2 ASP 41 1HB ASP 41 6.385 -10.147 0.805 290 HB3 ASP 41 2HB ASP 41 6.127 -11.092 2.246 291 H GLY 42 H GLY 42 4.680 -7.272 4.001 292 HA2 GLY 42 1HA GLY 42 5.761 -7.752 6.490 293 HA3 GLY 42 2HA GLY 42 4.151 -7.084 6.196 294 H ALA 43 H ALA 43 3.363 -9.781 4.898 295 HA ALA 43 HA ALA 43 2.175 -11.085 7.109 296 HB1 ALA 43 1HB ALA 43 1.668 -12.819 5.422 297 HB2 ALA 43 2HB ALA 43 1.377 -11.184 4.786 298 HB3 ALA 43 3HB ALA 43 2.834 -12.074 4.299 299 H THR 44 H THR 44 4.973 -12.186 5.100 300 HA THR 44 HA THR 44 5.720 -14.154 7.190 301 HB THR 44 HB THR 44 6.416 -15.414 5.015 302 HG1 THR 44 1HG THR 44 5.583 -14.710 3.180 303 HG21 THR 44 3HG2 THR 44 3.461 -14.863 5.596 304 HG22 THR 44 1HG2 THR 44 4.463 -16.055 6.440 305 HG23 THR 44 2HG2 THR 44 4.102 -16.265 4.718 306 H GLY 45 H GLY 45 6.771 -11.296 5.833 307 HA2 GLY 45 1HA GLY 45 8.710 -10.209 5.798 308 HA3 GLY 45 2HA GLY 45 9.378 -11.444 6.883 309 H GLU 46 H GLU 46 8.064 -12.356 3.743 310 HA GLU 46 HA GLU 46 10.704 -13.307 2.863 311 HB2 GLU 46 1HB GLU 46 9.466 -14.310 1.061 312 HB3 GLU 46 2HB GLU 46 8.846 -14.772 2.659 313 HG2 GLU 46 1HG GLU 46 6.969 -13.215 2.311 314 HG3 GLU 46 2HG GLU 46 7.578 -12.952 0.664 315 H SER 47 H SER 47 11.447 -12.706 0.688 316 HA SER 47 HA SER 47 10.885 -9.825 0.365 317 HB2 SER 47 1HB SER 47 13.423 -11.175 -0.240 318 HB3 SER 47 2HB SER 47 13.156 -9.449 -0.100 319 HG SER 47 HG SER 47 13.154 -11.358 2.041 320 H LEU 48 H LEU 48 9.886 -9.453 -1.283 321 HA LEU 48 HA LEU 48 9.641 -11.419 -3.493 322 HB2 LEU 48 1HB LEU 48 7.879 -9.019 -2.897 323 HB3 LEU 48 2HB LEU 48 7.556 -10.280 -4.087 324 HG LEU 48 HG LEU 48 7.602 -10.563 -1.062 325 HD11 LEU 48 1HD1 LEU 48 5.251 -11.126 -1.353 326 HD12 LEU 48 2HD1 LEU 48 5.407 -11.035 -3.121 327 HD13 LEU 48 3HD1 LEU 48 5.590 -9.574 -2.134 328 HD21 LEU 48 3HD2 LEU 48 8.554 -12.637 -1.792 329 HD22 LEU 48 1HD2 LEU 48 7.410 -12.771 -3.151 330 HD23 LEU 48 2HD2 LEU 48 6.854 -12.955 -1.480 331 H ALA 49 H ALA 49 9.252 -10.713 -5.699 332 HA ALA 49 HA ALA 49 11.507 -9.066 -6.588 333 HB1 ALA 49 1HB ALA 49 11.242 -10.323 -8.660 334 HB2 ALA 49 2HB ALA 49 11.267 -11.457 -7.303 335 HB3 ALA 49 3HB ALA 49 9.731 -11.060 -8.086 336 H SER 50 H SER 50 10.660 -6.977 -6.439 337 HA SER 50 HA SER 50 8.216 -6.036 -7.432 338 HB2 SER 50 1HB SER 50 9.507 -3.860 -7.525 339 HB3 SER 50 2HB SER 50 9.642 -4.714 -5.994 340 HG SER 50 HG SER 50 11.555 -4.150 -7.910 341 HA PRO 51 HA PRO 51 7.544 -4.051 -8.510 342 HB2 PRO 51 1HB PRO 51 6.253 -3.004 -10.623 343 HB3 PRO 51 2HB PRO 51 7.912 -2.474 -10.207 344 HG2 PRO 51 1HG PRO 51 7.094 -4.438 -12.349 345 HG3 PRO 51 2HG PRO 51 8.275 -3.094 -12.444 346 HD2 PRO 51 1HD PRO 51 8.953 -5.744 -11.945 347 HD3 PRO 51 2HD PRO 51 9.925 -4.342 -11.420 348 H VAL 52 H VAL 52 5.281 -4.546 -8.025 349 HA VAL 52 HA VAL 52 4.174 -6.921 -9.417 350 HB VAL 52 HB VAL 52 5.613 -7.671 -7.529 351 HG11 VAL 52 1HG1 VAL 52 3.632 -6.154 -5.788 352 HG12 VAL 52 2HG1 VAL 52 4.840 -7.311 -5.215 353 HG13 VAL 52 3HG1 VAL 52 5.371 -5.811 -5.999 354 HG21 VAL 52 3HG2 VAL 52 3.698 -9.084 -8.154 355 HG22 VAL 52 1HG2 VAL 52 4.036 -9.171 -6.429 356 HG23 VAL 52 2HG2 VAL 52 2.662 -8.220 -6.993 357 H ILE 53 H ILE 53 1.930 -7.318 -8.944 358 HA ILE 53 HA ILE 53 0.450 -4.880 -8.127 359 HB ILE 53 HB ILE 53 -0.388 -7.024 -10.111 360 HG12 ILE 53 1HG1 ILE 53 1.300 -5.802 -11.259 361 HG13 ILE 53 2HG1 ILE 53 -0.255 -5.254 -11.860 362 HG21 ILE 53 1HG2 ILE 53 -1.743 -4.402 -9.330 363 HG22 ILE 53 2HG2 ILE 53 -2.269 -5.490 -10.638 364 HG23 ILE 53 3HG2 ILE 53 -2.293 -6.042 -8.961 365 HD11 ILE 53 3HD1 ILE 53 1.041 -3.303 -11.633 366 HD12 ILE 53 1HD1 ILE 53 0.011 -3.267 -10.183 367 HD13 ILE 53 2HD1 ILE 53 1.699 -3.790 -10.069 368 H LEU 54 H LEU 54 -0.737 -5.192 -6.501 369 HA LEU 54 HA LEU 54 -1.017 -7.787 -5.037 370 HB2 LEU 54 1HB LEU 54 -1.312 -4.864 -4.318 371 HB3 LEU 54 2HB LEU 54 -1.701 -6.189 -3.254 372 HG LEU 54 HG LEU 54 1.041 -5.596 -4.427 373 HD11 LEU 54 1HD1 LEU 54 1.721 -4.947 -2.257 374 HD12 LEU 54 2HD1 LEU 54 0.278 -5.633 -1.508 375 HD13 LEU 54 3HD1 LEU 54 0.124 -4.172 -2.458 376 HD21 LEU 54 3HD2 LEU 54 1.860 -7.418 -2.900 377 HD22 LEU 54 1HD2 LEU 54 0.887 -8.019 -4.194 378 HD23 LEU 54 2HD2 LEU 54 0.175 -7.880 -2.568 379 H SER 55 H SER 55 -3.058 -8.107 -3.917 380 HA SER 55 HA SER 55 -5.401 -7.733 -5.680 381 HB2 SER 55 1HB SER 55 -5.753 -10.208 -5.397 382 HB3 SER 55 2HB SER 55 -4.296 -9.802 -6.283 383 HG SER 55 HG SER 55 -3.045 -10.346 -4.590 384 H ASP 56 H ASP 56 -7.042 -9.464 -4.250 385 HA ASP 56 HA ASP 56 -7.755 -7.939 -1.835 386 HB2 ASP 56 1HB ASP 56 -9.371 -8.487 -3.683 387 HB3 ASP 56 2HB ASP 56 -9.127 -10.202 -3.340 388 H GLU 57 H GLU 57 -6.142 -10.827 -2.794 389 HA GLU 57 HA GLU 57 -6.719 -12.498 -0.447 390 HB2 GLU 57 1HB GLU 57 -4.709 -12.620 -2.751 391 HB3 GLU 57 2HB GLU 57 -4.778 -13.834 -1.491 392 HG2 GLU 57 1HG GLU 57 -7.208 -13.175 -3.200 393 HG3 GLU 57 2HG GLU 57 -5.980 -14.324 -3.698 394 H GLU 58 H GLU 58 -3.963 -10.339 -1.501 395 HA GLU 58 HA GLU 58 -2.261 -11.056 0.555 396 HB2 GLU 58 1HB GLU 58 -0.994 -9.431 -0.657 397 HB3 GLU 58 2HB GLU 58 -1.941 -10.280 -1.822 398 HG2 GLU 58 1HG GLU 58 -2.147 -8.178 -2.518 399 HG3 GLU 58 2HG GLU 58 -3.593 -8.359 -1.575 400 H LEU 59 H LEU 59 -4.720 -8.591 0.161 401 HA LEU 59 HA LEU 59 -3.963 -7.239 2.650 402 HB2 LEU 59 1HB LEU 59 -5.246 -6.461 0.171 403 HB3 LEU 59 2HB LEU 59 -6.194 -5.884 1.528 404 HG LEU 59 HG LEU 59 -3.197 -5.443 1.297 405 HD11 LEU 59 1HD1 LEU 59 -3.635 -3.218 0.491 406 HD12 LEU 59 2HD1 LEU 59 -5.390 -3.382 0.689 407 HD13 LEU 59 3HD1 LEU 59 -4.530 -4.298 -0.563 408 HD21 LEU 59 3HD2 LEU 59 -4.233 -5.287 3.567 409 HD22 LEU 59 1HD2 LEU 59 -5.284 -3.994 2.954 410 HD23 LEU 59 2HD2 LEU 59 -3.530 -3.769 2.988 411 H ALA 60 H ALA 60 -5.193 -9.894 2.785 412 HA ALA 60 HA ALA 60 -7.882 -9.643 3.861 413 HB1 ALA 60 1HB ALA 60 -7.103 -11.611 2.574 414 HB2 ALA 60 2HB ALA 60 -5.930 -11.982 3.861 415 HB3 ALA 60 3HB ALA 60 -7.672 -12.054 4.192 416 H VAL 61 H VAL 61 -6.014 -7.997 5.310 417 HA VAL 61 HA VAL 61 -6.161 -9.134 8.028 418 HB VAL 61 HB VAL 61 -3.936 -8.136 8.553 419 HG11 VAL 61 1HG1 VAL 61 -2.596 -9.907 7.698 420 HG12 VAL 61 2HG1 VAL 61 -4.198 -10.534 8.119 421 HG13 VAL 61 3HG1 VAL 61 -3.771 -10.271 6.411 422 HG21 VAL 61 3HG2 VAL 61 -3.768 -6.552 6.616 423 HG22 VAL 61 1HG2 VAL 61 -2.352 -7.602 6.826 424 HG23 VAL 61 2HG2 VAL 61 -3.524 -7.944 5.537 425 H GLU 62 H GLU 62 -5.249 -6.997 9.448 426 HA GLU 62 HA GLU 62 -7.194 -4.855 8.863 427 HB2 GLU 62 1HB GLU 62 -6.987 -4.279 11.166 428 HB3 GLU 62 2HB GLU 62 -7.255 -6.020 10.987 429 HG2 GLU 62 1HG GLU 62 -4.830 -6.428 11.366 430 HG3 GLU 62 2HG GLU 62 -4.599 -4.692 11.548 431 H LYS 63 H LYS 63 -3.713 -5.363 8.885 432 HA LYS 63 HA LYS 63 -3.389 -2.904 7.474 433 HB2 LYS 63 1HB LYS 63 -3.211 -1.805 9.571 434 HB3 LYS 63 2HB LYS 63 -2.418 -3.176 10.323 435 HG2 LYS 63 1HG LYS 63 -0.314 -2.700 9.138 436 HG3 LYS 63 2HG LYS 63 -1.085 -1.328 8.306 437 HD2 LYS 63 1HD LYS 63 -1.595 -0.345 10.540 438 HD3 LYS 63 2HD LYS 63 -0.748 -1.664 11.300 439 HE2 LYS 63 1HE LYS 63 0.542 0.242 9.282 440 HE3 LYS 63 2HE LYS 63 0.560 0.505 11.020 441 HZ1 LYS 63 3HZ LYS 63 1.935 -1.648 9.554 442 HZ2 LYS 63 1HZ LYS 63 1.648 -1.740 11.184 443 HZ3 LYS 63 2HZ LYS 63 2.547 -0.509 10.550 444 H VAL 64 H VAL 64 -1.437 -2.910 6.270 445 HA VAL 64 HA VAL 64 0.436 -5.097 6.934 446 HB VAL 64 HB VAL 64 0.230 -4.220 4.074 447 HG11 VAL 64 1HG1 VAL 64 1.093 -6.439 3.614 448 HG12 VAL 64 2HG1 VAL 64 2.137 -5.675 4.803 449 HG13 VAL 64 3HG1 VAL 64 0.961 -6.895 5.318 450 HG21 VAL 64 3HG2 VAL 64 -1.285 -5.979 3.436 451 HG22 VAL 64 1HG2 VAL 64 -1.430 -6.533 5.104 452 HG23 VAL 64 2HG2 VAL 64 -2.121 -4.971 4.615 453 H THR 65 H THR 65 2.622 -4.546 6.127 454 HA THR 65 HA THR 65 3.348 -1.722 5.793 455 HB THR 65 HB THR 65 4.618 -3.733 7.704 456 HG1 THR 65 1HG THR 65 4.159 -2.290 9.291 457 HG21 THR 65 3HG2 THR 65 6.221 -1.917 8.240 458 HG22 THR 65 1HG2 THR 65 5.488 -0.916 6.962 459 HG23 THR 65 2HG2 THR 65 6.341 -2.433 6.560 460 H LEU 66 H LEU 66 4.576 -1.687 3.910 461 HA LEU 66 HA LEU 66 6.079 -4.144 3.120 462 HB2 LEU 66 1HB LEU 66 4.556 -2.159 1.383 463 HB3 LEU 66 2HB LEU 66 5.821 -3.200 0.773 464 HG LEU 66 HG LEU 66 3.735 -4.179 0.207 465 HD11 LEU 66 1HD1 LEU 66 3.877 -6.411 1.239 466 HD12 LEU 66 2HD1 LEU 66 4.898 -5.789 2.528 467 HD13 LEU 66 3HD1 LEU 66 5.492 -5.788 0.855 468 HD21 LEU 66 3HD2 LEU 66 2.960 -4.437 3.117 469 HD22 LEU 66 1HD2 LEU 66 1.980 -4.776 1.682 470 HD23 LEU 66 2HD2 LEU 66 2.405 -3.106 2.088 471 H SER 67 H SER 67 8.218 -3.763 2.453 472 HA SER 67 HA SER 67 9.218 -1.017 2.583 473 HB2 SER 67 1HB SER 67 9.113 -1.867 4.979 474 HB3 SER 67 2HB SER 67 10.299 -3.097 4.516 475 HG SER 67 HG SER 67 11.461 -1.391 5.304 476 H THR 68 H THR 68 11.836 -1.401 2.609 477 HA THR 68 HA THR 68 12.529 -3.071 0.216 478 HB THR 68 HB THR 68 14.405 -1.237 0.236 479 HG1 THR 68 1HG THR 68 12.163 0.109 1.357 480 HG21 THR 68 3HG2 THR 68 13.106 0.052 -1.434 481 HG22 THR 68 1HG2 THR 68 11.584 -0.634 -0.831 482 HG23 THR 68 2HG2 THR 68 12.772 -1.669 -1.638 483 H THR 69 H THR 69 14.064 -4.569 0.557 484 HA THR 69 HA THR 69 14.990 -4.829 3.159 485 HB THR 69 HB THR 69 16.058 -6.827 2.596 486 HG1 THR 69 1HG THR 69 16.380 -7.297 0.245 487 HG21 THR 69 3HG2 THR 69 13.682 -7.057 2.157 488 HG22 THR 69 1HG2 THR 69 14.640 -8.102 1.124 489 HG23 THR 69 2HG2 THR 69 13.936 -6.636 0.430 490 H GLY 70 H GLY 70 16.709 -3.692 0.354 491 HA2 GLY 70 1HA GLY 70 19.119 -2.940 1.973 492 HA3 GLY 70 2HA GLY 70 19.054 -3.173 0.230 493 H LYS 71 H LYS 71 18.602 -1.429 -1.024 494 HA LYS 71 HA LYS 71 17.243 0.954 0.003 495 HB2 LYS 71 1HB LYS 71 18.974 2.394 -0.948 496 HB3 LYS 71 2HB LYS 71 19.561 1.430 0.406 497 HG2 LYS 71 1HG LYS 71 21.196 0.509 -0.782 498 HG3 LYS 71 2HG LYS 71 20.152 0.049 -2.102 499 HD2 LYS 71 1HD LYS 71 21.313 2.815 -1.702 500 HD3 LYS 71 2HD LYS 71 22.024 1.561 -2.715 501 HE2 LYS 71 1HE LYS 71 19.261 1.924 -3.482 502 HE3 LYS 71 2HE LYS 71 20.010 3.517 -3.460 503 HZ1 LYS 71 3HZ LYS 71 21.819 2.368 -4.899 504 HZ2 LYS 71 1HZ LYS 71 20.377 2.483 -5.636 505 HZ3 LYS 71 2HZ LYS 71 20.799 1.066 -4.964 506 H ALA 72 H ALA 72 16.242 2.164 -1.628 507 HA ALA 72 HA ALA 72 16.514 1.217 -4.403 508 HB1 ALA 72 1HB ALA 72 14.389 0.222 -3.579 509 HB2 ALA 72 2HB ALA 72 13.887 1.813 -2.990 510 HB3 ALA 72 3HB ALA 72 14.049 1.513 -4.727 511 H ILE 73 H ILE 73 15.370 2.951 -5.837 512 HA ILE 73 HA ILE 73 15.915 5.666 -4.739 513 HB ILE 73 HB ILE 73 15.893 5.179 -7.685 514 HG12 ILE 73 1HG1 ILE 73 17.222 3.282 -7.124 515 HG13 ILE 73 2HG1 ILE 73 18.189 4.499 -7.858 516 HG21 ILE 73 1HG2 ILE 73 17.733 6.840 -7.610 517 HG22 ILE 73 2HG2 ILE 73 16.341 7.426 -6.693 518 HG23 ILE 73 3HG2 ILE 73 17.753 6.761 -5.831 519 HD11 ILE 73 3HD1 ILE 73 18.303 4.824 -4.953 520 HD12 ILE 73 1HD1 ILE 73 18.619 3.161 -5.440 521 HD13 ILE 73 2HD1 ILE 73 19.611 4.508 -6.089 522 H GLU 74 H GLU 74 13.220 3.729 -5.340 523 HA GLU 74 HA GLU 74 11.600 6.065 -5.914 524 HB2 GLU 74 1HB GLU 74 11.694 3.667 -7.812 525 HB3 GLU 74 2HB GLU 74 10.338 4.796 -7.718 526 HG2 GLU 74 1HG GLU 74 11.992 6.673 -8.120 527 HG3 GLU 74 2HG GLU 74 13.192 5.426 -8.521 528 H PHE 75 H PHE 75 9.365 5.668 -5.484 529 HA PHE 75 HA PHE 75 8.427 3.016 -4.904 530 HB2 PHE 75 1HB PHE 75 9.385 4.381 -2.720 531 HB3 PHE 75 2HB PHE 75 7.733 4.907 -2.665 532 HD1 PHE 75 2HD PHE 75 8.919 1.455 -3.691 533 HD2 PHE 75 1HD PHE 75 7.237 3.836 -0.471 534 HE1 PHE 75 2HE PHE 75 8.738 -0.531 -2.296 535 HE2 PHE 75 1HE PHE 75 7.129 1.843 0.888 536 HZ PHE 75 HZ PHE 75 7.855 -0.368 0.030 537 H ALA 76 H ALA 76 6.570 2.988 -6.025 538 HA ALA 76 HA ALA 76 4.954 5.489 -6.244 539 HB1 ALA 76 1HB ALA 76 6.132 5.020 -8.370 540 HB2 ALA 76 2HB ALA 76 5.473 3.367 -8.378 541 HB3 ALA 76 3HB ALA 76 4.376 4.758 -8.508 542 H VAL 77 H VAL 77 2.793 5.189 -5.782 543 HA VAL 77 HA VAL 77 1.812 2.431 -5.298 544 HB VAL 77 HB VAL 77 1.531 4.746 -3.337 545 HG11 VAL 77 1HG1 VAL 77 1.058 1.802 -2.752 546 HG12 VAL 77 2HG1 VAL 77 0.523 3.219 -1.846 547 HG13 VAL 77 3HG1 VAL 77 -0.224 2.824 -3.399 548 HG21 VAL 77 3HG2 VAL 77 3.060 3.501 -1.842 549 HG22 VAL 77 1HG2 VAL 77 3.431 2.367 -3.164 550 HG23 VAL 77 2HG2 VAL 77 3.875 4.083 -3.291 551 H SER 78 H SER 78 0.060 2.295 -6.645 552 HA SER 78 HA SER 78 -1.891 4.483 -6.550 553 HB2 SER 78 1HB SER 78 -1.041 3.138 -9.140 554 HB3 SER 78 2HB SER 78 -2.295 4.372 -8.966 555 HG SER 78 HG SER 78 0.306 4.656 -9.321 556 H GLY 79 H GLY 79 -4.072 3.616 -7.566 557 HA2 GLY 79 1HA GLY 79 -4.394 1.332 -8.838 558 HA3 GLY 79 2HA GLY 79 -4.475 0.701 -7.196 559 H GLY 80 H GLY 80 -6.166 1.312 -5.851 560 HA2 GLY 80 1HA GLY 80 -7.940 2.940 -5.259 561 HA3 GLY 80 2HA GLY 80 -8.502 2.845 -6.927 562 H VAL 81 H VAL 81 -10.518 2.040 -5.370 563 HA VAL 81 HA VAL 81 -10.711 -0.778 -5.798 564 HB VAL 81 HB VAL 81 -9.641 -1.155 -3.785 565 HG11 VAL 81 1HG1 VAL 81 -11.122 1.184 -2.570 566 HG12 VAL 81 2HG1 VAL 81 -10.192 -0.001 -1.617 567 HG13 VAL 81 3HG1 VAL 81 -9.367 1.015 -2.806 568 HG21 VAL 81 3HG2 VAL 81 -11.903 -2.227 -3.858 569 HG22 VAL 81 1HG2 VAL 81 -11.051 -2.123 -2.313 570 HG23 VAL 81 2HG2 VAL 81 -12.383 -0.996 -2.679 571 H VAL 82 H VAL 82 -12.932 -1.518 -5.479 572 HA VAL 82 HA VAL 82 -15.050 0.471 -5.126 573 HB VAL 82 HB VAL 82 -14.992 -1.607 -7.383 574 HG11 VAL 82 1HG1 VAL 82 -16.862 0.644 -6.666 575 HG12 VAL 82 2HG1 VAL 82 -16.791 0.024 -8.328 576 HG13 VAL 82 3HG1 VAL 82 -17.230 -1.056 -7.016 577 HG21 VAL 82 3HG2 VAL 82 -14.645 0.250 -9.009 578 HG22 VAL 82 1HG2 VAL 82 -14.230 1.306 -7.635 579 HG23 VAL 82 2HG2 VAL 82 -13.243 -0.127 -8.021 580 H ASP 83 H ASP 83 -17.161 -0.864 -4.963 581 HA ASP 83 HA ASP 83 -16.592 -3.591 -4.082 582 HB2 ASP 83 1HB ASP 83 -17.181 -1.986 -2.068 583 HB3 ASP 83 2HB ASP 83 -18.756 -1.978 -2.743 584 H GLY 84 H GLY 84 -17.265 -4.576 -5.774 585 HA2 GLY 84 1HA GLY 84 -19.421 -3.517 -7.494 586 HA3 GLY 84 2HA GLY 84 -18.245 -4.776 -7.882 587 H GLU 85 H GLU 85 -19.769 -5.246 -4.841 588 HA GLU 85 HA GLU 85 -20.970 -7.715 -5.526 589 HB2 GLU 85 1HB GLU 85 -21.405 -5.852 -3.154 590 HB3 GLU 85 2HB GLU 85 -21.845 -7.556 -3.186 591 HG2 GLU 85 1HG GLU 85 -18.971 -6.571 -3.493 592 HG3 GLU 85 2HG GLU 85 -19.729 -6.945 -1.944 593 H ASP 86 H ASP 86 -23.372 -8.079 -4.768 594 HA ASP 86 HA ASP 86 -25.349 -6.104 -5.239 595 HB2 ASP 86 1HB ASP 86 -24.758 -6.519 -7.615 596 HB3 ASP 86 2HB ASP 86 -24.915 -8.264 -7.362 597 H GLY 87 H GLY 87 -26.846 -6.846 -3.831 598 HA2 GLY 87 1HA GLY 87 -28.519 -8.542 -3.306 599 HA3 GLY 87 2HA GLY 87 -27.309 -9.798 -3.541 600 H VAL 88 H VAL 88 -25.595 -7.528 -1.872 601 HA VAL 88 HA VAL 88 -26.783 -7.818 0.743 602 HB VAL 88 HB VAL 88 -25.545 -9.819 0.760 603 HG11 VAL 88 1HG1 VAL 88 -24.026 -9.488 -1.088 604 HG12 VAL 88 2HG1 VAL 88 -23.097 -8.295 -0.149 605 HG13 VAL 88 3HG1 VAL 88 -23.145 -10.003 0.361 606 HG21 VAL 88 3HG2 VAL 88 -25.410 -8.387 2.803 607 HG22 VAL 88 1HG2 VAL 88 -24.098 -9.561 2.626 608 HG23 VAL 88 2HG2 VAL 88 -23.807 -7.845 2.269 609 H VAL 89 H VAL 89 -26.326 -5.972 1.942 610 HA VAL 89 HA VAL 89 -24.495 -3.985 0.720 611 HB VAL 89 HB VAL 89 -26.878 -3.433 1.333 612 HG11 VAL 89 1HG1 VAL 89 -27.532 -2.988 3.562 613 HG12 VAL 89 2HG1 VAL 89 -26.904 -4.629 3.540 614 HG13 VAL 89 3HG1 VAL 89 -25.907 -3.319 4.199 615 HG21 VAL 89 3HG2 VAL 89 -25.183 -1.707 0.913 616 HG22 VAL 89 1HG2 VAL 89 -26.365 -1.200 2.123 617 HG23 VAL 89 2HG2 VAL 89 -24.751 -1.715 2.637 618 H ASN 90 H ASN 90 -22.659 -3.411 1.716 619 HA ASN 90 HA ASN 90 -21.930 -4.728 4.272 620 HB2 ASN 90 1HB ASN 90 -20.033 -4.034 2.008 621 HB3 ASN 90 2HB ASN 90 -19.576 -4.612 3.609 622 HD21 ASN 90 1HD2 ASN 90 -21.175 -5.547 0.574 623 HD22 ASN 90 2HD2 ASN 90 -21.088 -7.279 0.850 624 H GLU 91 H GLU 91 -19.702 -2.814 4.786 625 HA GLU 91 HA GLU 91 -21.198 -0.245 4.860 626 HB2 GLU 91 1HB GLU 91 -19.999 -1.882 7.064 627 HB3 GLU 91 2HB GLU 91 -19.763 -0.161 7.171 628 HG2 GLU 91 1HG GLU 91 -22.541 -0.610 6.477 629 HG3 GLU 91 2HG GLU 91 -22.092 -1.748 7.738 630 HA PRO 92 HA PRO 92 -17.678 1.662 3.357 631 HB2 PRO 92 1HB PRO 92 -17.671 4.181 4.525 632 HB3 PRO 92 2HB PRO 92 -18.977 3.657 3.410 633 HG2 PRO 92 1HG PRO 92 -18.913 3.593 6.439 634 HG3 PRO 92 2HG PRO 92 -20.208 4.242 5.379 635 HD2 PRO 92 1HD PRO 92 -20.321 1.762 6.448 636 HD3 PRO 92 2HD PRO 92 -20.931 2.068 4.799 637 H MET 93 H MET 93 -15.581 3.176 3.939 638 HA MET 93 HA MET 93 -14.309 2.135 6.339 639 HB2 MET 93 1HB MET 93 -12.596 1.043 5.039 640 HB3 MET 93 2HB MET 93 -14.138 0.273 4.707 641 HG2 MET 93 1HG MET 93 -14.112 1.021 2.500 642 HG3 MET 93 2HG MET 93 -13.162 2.466 2.882 643 HE1 MET 93 3HE MET 93 -11.211 -1.720 3.076 644 HE2 MET 93 1HE MET 93 -12.216 -1.028 4.361 645 HE3 MET 93 2HE MET 93 -12.955 -1.487 2.804 646 H GLN 94 H GLN 94 -11.849 2.632 5.913 647 HA GLN 94 HA GLN 94 -11.287 5.123 4.537 648 HB2 GLN 94 1HB GLN 94 -10.813 4.607 7.502 649 HB3 GLN 94 2HB GLN 94 -9.962 5.864 6.597 650 HG2 GLN 94 1HG GLN 94 -11.982 7.041 6.112 651 HG3 GLN 94 2HG GLN 94 -13.005 5.749 6.760 652 HE21 GLN 94 1HE2 GLN 94 -13.323 8.368 7.703 653 HE22 GLN 94 2HE2 GLN 94 -12.746 8.432 9.361 654 H TRP 95 H TRP 95 -8.943 5.265 4.286 655 HA TRP 95 HA TRP 95 -7.329 2.825 4.789 656 HB2 TRP 95 1HB TRP 95 -7.811 4.254 2.181 657 HB3 TRP 95 2HB TRP 95 -6.174 3.805 2.560 658 HD1 TRP 95 HD TRP 95 -8.589 1.155 3.704 659 HE1 TRP 95 1HE TRP 95 -8.545 -0.791 2.104 660 HE3 TRP 95 3HE TRP 95 -5.358 3.095 0.203 661 HZ2 TRP 95 2HZ TRP 95 -6.967 -1.606 -0.198 662 HZ3 TRP 95 3HZ TRP 95 -4.318 1.544 -1.421 663 HH2 TRP 95 HH TRP 95 -5.159 -0.793 -1.662 664 H VAL 96 H VAL 96 -5.818 3.594 6.256 665 HA VAL 96 HA VAL 96 -4.882 6.408 5.914 666 HB VAL 96 HB VAL 96 -3.988 4.682 8.213 667 HG11 VAL 96 1HG1 VAL 96 -4.426 7.676 7.875 668 HG12 VAL 96 2HG1 VAL 96 -3.709 6.862 9.282 669 HG13 VAL 96 3HG1 VAL 96 -2.862 6.832 7.730 670 HG21 VAL 96 3HG2 VAL 96 -6.600 6.256 8.124 671 HG22 VAL 96 1HG2 VAL 96 -6.405 4.512 8.453 672 HG23 VAL 96 2HG2 VAL 96 -5.805 5.694 9.613 673 H VAL 97 H VAL 97 -2.894 6.645 4.832 674 HA VAL 97 HA VAL 97 -1.290 4.238 4.303 675 HB VAL 97 HB VAL 97 -1.377 5.070 1.917 676 HG11 VAL 97 1HG1 VAL 97 -3.926 3.863 3.022 677 HG12 VAL 97 2HG1 VAL 97 -3.311 3.727 1.357 678 HG13 VAL 97 3HG1 VAL 97 -2.413 3.000 2.691 679 HG21 VAL 97 3HG2 VAL 97 -4.020 6.373 2.714 680 HG22 VAL 97 1HG2 VAL 97 -2.554 7.254 2.217 681 HG23 VAL 97 2HG2 VAL 97 -3.373 6.185 1.077 682 H THR 98 H THR 98 0.554 4.789 5.225 683 HA THR 98 HA THR 98 1.480 7.603 5.093 684 HB THR 98 HB THR 98 2.159 5.511 7.164 685 HG1 THR 98 1HG THR 98 0.249 5.687 7.990 686 HG21 THR 98 3HG2 THR 98 1.970 8.546 7.336 687 HG22 THR 98 1HG2 THR 98 3.477 7.601 7.255 688 HG23 THR 98 2HG2 THR 98 2.398 7.470 8.659 689 H VAL 99 H VAL 99 3.856 7.822 4.920 690 HA VAL 99 HA VAL 99 5.193 5.434 3.746 691 HB VAL 99 HB VAL 99 5.158 8.197 2.481 692 HG11 VAL 99 1HG1 VAL 99 6.423 5.588 1.587 693 HG12 VAL 99 2HG1 VAL 99 6.292 7.052 0.596 694 HG13 VAL 99 3HG1 VAL 99 7.228 7.113 2.082 695 HG21 VAL 99 3HG2 VAL 99 2.966 7.039 2.122 696 HG22 VAL 99 1HG2 VAL 99 3.893 7.130 0.628 697 HG23 VAL 99 2HG2 VAL 99 3.846 5.614 1.531 698 H TYR 100 H TYR 100 7.107 5.132 4.615 699 HA TYR 100 HA TYR 100 8.265 7.243 6.365 700 HB2 TYR 100 1HB TYR 100 7.979 4.239 6.757 701 HB3 TYR 100 2HB TYR 100 9.053 5.240 7.720 702 HD1 TYR 100 2HD TYR 100 8.103 7.091 9.156 703 HD2 TYR 100 1HD TYR 100 5.612 4.171 7.198 704 HE1 TYR 100 2HE TYR 100 6.228 7.681 10.676 705 HE2 TYR 100 1HE TYR 100 3.738 4.728 8.737 706 HH TYR 100 HH TYR 100 2.991 6.173 10.541 707 H LYS 101 H LYS 101 10.337 7.725 5.805 708 HA LYS 101 HA LYS 101 11.801 6.351 3.674 709 HB2 LYS 101 1HB LYS 101 11.544 8.835 3.874 710 HB3 LYS 101 2HB LYS 101 12.452 8.790 5.390 711 HG2 LYS 101 1HG LYS 101 14.469 8.533 4.346 712 HG3 LYS 101 2HG LYS 101 13.773 7.589 3.020 713 HD2 LYS 101 1HD LYS 101 12.845 9.620 2.031 714 HD3 LYS 101 2HD LYS 101 13.480 10.610 3.348 715 HE2 LYS 101 1HE LYS 101 15.399 8.844 1.826 716 HE3 LYS 101 2HE LYS 101 14.749 10.239 0.971 717 HZ1 LYS 101 3HZ LYS 101 16.857 10.662 2.199 718 HZ2 LYS 101 1HZ LYS 101 16.050 10.508 3.626 719 HZ3 LYS 101 2HZ LYS 101 15.626 11.676 2.577 720 H ASN 102 H ASN 102 14.396 6.723 4.683 721 HA ASN 102 HA ASN 102 14.900 4.561 6.498 722 HB2 ASN 102 1HB ASN 102 17.179 5.267 6.545 723 HB3 ASN 102 2HB ASN 102 16.592 4.995 4.924 724 HD21 ASN 102 1HD2 ASN 102 16.611 6.758 3.432 725 HD22 ASN 102 2HD2 ASN 102 17.334 8.303 3.878 726 H GLY 103 H GLY 103 13.534 5.106 8.115 727 HA2 GLY 103 1HA GLY 103 13.116 5.663 10.303 728 HA3 GLY 103 2HA GLY 103 14.719 6.393 10.372 729 H LYS 104 H LYS 104 12.115 7.603 8.163 730 HA LYS 104 HA LYS 104 11.135 9.465 10.157 731 HB2 LYS 104 1HB LYS 104 11.494 11.412 9.126 732 HB3 LYS 104 2HB LYS 104 13.055 10.606 9.117 733 HG2 LYS 104 1HG LYS 104 13.136 10.376 6.829 734 HG3 LYS 104 2HG LYS 104 11.366 10.394 6.614 735 HD2 LYS 104 1HD LYS 104 11.240 12.691 7.298 736 HD3 LYS 104 2HD LYS 104 12.983 12.724 7.593 737 HE2 LYS 104 1HE LYS 104 13.435 12.317 5.199 738 HE3 LYS 104 2HE LYS 104 11.698 12.175 4.875 739 HZ1 LYS 104 3HZ LYS 104 12.568 14.375 4.316 740 HZ2 LYS 104 1HZ LYS 104 13.061 14.587 5.857 741 HZ3 LYS 104 2HZ LYS 104 11.453 14.492 5.521 742 H GLU 105 H GLU 105 9.260 10.752 8.973 743 HA GLU 105 HA GLU 105 7.695 8.944 7.189 744 HB2 GLU 105 1HB GLU 105 6.728 9.678 9.338 745 HB3 GLU 105 2HB GLU 105 7.058 11.328 8.852 746 HG2 GLU 105 1HG GLU 105 5.398 10.931 6.917 747 HG3 GLU 105 2HG GLU 105 4.934 9.462 7.795 748 H ILE 106 H ILE 106 6.972 9.863 5.122 749 HA ILE 106 HA ILE 106 7.700 12.690 4.575 750 HB ILE 106 HB ILE 106 8.161 12.077 2.231 751 HG12 ILE 106 1HG1 ILE 106 8.151 9.179 3.213 752 HG13 ILE 106 2HG1 ILE 106 6.915 9.916 2.180 753 HG21 ILE 106 1HG2 ILE 106 9.996 10.671 4.212 754 HG22 ILE 106 2HG2 ILE 106 10.441 11.334 2.624 755 HG23 ILE 106 3HG2 ILE 106 9.934 12.425 3.920 756 HD11 ILE 106 3HD1 ILE 106 9.826 9.449 1.496 757 HD12 ILE 106 1HD1 ILE 106 8.403 8.683 0.775 758 HD13 ILE 106 2HD1 ILE 106 8.709 10.406 0.486 759 H GLU 107 H GLU 107 5.153 10.303 4.670 760 HA GLU 107 HA GLU 107 3.346 12.240 3.357 761 HB2 GLU 107 1HB GLU 107 4.041 10.314 1.777 762 HB3 GLU 107 2HB GLU 107 3.293 9.233 2.927 763 HG2 GLU 107 1HG GLU 107 1.893 9.798 0.907 764 HG3 GLU 107 2HG GLU 107 1.125 9.950 2.477 765 H LYS 108 H LYS 108 1.225 12.054 4.223 766 HA LYS 108 HA LYS 108 0.584 9.941 6.113 767 HB2 LYS 108 1HB LYS 108 1.739 11.888 7.442 768 HB3 LYS 108 2HB LYS 108 0.238 12.771 7.165 769 HG2 LYS 108 1HG LYS 108 -0.978 10.762 8.207 770 HG3 LYS 108 2HG LYS 108 0.607 10.068 8.521 771 HD2 LYS 108 1HD LYS 108 0.052 10.991 10.540 772 HD3 LYS 108 2HD LYS 108 1.115 12.223 9.881 773 HE2 LYS 108 1HE LYS 108 -1.884 12.429 9.394 774 HE3 LYS 108 2HE LYS 108 -1.290 12.710 11.023 775 HZ1 LYS 108 3HZ LYS 108 0.120 14.457 10.186 776 HZ2 LYS 108 1HZ LYS 108 -1.462 14.749 9.877 777 HZ3 LYS 108 2HZ LYS 108 -0.511 14.266 8.652 778 H LYS 109 H LYS 109 -0.416 10.069 3.670 779 HA LYS 109 HA LYS 109 -2.827 11.760 3.639 780 HB2 LYS 109 1HB LYS 109 -1.346 10.471 1.552 781 HB3 LYS 109 2HB LYS 109 -2.937 9.710 1.591 782 HG2 LYS 109 1HG LYS 109 -3.918 12.114 1.697 783 HG3 LYS 109 2HG LYS 109 -2.274 12.665 1.356 784 HD2 LYS 109 1HD LYS 109 -3.406 12.722 -0.696 785 HD3 LYS 109 2HD LYS 109 -2.328 11.334 -0.763 786 HE2 LYS 109 1HE LYS 109 -4.416 10.774 -1.791 787 HE3 LYS 109 2HE LYS 109 -4.239 9.821 -0.327 788 HZ1 LYS 109 3HZ LYS 109 -6.475 10.812 -0.717 789 HZ2 LYS 109 1HZ LYS 109 -5.866 12.297 -0.552 790 HZ3 LYS 109 2HZ LYS 109 -5.892 11.233 0.738 791 H SER 110 H SER 110 -4.957 10.674 3.171 792 HA SER 110 HA SER 110 -5.327 7.979 4.136 793 HB2 SER 110 1HB SER 110 -5.418 9.376 6.194 794 HB3 SER 110 2HB SER 110 -6.664 10.390 5.457 795 HG SER 110 HG SER 110 -8.096 8.851 5.757 796 H LEU 111 H LEU 111 -7.644 7.375 3.590 797 HA LEU 111 HA LEU 111 -9.015 9.066 1.571 798 HB2 LEU 111 1HB LEU 111 -8.694 6.063 1.370 799 HB3 LEU 111 2HB LEU 111 -9.419 7.136 0.188 800 HG LEU 111 HG LEU 111 -6.458 6.950 0.866 801 HD11 LEU 111 1HD1 LEU 111 -8.224 6.020 -1.414 802 HD12 LEU 111 2HD1 LEU 111 -7.188 5.033 -0.347 803 HD13 LEU 111 3HD1 LEU 111 -6.488 6.144 -1.575 804 HD21 LEU 111 3HD2 LEU 111 -7.552 8.403 -1.537 805 HD22 LEU 111 1HD2 LEU 111 -5.973 8.523 -0.773 806 HD23 LEU 111 2HD2 LEU 111 -7.407 9.263 -0.007 807 H VAL 112 H VAL 112 -11.321 7.945 1.185 808 HA VAL 112 HA VAL 112 -12.406 6.646 3.549 809 HB VAL 112 HB VAL 112 -12.153 8.923 4.212 810 HG11 VAL 112 1HG1 VAL 112 -12.184 10.091 2.045 811 HG12 VAL 112 2HG1 VAL 112 -13.936 9.894 1.974 812 HG13 VAL 112 3HG1 VAL 112 -13.183 10.836 3.282 813 HG21 VAL 112 3HG2 VAL 112 -15.086 8.315 3.791 814 HG22 VAL 112 1HG2 VAL 112 -14.064 7.624 5.049 815 HG23 VAL 112 2HG2 VAL 112 -14.374 9.367 5.037 816 H PHE 113 H PHE 113 -12.418 5.150 1.734 817 HA PHE 113 HA PHE 113 -14.148 5.473 -0.541 818 HB2 PHE 113 1HB PHE 113 -13.087 2.958 0.787 819 HB3 PHE 113 2HB PHE 113 -13.937 3.013 -0.742 820 HD1 PHE 113 1HD PHE 113 -12.796 5.044 -2.337 821 HD2 PHE 113 2HD PHE 113 -10.827 2.373 0.407 822 HE1 PHE 113 1HE PHE 113 -10.734 5.194 -3.670 823 HE2 PHE 113 2HE PHE 113 -8.716 2.640 -0.854 824 HZ PHE 113 HZ PHE 113 -8.664 4.013 -2.920 825 H ARG 114 H ARG 114 -16.304 5.447 -0.557 826 HA ARG 114 HA ARG 114 -17.792 3.719 1.346 827 HB2 ARG 114 1HB ARG 114 -18.675 6.548 0.603 828 HB3 ARG 114 2HB ARG 114 -19.450 5.431 1.728 829 HG2 ARG 114 1HG ARG 114 -17.135 5.524 2.989 830 HG3 ARG 114 2HG ARG 114 -16.879 6.983 2.051 831 HD2 ARG 114 1HD ARG 114 -18.764 8.072 3.040 832 HD3 ARG 114 2HD ARG 114 -19.379 6.560 3.723 833 HE ARG 114 HE ARG 114 -17.248 6.485 5.097 834 HH11 ARG 114 1HH1 ARG 114 -18.399 9.633 4.059 835 HH12 ARG 114 2HH1 ARG 114 -18.028 10.445 5.544 836 HH21 ARG 114 1HH2 ARG 114 -16.616 7.427 6.920 837 HH22 ARG 114 2HH2 ARG 114 -16.920 9.094 7.293 838 H ASP 115 H ASP 115 -20.016 3.423 0.657 839 HA ASP 115 HA ASP 115 -21.534 2.590 -0.692 840 HB2 ASP 115 1HB ASP 115 -21.081 5.253 -2.026 841 HB3 ASP 115 2HB ASP 115 -22.502 4.199 -2.175 842 H GLY 116 H GLY 116 -20.538 0.770 -1.315 843 HA2 GLY 116 1HA GLY 116 -19.140 0.049 -3.564 844 HA3 GLY 116 2HA GLY 116 -20.401 -0.828 -2.667 845 H LYS 117 H LYS 117 -20.288 1.870 -4.920 846 HA LYS 117 HA LYS 117 -22.161 0.422 -6.749 847 HB2 LYS 117 1HB LYS 117 -21.785 3.437 -6.417 848 HB3 LYS 117 2HB LYS 117 -22.973 2.653 -7.438 849 HG2 LYS 117 1HG LYS 117 -22.902 2.571 -4.397 850 HG3 LYS 117 2HG LYS 117 -24.014 3.503 -5.388 851 HD2 LYS 117 1HD LYS 117 -25.085 1.526 -6.249 852 HD3 LYS 117 2HD LYS 117 -23.888 0.464 -5.538 853 HE2 LYS 117 1HE LYS 117 -24.399 1.312 -3.257 854 HE3 LYS 117 2HE LYS 117 -25.737 2.255 -3.937 855 HZ1 LYS 117 3HZ LYS 117 -26.750 0.205 -4.623 856 HZ2 LYS 117 1HZ LYS 117 -26.429 0.162 -3.001 857 HZ3 LYS 117 2HZ LYS 117 -25.488 -0.687 -4.053 858 H GLU 118 H GLU 118 -21.955 1.425 -9.030 859 HA GLU 118 HA GLU 118 -19.262 0.870 -9.972 860 HB2 GLU 118 1HB GLU 118 -21.803 1.949 -11.234 861 HB3 GLU 118 2HB GLU 118 -20.284 2.075 -12.107 862 HG2 GLU 118 1HG GLU 118 -19.957 -0.316 -12.090 863 HG3 GLU 118 2HG GLU 118 -21.382 -0.556 -11.063 864 H ILE 119 H ILE 119 -17.622 2.165 -9.419 865 HA ILE 119 HA ILE 119 -17.677 5.037 -10.047 866 HB ILE 119 HB ILE 119 -16.655 5.619 -7.962 867 HG12 ILE 119 1HG1 ILE 119 -16.984 3.647 -6.125 868 HG13 ILE 119 2HG1 ILE 119 -16.635 2.656 -7.519 869 HG21 ILE 119 1HG2 ILE 119 -18.503 5.504 -6.453 870 HG22 ILE 119 2HG2 ILE 119 -19.172 5.631 -8.086 871 HG23 ILE 119 3HG2 ILE 119 -19.169 4.072 -7.255 872 HD11 ILE 119 3HD1 ILE 119 -14.628 3.269 -6.137 873 HD12 ILE 119 1HD1 ILE 119 -14.495 3.687 -7.846 874 HD13 ILE 119 2HD1 ILE 119 -14.867 4.960 -6.682 875 H SER 120 H SER 120 -15.433 5.880 -10.147 876 HA SER 120 HA SER 120 -13.230 4.118 -9.724 877 HB2 SER 120 1HB SER 120 -12.172 4.623 -11.955 878 HB3 SER 120 2HB SER 120 -13.484 3.439 -12.003 879 HG SER 120 HG SER 120 -14.469 4.654 -13.346 880 H THR 121 H THR 121 -11.510 5.436 -8.982 881 HA THR 121 HA THR 121 -11.343 8.217 -9.870 882 HB THR 121 HB THR 121 -10.932 9.023 -7.525 883 HG1 THR 121 1HG THR 121 -11.455 7.794 -5.819 884 HG21 THR 121 3HG2 THR 121 -13.198 9.355 -6.842 885 HG22 THR 121 1HG2 THR 121 -13.766 7.954 -7.758 886 HG23 THR 121 2HG2 THR 121 -13.172 9.402 -8.610 887 H ASP 122 H ASP 122 -9.238 9.177 -9.274 888 HA ASP 122 HA ASP 122 -7.110 7.135 -9.205 889 HB2 ASP 122 1HB ASP 122 -7.103 10.043 -10.018 890 HB3 ASP 122 2HB ASP 122 -5.615 9.161 -9.670 891 H ASP 123 H ASP 123 -8.663 7.294 -6.982 892 HA ASP 123 HA ASP 123 -8.070 9.061 -4.878 893 HB2 ASP 123 1HB ASP 123 -9.390 6.462 -5.246 894 HB3 ASP 123 2HB ASP 123 -8.423 6.447 -3.799 895 H LEU 124 H LEU 124 -6.367 6.112 -5.929 896 HA LEU 124 HA LEU 124 -4.222 6.692 -3.952 897 HB2 LEU 124 1HB LEU 124 -5.585 4.269 -4.198 898 HB3 LEU 124 2HB LEU 124 -4.239 4.047 -5.231 899 HG LEU 124 HG LEU 124 -3.637 3.199 -3.078 900 HD11 LEU 124 1HD1 LEU 124 -1.670 4.419 -2.453 901 HD12 LEU 124 2HD1 LEU 124 -2.173 5.850 -3.367 902 HD13 LEU 124 3HD1 LEU 124 -1.801 4.331 -4.211 903 HD21 LEU 124 3HD2 LEU 124 -4.255 5.920 -1.937 904 HD22 LEU 124 1HD2 LEU 124 -3.557 4.551 -1.052 905 HD23 LEU 124 2HD2 LEU 124 -5.194 4.414 -1.712 906 H ASN 125 H ASN 125 -2.815 7.868 -5.009 907 HA ASN 125 HA ASN 125 -1.526 6.841 -7.382 908 HB2 ASN 125 1HB ASN 125 -3.731 8.047 -8.227 909 HB3 ASN 125 2HB ASN 125 -2.823 9.521 -7.989 910 HD21 ASN 125 1HD2 ASN 125 -0.542 9.529 -9.091 911 HD22 ASN 125 2HD2 ASN 125 -0.405 8.649 -10.603 912 H LEU 126 H LEU 126 0.338 7.006 -6.072 913 HA LEU 126 HA LEU 126 1.343 9.751 -5.519 914 HB2 LEU 126 1HB LEU 126 1.438 7.321 -3.695 915 HB3 LEU 126 2HB LEU 126 2.236 8.853 -3.374 916 HG LEU 126 HG LEU 126 -0.793 8.506 -3.584 917 HD11 LEU 126 1HD1 LEU 126 -0.778 8.675 -1.133 918 HD12 LEU 126 2HD1 LEU 126 1.003 8.720 -1.147 919 HD13 LEU 126 3HD1 LEU 126 0.141 7.264 -1.687 920 HD21 LEU 126 3HD2 LEU 126 -0.079 10.843 -4.028 921 HD22 LEU 126 1HD2 LEU 126 0.865 10.850 -2.527 922 HD23 LEU 126 2HD2 LEU 126 -0.907 10.713 -2.470 923 H TYR 127 H TYR 127 3.627 9.908 -5.534 924 HA TYR 127 HA TYR 127 5.237 7.616 -6.521 925 HB2 TYR 127 1HB TYR 127 4.683 10.220 -7.977 926 HB3 TYR 127 2HB TYR 127 6.204 9.381 -8.188 927 HD1 TYR 127 1HD TYR 127 2.529 9.098 -8.720 928 HD2 TYR 127 2HD TYR 127 6.395 7.320 -9.421 929 HE1 TYR 127 1HE TYR 127 1.494 7.466 -10.258 930 HE2 TYR 127 2HE TYR 127 5.374 5.707 -10.990 931 HH TYR 127 HH TYR 127 2.011 5.861 -12.064 932 H TYR 128 H TYR 128 7.450 7.816 -6.004 933 HA TYR 128 HA TYR 128 8.487 10.294 -4.899 934 HB2 TYR 128 1HB TYR 128 8.473 7.651 -3.370 935 HB3 TYR 128 2HB TYR 128 9.566 8.962 -3.015 936 HD1 TYR 128 2HD TYR 128 8.433 11.368 -2.774 937 HD2 TYR 128 1HD TYR 128 6.571 7.574 -1.914 938 HE1 TYR 128 2HE TYR 128 6.705 12.522 -1.442 939 HE2 TYR 128 1HE TYR 128 4.796 8.755 -0.618 940 HH TYR 128 HH TYR 128 4.810 12.329 -0.227 941 H ASN 129 H ASN 129 10.755 10.282 -4.868 942 HA ASN 129 HA ASN 129 12.233 8.098 -6.025 943 HB2 ASN 129 1HB ASN 129 13.357 9.387 -7.699 944 HB3 ASN 129 2HB ASN 129 11.625 9.432 -8.027 945 HD21 ASN 129 1HD2 ASN 129 14.460 11.379 -7.509 946 HD22 ASN 129 2HD2 ASN 129 13.634 12.917 -7.341 Start of MODEL 15 1 H1 GLY 1 H GLY 1 17.172 -13.196 -0.885 2 HA2 GLY 1 1HA GLY 1 19.421 -13.136 0.143 3 HA3 GLY 1 2HA GLY 1 19.058 -11.646 -0.764 4 H ASP 2 H ASP 2 20.414 -12.611 2.024 5 HA ASP 2 HA ASP 2 19.102 -10.711 3.873 6 HB2 ASP 2 1HB ASP 2 19.712 -12.904 4.705 7 HB3 ASP 2 2HB ASP 2 21.377 -12.686 4.180 8 H ASP 3 H ASP 3 22.625 -11.234 3.299 9 HA ASP 3 HA ASP 3 22.986 -8.379 2.708 10 HB2 ASP 3 1HB ASP 3 22.634 -8.333 5.095 11 HB3 ASP 3 2HB ASP 3 23.678 -9.726 5.351 12 H ASP 4 H ASP 4 24.715 -8.227 1.446 13 HA ASP 4 HA ASP 4 26.697 -10.465 1.326 14 HB2 ASP 4 1HB ASP 4 25.511 -9.120 -1.140 15 HB3 ASP 4 2HB ASP 4 26.570 -10.504 -1.052 16 H GLU 5 H GLU 5 26.363 -7.623 -0.801 17 HA GLU 5 HA GLU 5 28.423 -6.014 0.463 18 HB2 GLU 5 1HB GLU 5 29.752 -7.782 -0.669 19 HB3 GLU 5 2HB GLU 5 28.872 -7.491 -2.163 20 HG2 GLU 5 1HG GLU 5 29.849 -4.980 -1.732 21 HG3 GLU 5 2HG GLU 5 31.046 -5.890 -0.780 22 HA PRO 6 HA PRO 6 25.319 -3.839 -2.332 23 HB2 PRO 6 1HB PRO 6 24.179 -2.163 -0.529 24 HB3 PRO 6 2HB PRO 6 23.675 -3.874 -0.659 25 HG2 PRO 6 1HG PRO 6 25.712 -2.693 1.261 26 HG3 PRO 6 2HG PRO 6 24.270 -3.673 1.683 27 HD2 PRO 6 1HD PRO 6 26.750 -4.765 1.404 28 HD3 PRO 6 2HD PRO 6 25.292 -5.638 0.832 29 H GLY 7 H GLY 7 25.342 -1.366 -2.751 30 HA2 GLY 7 1HA GLY 7 26.903 0.515 -1.469 31 HA3 GLY 7 2HA GLY 7 28.018 -0.299 -2.579 32 H GLY 8 H GLY 8 24.975 1.588 -2.375 33 HA2 GLY 8 1HA GLY 8 25.529 2.883 -4.886 34 HA3 GLY 8 2HA GLY 8 24.100 1.832 -4.942 35 H LYS 9 H LYS 9 23.686 4.581 -5.272 36 HA LYS 9 HA LYS 9 22.880 5.620 -2.630 37 HB2 LYS 9 1HB LYS 9 22.973 7.846 -3.726 38 HB3 LYS 9 2HB LYS 9 24.514 7.047 -3.452 39 HG2 LYS 9 1HG LYS 9 24.777 6.496 -5.779 40 HG3 LYS 9 2HG LYS 9 23.137 7.028 -6.179 41 HD2 LYS 9 1HD LYS 9 25.168 8.914 -4.962 42 HD3 LYS 9 2HD LYS 9 25.101 8.628 -6.704 43 HE2 LYS 9 1HE LYS 9 22.944 9.563 -6.943 44 HE3 LYS 9 2HE LYS 9 22.570 9.407 -5.219 45 HZ1 LYS 9 3HZ LYS 9 23.110 11.704 -5.909 46 HZ2 LYS 9 1HZ LYS 9 24.678 11.225 -6.189 47 HZ3 LYS 9 2HZ LYS 9 24.042 11.112 -4.699 48 H GLY 10 H GLY 10 20.932 5.580 -2.280 49 HA2 GLY 10 1HA GLY 10 18.974 6.957 -3.856 50 HA3 GLY 10 2HA GLY 10 18.534 5.257 -3.656 51 H ALA 11 H ALA 11 17.234 4.904 -1.764 52 HA ALA 11 HA ALA 11 17.802 6.307 0.738 53 HB1 ALA 11 1HB ALA 11 15.566 7.391 0.840 54 HB2 ALA 11 2HB ALA 11 16.554 8.068 -0.467 55 HB3 ALA 11 3HB ALA 11 15.258 6.908 -0.837 56 H MET 12 H MET 12 16.175 5.562 2.403 57 HA MET 12 HA MET 12 14.634 3.141 1.649 58 HB2 MET 12 1HB MET 12 15.525 3.920 4.447 59 HB3 MET 12 2HB MET 12 14.539 2.523 4.007 60 HG2 MET 12 1HG MET 12 16.560 2.066 2.357 61 HG3 MET 12 2HG MET 12 17.389 3.010 3.559 62 HE1 MET 12 3HE MET 12 14.595 0.212 3.593 63 HE2 MET 12 1HE MET 12 15.900 -0.394 2.544 64 HE3 MET 12 2HE MET 12 15.548 -1.202 4.091 65 H TYR 13 H TYR 13 12.757 2.805 2.837 66 HA TYR 13 HA TYR 13 10.988 4.669 3.842 67 HB2 TYR 13 1HB TYR 13 9.602 4.386 1.542 68 HB3 TYR 13 2HB TYR 13 10.564 5.790 1.968 69 HD1 TYR 13 2HD TYR 13 11.838 2.491 0.600 70 HD2 TYR 13 1HD TYR 13 11.065 6.675 -0.133 71 HE1 TYR 13 2HE TYR 13 13.487 2.493 -1.231 72 HE2 TYR 13 1HE TYR 13 12.674 6.647 -2.028 73 HH TYR 13 HH TYR 13 15.038 4.204 -2.241 74 H GLU 14 H GLU 14 8.883 3.757 4.076 75 HA GLU 14 HA GLU 14 8.403 0.926 3.594 76 HB2 GLU 14 1HB GLU 14 9.554 0.748 5.703 77 HB3 GLU 14 2HB GLU 14 8.730 2.145 6.373 78 HG2 GLU 14 1HG GLU 14 6.624 0.952 6.517 79 HG3 GLU 14 2HG GLU 14 7.280 -0.418 5.627 80 H VAL 15 H VAL 15 6.083 0.685 3.520 81 HA VAL 15 HA VAL 15 4.397 3.085 4.089 82 HB VAL 15 HB VAL 15 4.722 2.817 1.683 83 HG11 VAL 15 1HG1 VAL 15 4.021 0.902 0.432 84 HG12 VAL 15 2HG1 VAL 15 5.186 0.332 1.622 85 HG13 VAL 15 3HG1 VAL 15 3.454 0.057 1.883 86 HG21 VAL 15 3HG2 VAL 15 1.925 1.921 2.490 87 HG22 VAL 15 1HG2 VAL 15 2.513 3.594 2.386 88 HG23 VAL 15 2HG2 VAL 15 2.383 2.603 0.935 89 H THR 16 H THR 16 2.394 2.698 5.029 90 HA THR 16 HA THR 16 1.733 -0.086 5.789 91 HB THR 16 HB THR 16 0.842 1.128 7.949 92 HG1 THR 16 1HG THR 16 1.325 3.245 7.477 93 HG21 THR 16 3HG2 THR 16 3.828 0.683 7.577 94 HG22 THR 16 1HG2 THR 16 2.589 -0.540 7.986 95 HG23 THR 16 2HG2 THR 16 2.966 0.761 9.133 96 H ILE 17 H ILE 17 -0.074 -0.566 4.951 97 HA ILE 17 HA ILE 17 -2.032 1.644 4.479 98 HB ILE 17 HB ILE 17 -1.702 -0.217 2.844 99 HG12 ILE 17 1HG1 ILE 17 -4.597 -0.474 3.393 100 HG13 ILE 17 2HG1 ILE 17 -4.070 1.167 3.706 101 HG21 ILE 17 1HG2 ILE 17 -3.337 -1.900 4.780 102 HG22 ILE 17 2HG2 ILE 17 -2.823 -2.333 3.136 103 HG23 ILE 17 3HG2 ILE 17 -1.614 -2.070 4.409 104 HD11 ILE 17 3HD1 ILE 17 -4.718 1.018 1.445 105 HD12 ILE 17 1HD1 ILE 17 -2.960 1.215 1.481 106 HD13 ILE 17 2HD1 ILE 17 -3.673 -0.396 1.148 107 H GLU 18 H GLU 18 -3.786 1.810 5.795 108 HA GLU 18 HA GLU 18 -4.281 -0.275 7.784 109 HB2 GLU 18 1HB GLU 18 -4.037 2.642 8.510 110 HB3 GLU 18 2HB GLU 18 -5.399 1.712 9.145 111 HG2 GLU 18 1HG GLU 18 -3.374 -0.024 9.693 112 HG3 GLU 18 2HG GLU 18 -2.490 1.501 9.798 113 H GLN 19 H GLN 19 -6.155 -1.075 7.266 114 HA GLN 19 HA GLN 19 -8.003 0.444 5.498 115 HB2 GLN 19 1HB GLN 19 -7.776 -2.538 6.109 116 HB3 GLN 19 2HB GLN 19 -9.051 -1.741 5.174 117 HG2 GLN 19 1HG GLN 19 -7.187 -0.814 3.661 118 HG3 GLN 19 2HG GLN 19 -6.077 -1.903 4.506 119 HE21 GLN 19 1HE2 GLN 19 -7.018 -4.280 4.711 120 HE22 GLN 19 2HE2 GLN 19 -7.639 -4.941 3.249 121 H SER 20 H SER 20 -9.386 1.525 6.762 122 HA SER 20 HA SER 20 -10.113 0.371 9.345 123 HB2 SER 20 1HB SER 20 -11.087 2.947 8.016 124 HB3 SER 20 2HB SER 20 -11.336 2.516 9.711 125 HG SER 20 HG SER 20 -9.038 2.537 9.959 126 H GLY 21 H GLY 21 -12.359 0.021 9.932 127 HA2 GLY 21 1HA GLY 21 -14.593 -0.285 9.557 128 HA3 GLY 21 2HA GLY 21 -14.385 0.275 7.885 129 H ASP 22 H ASP 22 -15.486 -1.315 6.769 130 HA ASP 22 HA ASP 22 -14.847 -4.161 7.220 131 HB2 ASP 22 1HB ASP 22 -17.201 -3.805 6.813 132 HB3 ASP 22 2HB ASP 22 -16.849 -2.893 5.340 133 H PHE 23 H PHE 23 -13.334 -5.057 5.932 134 HA PHE 23 HA PHE 23 -12.576 -3.768 3.367 135 HB2 PHE 23 1HB PHE 23 -10.141 -4.232 3.943 136 HB3 PHE 23 2HB PHE 23 -10.929 -2.890 4.754 137 HD1 PHE 23 1HD PHE 23 -10.025 -6.509 5.325 138 HD2 PHE 23 2HD PHE 23 -10.851 -2.648 7.072 139 HE1 PHE 23 1HE PHE 23 -9.493 -7.400 7.572 140 HE2 PHE 23 2HE PHE 23 -10.243 -3.516 9.298 141 HZ PHE 23 HZ PHE 23 -9.589 -5.906 9.571 142 H ARG 24 H ARG 24 -14.146 -6.260 4.359 143 HA ARG 24 HA ARG 24 -12.497 -8.422 3.097 144 HB2 ARG 24 1HB ARG 24 -14.595 -8.515 5.291 145 HB3 ARG 24 2HB ARG 24 -13.636 -9.886 4.717 146 HG2 ARG 24 1HG ARG 24 -11.584 -8.894 5.642 147 HG3 ARG 24 2HG ARG 24 -12.490 -7.442 6.146 148 HD2 ARG 24 1HD ARG 24 -14.001 -8.879 7.498 149 HD3 ARG 24 2HD ARG 24 -13.011 -10.266 7.111 150 HE ARG 24 HE ARG 24 -11.124 -9.173 8.261 151 HH11 ARG 24 1HH1 ARG 24 -14.438 -8.124 9.125 152 HH12 ARG 24 2HH1 ARG 24 -13.968 -7.622 10.713 153 HH21 ARG 24 1HH2 ARG 24 -10.539 -8.093 10.273 154 HH22 ARG 24 2HH2 ARG 24 -11.847 -7.506 11.296 155 H SER 25 H SER 25 -14.201 -6.727 1.532 156 HA SER 25 HA SER 25 -16.297 -8.586 0.614 157 HB2 SER 25 1HB SER 25 -17.161 -7.016 2.442 158 HB3 SER 25 2HB SER 25 -16.859 -5.669 1.341 159 HG SER 25 HG SER 25 -18.524 -6.162 0.227 160 H PHE 26 H PHE 26 -13.589 -6.985 -0.480 161 HA PHE 26 HA PHE 26 -15.039 -5.029 -2.183 162 HB2 PHE 26 1HB PHE 26 -12.441 -4.680 -0.629 163 HB3 PHE 26 2HB PHE 26 -12.924 -3.682 -1.974 164 HD1 PHE 26 2HD PHE 26 -14.417 -4.855 1.312 165 HD2 PHE 26 1HD PHE 26 -13.967 -1.639 -1.512 166 HE1 PHE 26 2HE PHE 26 -15.788 -3.398 2.745 167 HE2 PHE 26 1HE PHE 26 -15.281 -0.157 -0.025 168 HZ PHE 26 HZ PHE 26 -16.206 -1.054 2.112 169 H ILE 27 H ILE 27 -13.534 -4.446 -4.100 170 HA ILE 27 HA ILE 27 -12.242 -6.941 -5.080 171 HB ILE 27 HB ILE 27 -14.326 -5.201 -6.479 172 HG12 ILE 27 1HG1 ILE 27 -15.461 -7.725 -6.456 173 HG13 ILE 27 2HG1 ILE 27 -14.641 -7.735 -4.910 174 HG21 ILE 27 1HG2 ILE 27 -12.716 -6.205 -8.098 175 HG22 ILE 27 2HG2 ILE 27 -13.035 -7.817 -7.416 176 HG23 ILE 27 3HG2 ILE 27 -14.312 -6.929 -8.273 177 HD11 ILE 27 3HD1 ILE 27 -15.849 -5.559 -4.360 178 HD12 ILE 27 1HD1 ILE 27 -16.684 -5.711 -5.923 179 HD13 ILE 27 2HD1 ILE 27 -16.930 -6.926 -4.653 180 H LYS 28 H LYS 28 -10.090 -6.047 -5.143 181 HA LYS 28 HA LYS 28 -9.174 -4.685 -7.282 182 HB2 LYS 28 1HB LYS 28 -10.337 -2.669 -5.600 183 HB3 LYS 28 2HB LYS 28 -8.658 -2.509 -5.508 184 HG2 LYS 28 1HG LYS 28 -9.482 -1.116 -7.272 185 HG3 LYS 28 2HG LYS 28 -8.385 -2.317 -7.912 186 HD2 LYS 28 1HD LYS 28 -10.358 -3.484 -8.908 187 HD3 LYS 28 2HD LYS 28 -11.424 -2.255 -8.157 188 HE2 LYS 28 1HE LYS 28 -10.173 -0.451 -9.307 189 HE3 LYS 28 2HE LYS 28 -9.135 -1.643 -10.082 190 HZ1 LYS 28 3HZ LYS 28 -10.889 -0.828 -11.493 191 HZ2 LYS 28 1HZ LYS 28 -12.052 -1.438 -10.510 192 HZ3 LYS 28 2HZ LYS 28 -10.998 -2.441 -11.320 193 H SER 29 H SER 29 -7.046 -3.120 -5.774 194 HA SER 29 HA SER 29 -5.492 -5.070 -4.431 195 HB2 SER 29 1HB SER 29 -4.838 -4.374 -7.297 196 HB3 SER 29 2HB SER 29 -3.745 -5.217 -6.224 197 HG SER 29 HG SER 29 -6.165 -6.410 -6.225 198 H VAL 30 H VAL 30 -3.174 -4.222 -4.301 199 HA VAL 30 HA VAL 30 -3.021 -1.254 -4.529 200 HB VAL 30 HB VAL 30 -1.428 -2.917 -2.553 201 HG11 VAL 30 1HG1 VAL 30 -1.158 -0.732 -1.413 202 HG12 VAL 30 2HG1 VAL 30 -0.633 -0.579 -3.085 203 HG13 VAL 30 3HG1 VAL 30 -2.217 0.052 -2.605 204 HG21 VAL 30 3HG2 VAL 30 -4.091 -1.526 -2.028 205 HG22 VAL 30 1HG2 VAL 30 -3.763 -3.259 -1.881 206 HG23 VAL 30 2HG2 VAL 30 -2.988 -2.116 -0.775 207 H VAL 31 H VAL 31 -1.081 -0.487 -5.442 208 HA VAL 31 HA VAL 31 0.487 -2.417 -7.040 209 HB VAL 31 HB VAL 31 0.234 0.624 -7.181 210 HG11 VAL 31 1HG1 VAL 31 2.245 -0.113 -8.315 211 HG12 VAL 31 2HG1 VAL 31 1.347 -1.339 -9.220 212 HG13 VAL 31 3HG1 VAL 31 1.063 0.393 -9.509 213 HG21 VAL 31 3HG2 VAL 31 -1.990 -0.261 -7.654 214 HG22 VAL 31 1HG2 VAL 31 -1.263 0.325 -9.148 215 HG23 VAL 31 2HG2 VAL 31 -1.332 -1.415 -8.809 216 H VAL 32 H VAL 32 2.865 -2.417 -6.796 217 HA VAL 32 HA VAL 32 4.014 -0.138 -5.399 218 HB VAL 32 HB VAL 32 3.825 -1.597 -3.649 219 HG11 VAL 32 1HG1 VAL 32 4.755 -3.918 -3.601 220 HG12 VAL 32 2HG1 VAL 32 3.316 -3.683 -4.598 221 HG13 VAL 32 3HG1 VAL 32 4.908 -3.785 -5.378 222 HG21 VAL 32 3HG2 VAL 32 6.068 -1.913 -2.904 223 HG22 VAL 32 1HG2 VAL 32 6.684 -2.103 -4.560 224 HG23 VAL 32 2HG2 VAL 32 6.120 -0.521 -3.990 225 H VAL 33 H VAL 33 6.034 0.436 -6.147 226 HA VAL 33 HA VAL 33 7.539 -1.379 -7.875 227 HB VAL 33 HB VAL 33 7.210 1.579 -8.542 228 HG11 VAL 33 1HG1 VAL 33 8.313 0.875 -10.691 229 HG12 VAL 33 2HG1 VAL 33 9.344 0.707 -9.277 230 HG13 VAL 33 3HG1 VAL 33 8.583 -0.730 -9.993 231 HG21 VAL 33 3HG2 VAL 33 5.067 0.642 -9.076 232 HG22 VAL 33 1HG2 VAL 33 5.952 0.853 -10.584 233 HG23 VAL 33 2HG2 VAL 33 5.799 -0.764 -9.872 234 H ALA 34 H ALA 34 9.724 -1.317 -7.198 235 HA ALA 34 HA ALA 34 10.657 1.015 -5.668 236 HB1 ALA 34 1HB ALA 34 9.989 -0.651 -3.988 237 HB2 ALA 34 2HB ALA 34 11.039 -1.866 -4.760 238 HB3 ALA 34 3HB ALA 34 11.746 -0.411 -4.017 239 H ASN 35 H ASN 35 12.143 1.746 -6.976 240 HA ASN 35 HA ASN 35 13.424 0.362 -9.109 241 HB2 ASN 35 1HB ASN 35 13.072 2.827 -8.964 242 HB3 ASN 35 2HB ASN 35 14.259 2.903 -7.653 243 HD21 ASN 35 1HD2 ASN 35 14.392 4.406 -10.095 244 HD22 ASN 35 2HD2 ASN 35 15.841 3.889 -10.918 245 H GLY 36 H GLY 36 14.875 -1.339 -8.816 246 HA2 GLY 36 1HA GLY 36 16.979 -2.132 -8.462 247 HA3 GLY 36 2HA GLY 36 17.370 -0.619 -7.644 248 H THR 37 H THR 37 14.785 -2.873 -6.501 249 HA THR 37 HA THR 37 16.584 -4.217 -4.672 250 HB THR 37 HB THR 37 16.211 -1.995 -3.589 251 HG1 THR 37 1HG THR 37 15.830 -2.800 -1.637 252 HG21 THR 37 3HG2 THR 37 14.025 -1.619 -2.529 253 HG22 THR 37 1HG2 THR 37 13.320 -2.950 -3.437 254 HG23 THR 37 2HG2 THR 37 13.936 -1.543 -4.312 255 H GLN 38 H GLN 38 14.816 -5.275 -2.937 256 HA GLN 38 HA GLN 38 12.415 -6.204 -4.375 257 HB2 GLN 38 1HB GLN 38 14.222 -7.784 -2.486 258 HB3 GLN 38 2HB GLN 38 12.543 -8.197 -2.741 259 HG2 GLN 38 1HG GLN 38 13.398 -9.495 -4.405 260 HG3 GLN 38 2HG GLN 38 13.140 -8.017 -5.307 261 HE21 GLN 38 1HE2 GLN 38 14.748 -8.385 -6.892 262 HE22 GLN 38 2HE2 GLN 38 16.451 -8.385 -6.461 263 H LEU 39 H LEU 39 10.750 -6.809 -2.800 264 HA LEU 39 HA LEU 39 10.327 -4.705 -0.748 265 HB2 LEU 39 1HB LEU 39 8.692 -5.954 -2.901 266 HB3 LEU 39 2HB LEU 39 7.911 -6.062 -1.351 267 HG LEU 39 HG LEU 39 7.373 -4.114 -2.908 268 HD11 LEU 39 1HD1 LEU 39 6.500 -4.268 -0.681 269 HD12 LEU 39 2HD1 LEU 39 6.999 -2.589 -0.963 270 HD13 LEU 39 3HD1 LEU 39 8.004 -3.658 0.027 271 HD21 LEU 39 3HD2 LEU 39 9.804 -3.474 -3.274 272 HD22 LEU 39 1HD2 LEU 39 9.784 -2.816 -1.616 273 HD23 LEU 39 2HD2 LEU 39 8.689 -2.162 -2.855 274 H LYS 40 H LYS 40 8.955 -5.545 1.078 275 HA LYS 40 HA LYS 40 9.521 -8.368 1.817 276 HB2 LYS 40 1HB LYS 40 11.000 -6.637 2.943 277 HB3 LYS 40 2HB LYS 40 9.545 -5.896 3.602 278 HG2 LYS 40 1HG LYS 40 9.055 -8.246 4.628 279 HG3 LYS 40 2HG LYS 40 10.733 -8.635 4.194 280 HD2 LYS 40 1HD LYS 40 11.461 -6.614 5.542 281 HD3 LYS 40 2HD LYS 40 9.760 -6.307 5.933 282 HE2 LYS 40 1HE LYS 40 9.720 -8.673 6.953 283 HE3 LYS 40 2HE LYS 40 11.489 -8.641 6.813 284 HZ1 LYS 40 3HZ LYS 40 11.107 -7.791 8.924 285 HZ2 LYS 40 1HZ LYS 40 9.720 -7.008 8.494 286 HZ3 LYS 40 2HZ LYS 40 11.169 -6.388 8.085 287 H ASP 41 H ASP 41 7.670 -9.375 2.444 288 HA ASP 41 HA ASP 41 5.140 -7.883 2.922 289 HB2 ASP 41 1HB ASP 41 5.076 -10.092 1.712 290 HB3 ASP 41 2HB ASP 41 5.722 -10.846 3.152 291 H GLY 42 H GLY 42 4.932 -6.981 4.985 292 HA2 GLY 42 1HA GLY 42 6.629 -7.716 7.164 293 HA3 GLY 42 2HA GLY 42 5.213 -6.665 7.225 294 H ALA 43 H ALA 43 3.804 -9.346 5.991 295 HA ALA 43 HA ALA 43 2.602 -10.174 8.444 296 HB1 ALA 43 1HB ALA 43 2.690 -11.594 5.735 297 HB2 ALA 43 2HB ALA 43 1.596 -11.966 7.073 298 HB3 ALA 43 3HB ALA 43 1.470 -10.409 6.247 299 H THR 44 H THR 44 4.937 -11.875 6.275 300 HA THR 44 HA THR 44 5.763 -13.606 8.534 301 HB THR 44 HB THR 44 6.184 -15.093 6.277 302 HG1 THR 44 1HG THR 44 4.430 -14.853 4.935 303 HG21 THR 44 3HG2 THR 44 4.977 -15.755 8.328 304 HG22 THR 44 1HG2 THR 44 4.111 -16.260 6.862 305 HG23 THR 44 2HG2 THR 44 3.542 -14.842 7.783 306 H GLY 45 H GLY 45 6.891 -11.195 6.378 307 HA2 GLY 45 1HA GLY 45 8.961 -10.382 6.091 308 HA3 GLY 45 2HA GLY 45 9.641 -11.648 7.145 309 H GLU 46 H GLU 46 7.814 -11.491 4.043 310 HA GLU 46 HA GLU 46 9.540 -13.615 2.858 311 HB2 GLU 46 1HB GLU 46 6.830 -12.511 2.043 312 HB3 GLU 46 2HB GLU 46 7.697 -13.785 1.196 313 HG2 GLU 46 1HG GLU 46 6.938 -14.074 4.140 314 HG3 GLU 46 2HG GLU 46 5.795 -14.382 2.855 315 H SER 47 H SER 47 11.020 -12.883 1.276 316 HA SER 47 HA SER 47 11.070 -10.106 0.469 317 HB2 SER 47 1HB SER 47 13.085 -11.341 0.642 318 HB3 SER 47 2HB SER 47 12.542 -12.599 -0.489 319 HG SER 47 HG SER 47 13.292 -11.431 -2.044 320 H LEU 48 H LEU 48 10.466 -9.287 -1.453 321 HA LEU 48 HA LEU 48 8.751 -10.908 -3.315 322 HB2 LEU 48 1HB LEU 48 8.133 -8.108 -2.360 323 HB3 LEU 48 2HB LEU 48 7.084 -9.173 -3.288 324 HG LEU 48 HG LEU 48 7.919 -9.586 -0.386 325 HD11 LEU 48 1HD1 LEU 48 6.611 -7.647 -0.501 326 HD12 LEU 48 2HD1 LEU 48 5.490 -8.918 -0.008 327 HD13 LEU 48 3HD1 LEU 48 5.493 -8.363 -1.686 328 HD21 LEU 48 3HD2 LEU 48 6.527 -11.444 -0.284 329 HD22 LEU 48 1HD2 LEU 48 7.210 -11.632 -1.914 330 HD23 LEU 48 2HD2 LEU 48 5.580 -10.962 -1.688 331 H ALA 49 H ALA 49 8.889 -10.484 -5.349 332 HA ALA 49 HA ALA 49 11.107 -8.640 -6.200 333 HB1 ALA 49 1HB ALA 49 9.791 -10.992 -7.529 334 HB2 ALA 49 2HB ALA 49 10.742 -9.804 -8.454 335 HB3 ALA 49 3HB ALA 49 11.517 -10.685 -7.152 336 H SER 50 H SER 50 9.980 -6.680 -5.808 337 HA SER 50 HA SER 50 7.636 -5.958 -7.233 338 HB2 SER 50 1HB SER 50 7.924 -4.023 -6.164 339 HB3 SER 50 2HB SER 50 9.259 -4.791 -5.341 340 HG SER 50 HG SER 50 10.658 -3.880 -6.953 341 HA PRO 51 HA PRO 51 7.021 -3.747 -8.443 342 HB2 PRO 51 1HB PRO 51 5.687 -3.404 -10.795 343 HB3 PRO 51 2HB PRO 51 7.151 -2.472 -10.367 344 HG2 PRO 51 1HG PRO 51 6.994 -4.942 -12.105 345 HG3 PRO 51 2HG PRO 51 7.817 -3.390 -12.455 346 HD2 PRO 51 1HD PRO 51 9.166 -5.533 -11.430 347 HD3 PRO 51 2HD PRO 51 9.559 -3.861 -10.941 348 H VAL 52 H VAL 52 4.934 -4.445 -7.814 349 HA VAL 52 HA VAL 52 3.782 -6.869 -8.860 350 HB VAL 52 HB VAL 52 5.671 -7.573 -7.498 351 HG11 VAL 52 1HG1 VAL 52 4.339 -6.170 -5.196 352 HG12 VAL 52 2HG1 VAL 52 5.707 -7.295 -5.058 353 HG13 VAL 52 3HG1 VAL 52 5.898 -5.766 -5.925 354 HG21 VAL 52 3HG2 VAL 52 4.574 -9.238 -6.168 355 HG22 VAL 52 1HG2 VAL 52 3.098 -8.252 -6.018 356 HG23 VAL 52 2HG2 VAL 52 3.560 -8.963 -7.574 357 H ILE 53 H ILE 53 1.787 -7.436 -7.757 358 HA ILE 53 HA ILE 53 0.335 -5.068 -6.770 359 HB ILE 53 HB ILE 53 -0.554 -7.176 -8.759 360 HG12 ILE 53 1HG1 ILE 53 1.081 -5.835 -9.902 361 HG13 ILE 53 2HG1 ILE 53 -0.535 -5.502 -10.480 362 HG21 ILE 53 1HG2 ILE 53 -1.929 -4.648 -7.761 363 HG22 ILE 53 2HG2 ILE 53 -2.484 -5.632 -9.143 364 HG23 ILE 53 3HG2 ILE 53 -2.434 -6.341 -7.536 365 HD11 ILE 53 3HD1 ILE 53 -0.583 -3.394 -9.214 366 HD12 ILE 53 1HD1 ILE 53 1.068 -3.713 -8.654 367 HD13 ILE 53 2HD1 ILE 53 0.769 -3.477 -10.370 368 H LEU 54 H LEU 54 -0.309 -5.488 -4.732 369 HA LEU 54 HA LEU 54 -0.607 -8.205 -3.657 370 HB2 LEU 54 1HB LEU 54 -1.181 -5.437 -2.532 371 HB3 LEU 54 2HB LEU 54 -1.610 -6.927 -1.713 372 HG LEU 54 HG LEU 54 1.189 -5.921 -2.268 373 HD11 LEU 54 1HD1 LEU 54 0.073 -4.908 -0.395 374 HD12 LEU 54 2HD1 LEU 54 1.222 -6.101 0.271 375 HD13 LEU 54 3HD1 LEU 54 -0.489 -6.489 0.223 376 HD21 LEU 54 3HD2 LEU 54 0.447 -8.568 -0.956 377 HD22 LEU 54 1HD2 LEU 54 2.048 -7.888 -1.064 378 HD23 LEU 54 2HD2 LEU 54 1.202 -8.405 -2.543 379 H SER 55 H SER 55 -2.427 -9.385 -3.629 380 HA SER 55 HA SER 55 -4.796 -8.422 -5.023 381 HB2 SER 55 1HB SER 55 -5.198 -11.052 -4.685 382 HB3 SER 55 2HB SER 55 -4.156 -10.411 -5.950 383 HG SER 55 HG SER 55 -3.244 -12.184 -4.666 384 H ASP 56 H ASP 56 -6.858 -9.965 -3.886 385 HA ASP 56 HA ASP 56 -7.554 -8.430 -1.600 386 HB2 ASP 56 1HB ASP 56 -9.203 -9.569 -3.079 387 HB3 ASP 56 2HB ASP 56 -8.689 -11.121 -2.412 388 H GLU 57 H GLU 57 -6.227 -11.745 -1.852 389 HA GLU 57 HA GLU 57 -6.593 -12.642 0.752 390 HB2 GLU 57 1HB GLU 57 -4.290 -13.018 -1.216 391 HB3 GLU 57 2HB GLU 57 -4.370 -13.917 0.298 392 HG2 GLU 57 1HG GLU 57 -6.630 -14.018 -1.735 393 HG3 GLU 57 2HG GLU 57 -5.209 -15.052 -1.835 394 H GLU 58 H GLU 58 -4.017 -10.686 -0.527 395 HA GLU 58 HA GLU 58 -2.374 -10.622 1.789 396 HB2 GLU 58 1HB GLU 58 -2.502 -8.517 -0.389 397 HB3 GLU 58 2HB GLU 58 -1.090 -9.047 0.498 398 HG2 GLU 58 1HG GLU 58 -2.598 -10.708 -1.617 399 HG3 GLU 58 2HG GLU 58 -1.238 -9.688 -1.956 400 H LEU 59 H LEU 59 -4.912 -8.484 0.478 401 HA LEU 59 HA LEU 59 -4.676 -6.510 2.633 402 HB2 LEU 59 1HB LEU 59 -6.149 -6.773 0.008 403 HB3 LEU 59 2HB LEU 59 -6.709 -5.598 1.163 404 HG LEU 59 HG LEU 59 -5.238 -4.685 -0.555 405 HD11 LEU 59 1HD1 LEU 59 -3.936 -3.219 0.941 406 HD12 LEU 59 2HD1 LEU 59 -4.170 -4.366 2.285 407 HD13 LEU 59 3HD1 LEU 59 -5.546 -3.511 1.568 408 HD21 LEU 59 3HD2 LEU 59 -2.929 -6.097 0.811 409 HD22 LEU 59 1HD2 LEU 59 -2.830 -4.919 -0.520 410 HD23 LEU 59 2HD2 LEU 59 -3.614 -6.478 -0.784 411 H ALA 60 H ALA 60 -5.969 -9.507 2.777 412 HA ALA 60 HA ALA 60 -8.650 -8.893 3.588 413 HB1 ALA 60 1HB ALA 60 -6.951 -11.335 4.166 414 HB2 ALA 60 2HB ALA 60 -8.743 -11.206 4.224 415 HB3 ALA 60 3HB ALA 60 -7.893 -11.050 2.684 416 H VAL 61 H VAL 61 -6.366 -7.426 5.066 417 HA VAL 61 HA VAL 61 -7.129 -8.038 7.865 418 HB VAL 61 HB VAL 61 -4.814 -7.797 8.565 419 HG11 VAL 61 1HG1 VAL 61 -4.862 -9.899 6.370 420 HG12 VAL 61 2HG1 VAL 61 -3.940 -9.891 7.891 421 HG13 VAL 61 3HG1 VAL 61 -5.704 -10.076 7.922 422 HG21 VAL 61 3HG2 VAL 61 -3.962 -6.355 6.712 423 HG22 VAL 61 1HG2 VAL 61 -2.937 -7.762 7.010 424 HG23 VAL 61 2HG2 VAL 61 -4.035 -7.748 5.618 425 H GLU 62 H GLU 62 -6.586 -6.320 9.355 426 HA GLU 62 HA GLU 62 -7.479 -3.753 8.536 427 HB2 GLU 62 1HB GLU 62 -6.929 -3.099 10.855 428 HB3 GLU 62 2HB GLU 62 -7.875 -4.587 10.768 429 HG2 GLU 62 1HG GLU 62 -5.818 -5.940 11.051 430 HG3 GLU 62 2HG GLU 62 -4.869 -4.456 11.111 431 H LYS 63 H LYS 63 -4.190 -5.091 8.683 432 HA LYS 63 HA LYS 63 -3.153 -2.494 7.718 433 HB2 LYS 63 1HB LYS 63 -3.130 -2.443 10.255 434 HB3 LYS 63 2HB LYS 63 -2.033 -3.830 10.217 435 HG2 LYS 63 1HG LYS 63 -0.393 -2.426 8.884 436 HG3 LYS 63 2HG LYS 63 -1.506 -1.067 9.094 437 HD2 LYS 63 1HD LYS 63 -1.356 -1.733 11.640 438 HD3 LYS 63 2HD LYS 63 0.181 -2.452 11.141 439 HE2 LYS 63 1HE LYS 63 0.954 -0.299 10.259 440 HE3 LYS 63 2HE LYS 63 -0.648 0.420 10.521 441 HZ1 LYS 63 3HZ LYS 63 -0.352 0.096 12.884 442 HZ2 LYS 63 1HZ LYS 63 0.849 1.050 12.261 443 HZ3 LYS 63 2HZ LYS 63 1.174 -0.517 12.639 444 H VAL 64 H VAL 64 -1.642 -2.822 6.226 445 HA VAL 64 HA VAL 64 -0.097 -5.341 6.228 446 HB VAL 64 HB VAL 64 -1.085 -3.946 3.705 447 HG11 VAL 64 1HG1 VAL 64 1.018 -5.112 3.378 448 HG12 VAL 64 2HG1 VAL 64 0.288 -6.596 4.060 449 HG13 VAL 64 3HG1 VAL 64 -0.306 -5.932 2.545 450 HG21 VAL 64 3HG2 VAL 64 -2.074 -6.540 4.912 451 HG22 VAL 64 1HG2 VAL 64 -3.028 -5.036 4.792 452 HG23 VAL 64 2HG2 VAL 64 -2.534 -5.896 3.335 453 H THR 65 H THR 65 2.102 -4.931 5.745 454 HA THR 65 HA THR 65 2.984 -2.116 5.980 455 HB THR 65 HB THR 65 3.806 -4.390 7.832 456 HG1 THR 65 1HG THR 65 2.068 -3.965 8.807 457 HG21 THR 65 3HG2 THR 65 4.577 -2.174 9.090 458 HG22 THR 65 1HG2 THR 65 4.630 -1.513 7.450 459 HG23 THR 65 2HG2 THR 65 5.599 -2.923 7.837 460 H LEU 66 H LEU 66 4.356 -1.851 4.300 461 HA LEU 66 HA LEU 66 5.951 -4.213 3.387 462 HB2 LEU 66 1HB LEU 66 4.503 -2.052 1.833 463 HB3 LEU 66 2HB LEU 66 5.616 -3.193 1.112 464 HG LEU 66 HG LEU 66 3.037 -4.023 2.507 465 HD11 LEU 66 1HD1 LEU 66 2.644 -2.534 0.625 466 HD12 LEU 66 2HD1 LEU 66 2.174 -4.165 0.198 467 HD13 LEU 66 3HD1 LEU 66 3.711 -3.533 -0.416 468 HD21 LEU 66 3HD2 LEU 66 3.374 -6.161 1.244 469 HD22 LEU 66 1HD2 LEU 66 4.673 -5.857 2.381 470 HD23 LEU 66 2HD2 LEU 66 4.941 -5.568 0.657 471 H SER 67 H SER 67 8.019 -3.770 2.720 472 HA SER 67 HA SER 67 9.025 -1.010 2.776 473 HB2 SER 67 1HB SER 67 9.105 -1.781 5.170 474 HB3 SER 67 2HB SER 67 10.102 -3.150 4.663 475 HG SER 67 HG SER 67 11.435 -1.473 5.353 476 H THR 68 H THR 68 11.254 -0.979 1.986 477 HA THR 68 HA THR 68 11.822 -3.041 -0.062 478 HB THR 68 HB THR 68 13.891 -1.689 -0.156 479 HG1 THR 68 1HG THR 68 13.286 -0.818 2.080 480 HG21 THR 68 3HG2 THR 68 11.258 -0.108 -0.427 481 HG22 THR 68 1HG2 THR 68 11.885 -1.230 -1.648 482 HG23 THR 68 2HG2 THR 68 12.743 0.281 -1.278 483 H THR 69 H THR 69 13.375 -4.734 0.173 484 HA THR 69 HA THR 69 14.192 -5.215 2.893 485 HB THR 69 HB THR 69 15.362 -7.191 2.002 486 HG1 THR 69 1HG THR 69 16.082 -7.065 0.117 487 HG21 THR 69 3HG2 THR 69 13.469 -8.379 0.904 488 HG22 THR 69 1HG2 THR 69 12.606 -6.841 0.774 489 HG23 THR 69 2HG2 THR 69 13.002 -7.519 2.376 490 H GLY 70 H GLY 70 15.843 -4.328 -0.093 491 HA2 GLY 70 1HA GLY 70 18.160 -3.251 1.479 492 HA3 GLY 70 2HA GLY 70 18.245 -3.876 -0.179 493 H LYS 71 H LYS 71 19.238 -1.455 0.156 494 HA LYS 71 HA LYS 71 17.524 0.860 0.132 495 HB2 LYS 71 1HB LYS 71 20.071 0.687 0.485 496 HB3 LYS 71 2HB LYS 71 20.104 0.460 -1.276 497 HG2 LYS 71 1HG LYS 71 18.639 2.769 -1.134 498 HG3 LYS 71 2HG LYS 71 19.650 2.919 0.303 499 HD2 LYS 71 1HD LYS 71 20.935 3.861 -1.421 500 HD3 LYS 71 2HD LYS 71 21.645 2.278 -1.227 501 HE2 LYS 71 1HE LYS 71 19.453 2.899 -3.255 502 HE3 LYS 71 2HE LYS 71 21.120 3.157 -3.622 503 HZ1 LYS 71 3HZ LYS 71 21.530 0.736 -3.135 504 HZ2 LYS 71 1HZ LYS 71 20.620 1.017 -4.502 505 HZ3 LYS 71 2HZ LYS 71 19.922 0.510 -3.140 506 H ALA 72 H ALA 72 16.500 1.835 -1.487 507 HA ALA 72 HA ALA 72 16.570 0.700 -4.224 508 HB1 ALA 72 1HB ALA 72 14.064 2.059 -3.284 509 HB2 ALA 72 2HB ALA 72 14.251 0.722 -4.398 510 HB3 ALA 72 3HB ALA 72 14.382 0.444 -2.650 511 H ILE 73 H ILE 73 15.542 2.506 -5.703 512 HA ILE 73 HA ILE 73 16.586 5.169 -4.850 513 HB ILE 73 HB ILE 73 16.181 4.466 -7.717 514 HG12 ILE 73 1HG1 ILE 73 17.318 2.449 -7.188 515 HG13 ILE 73 2HG1 ILE 73 18.421 3.542 -7.949 516 HG21 ILE 73 1HG2 ILE 73 16.877 6.700 -7.045 517 HG22 ILE 73 2HG2 ILE 73 18.332 6.054 -6.265 518 HG23 ILE 73 3HG2 ILE 73 18.124 5.920 -8.027 519 HD11 ILE 73 3HD1 ILE 73 18.575 2.310 -5.248 520 HD12 ILE 73 1HD1 ILE 73 19.849 2.867 -6.319 521 HD13 ILE 73 2HD1 ILE 73 19.011 4.030 -5.311 522 H GLU 74 H GLU 74 13.650 3.528 -5.356 523 HA GLU 74 HA GLU 74 12.303 6.002 -5.099 524 HB2 GLU 74 1HB GLU 74 11.785 4.255 -7.543 525 HB3 GLU 74 2HB GLU 74 10.492 5.170 -6.784 526 HG2 GLU 74 1HG GLU 74 11.935 7.251 -7.043 527 HG3 GLU 74 2HG GLU 74 12.950 6.289 -8.131 528 H PHE 75 H PHE 75 10.038 5.530 -4.428 529 HA PHE 75 HA PHE 75 9.255 2.732 -4.019 530 HB2 PHE 75 1HB PHE 75 10.426 3.666 -1.954 531 HB3 PHE 75 2HB PHE 75 9.051 4.724 -1.718 532 HD1 PHE 75 2HD PHE 75 9.727 1.099 -2.485 533 HD2 PHE 75 1HD PHE 75 7.621 3.878 0.092 534 HE1 PHE 75 2HE PHE 75 8.861 -0.773 -1.102 535 HE2 PHE 75 1HE PHE 75 6.822 2.030 1.408 536 HZ PHE 75 HZ PHE 75 7.408 -0.321 0.850 537 H ALA 76 H ALA 76 7.440 2.749 -5.254 538 HA ALA 76 HA ALA 76 5.677 5.160 -5.224 539 HB1 ALA 76 1HB ALA 76 6.577 4.378 -7.427 540 HB2 ALA 76 2HB ALA 76 5.682 2.852 -7.197 541 HB3 ALA 76 3HB ALA 76 4.812 4.404 -7.309 542 H VAL 77 H VAL 77 3.442 4.863 -4.984 543 HA VAL 77 HA VAL 77 2.365 2.354 -3.837 544 HB VAL 77 HB VAL 77 2.541 5.099 -2.499 545 HG11 VAL 77 1HG1 VAL 77 1.112 4.131 -0.672 546 HG12 VAL 77 2HG1 VAL 77 0.272 4.471 -2.183 547 HG13 VAL 77 3HG1 VAL 77 0.705 2.799 -1.771 548 HG21 VAL 77 3HG2 VAL 77 3.494 3.952 -0.602 549 HG22 VAL 77 1HG2 VAL 77 3.278 2.376 -1.397 550 HG23 VAL 77 2HG2 VAL 77 4.446 3.552 -2.027 551 H SER 78 H SER 78 0.526 2.028 -5.163 552 HA SER 78 HA SER 78 -1.333 4.222 -5.401 553 HB2 SER 78 1HB SER 78 -1.396 4.375 -7.818 554 HB3 SER 78 2HB SER 78 0.183 4.831 -7.216 555 HG SER 78 HG SER 78 -0.578 2.614 -8.735 556 H GLY 79 H GLY 79 -3.172 3.325 -7.185 557 HA2 GLY 79 1HA GLY 79 -4.356 1.222 -7.726 558 HA3 GLY 79 2HA GLY 79 -3.922 0.654 -6.104 559 H GLY 80 H GLY 80 -6.296 0.507 -5.760 560 HA2 GLY 80 1HA GLY 80 -7.413 2.426 -4.120 561 HA3 GLY 80 2HA GLY 80 -7.979 2.843 -5.762 562 H VAL 81 H VAL 81 -10.063 1.902 -4.083 563 HA VAL 81 HA VAL 81 -10.729 -0.552 -5.415 564 HB VAL 81 HB VAL 81 -9.474 -1.656 -3.742 565 HG11 VAL 81 1HG1 VAL 81 -10.670 -0.104 -1.486 566 HG12 VAL 81 2HG1 VAL 81 -9.417 -1.363 -1.450 567 HG13 VAL 81 3HG1 VAL 81 -9.055 0.187 -2.205 568 HG21 VAL 81 3HG2 VAL 81 -10.864 -2.924 -2.459 569 HG22 VAL 81 1HG2 VAL 81 -12.111 -1.676 -2.430 570 HG23 VAL 81 2HG2 VAL 81 -11.776 -2.574 -3.938 571 H VAL 82 H VAL 82 -13.109 -1.206 -4.920 572 HA VAL 82 HA VAL 82 -14.507 0.381 -3.067 573 HB VAL 82 HB VAL 82 -14.593 1.811 -5.154 574 HG11 VAL 82 1HG1 VAL 82 -16.045 1.064 -7.011 575 HG12 VAL 82 2HG1 VAL 82 -14.513 0.147 -6.927 576 HG13 VAL 82 3HG1 VAL 82 -16.034 -0.576 -6.364 577 HG21 VAL 82 3HG2 VAL 82 -17.278 0.648 -4.447 578 HG22 VAL 82 1HG2 VAL 82 -16.348 1.784 -3.440 579 HG23 VAL 82 2HG2 VAL 82 -16.905 2.278 -5.047 580 H ASP 83 H ASP 83 -16.687 -0.683 -2.785 581 HA ASP 83 HA ASP 83 -16.480 -3.575 -3.307 582 HB2 ASP 83 1HB ASP 83 -17.052 -2.635 -0.992 583 HB3 ASP 83 2HB ASP 83 -18.608 -2.168 -1.670 584 H GLY 84 H GLY 84 -17.886 -4.484 -4.632 585 HA2 GLY 84 1HA GLY 84 -19.553 -2.777 -6.430 586 HA3 GLY 84 2HA GLY 84 -18.805 -4.310 -6.898 587 H GLU 85 H GLU 85 -19.772 -4.902 -3.754 588 HA GLU 85 HA GLU 85 -22.208 -6.303 -4.356 589 HB2 GLU 85 1HB GLU 85 -20.993 -5.228 -1.766 590 HB3 GLU 85 2HB GLU 85 -22.459 -6.178 -1.859 591 HG2 GLU 85 1HG GLU 85 -19.761 -7.203 -2.834 592 HG3 GLU 85 2HG GLU 85 -20.342 -7.406 -1.168 593 H ASP 86 H ASP 86 -24.116 -5.260 -4.829 594 HA ASP 86 HA ASP 86 -24.814 -2.871 -3.184 595 HB2 ASP 86 1HB ASP 86 -24.256 -2.257 -5.547 596 HB3 ASP 86 2HB ASP 86 -25.611 -3.256 -6.076 597 H GLY 87 H GLY 87 -25.126 -5.547 -2.543 598 HA2 GLY 87 1HA GLY 87 -28.093 -5.957 -2.669 599 HA3 GLY 87 2HA GLY 87 -26.942 -7.278 -2.911 600 H VAL 88 H VAL 88 -25.158 -5.978 -0.673 601 HA VAL 88 HA VAL 88 -26.707 -6.914 1.671 602 HB VAL 88 HB VAL 88 -24.914 -8.379 1.319 603 HG11 VAL 88 1HG1 VAL 88 -22.541 -7.681 1.209 604 HG12 VAL 88 2HG1 VAL 88 -23.483 -7.125 -0.172 605 HG13 VAL 88 3HG1 VAL 88 -23.064 -5.979 1.114 606 HG21 VAL 88 3HG2 VAL 88 -23.823 -6.496 3.434 607 HG22 VAL 88 1HG2 VAL 88 -25.272 -7.488 3.686 608 HG23 VAL 88 2HG2 VAL 88 -23.713 -8.258 3.358 609 H VAL 89 H VAL 89 -26.747 -5.506 3.495 610 HA VAL 89 HA VAL 89 -25.852 -2.732 2.958 611 HB VAL 89 HB VAL 89 -28.130 -3.203 3.939 612 HG11 VAL 89 1HG1 VAL 89 -28.416 -3.637 6.289 613 HG12 VAL 89 2HG1 VAL 89 -27.486 -4.976 5.596 614 HG13 VAL 89 3HG1 VAL 89 -26.662 -3.731 6.554 615 HG21 VAL 89 3HG2 VAL 89 -28.008 -1.289 5.468 616 HG22 VAL 89 1HG2 VAL 89 -26.221 -1.425 5.498 617 HG23 VAL 89 2HG2 VAL 89 -27.071 -1.013 4.000 618 H ASN 90 H ASN 90 -23.875 -2.070 3.736 619 HA ASN 90 HA ASN 90 -22.473 -3.864 5.656 620 HB2 ASN 90 1HB ASN 90 -21.844 -3.901 3.101 621 HB3 ASN 90 2HB ASN 90 -20.910 -2.467 3.552 622 HD21 ASN 90 1HD2 ASN 90 -20.179 -5.208 2.833 623 HD22 ASN 90 2HD2 ASN 90 -18.871 -5.478 3.967 624 H GLU 91 H GLU 91 -20.243 -2.321 6.000 625 HA GLU 91 HA GLU 91 -21.067 0.491 6.256 626 HB2 GLU 91 1HB GLU 91 -19.281 -1.074 8.156 627 HB3 GLU 91 2HB GLU 91 -19.225 0.686 7.987 628 HG2 GLU 91 1HG GLU 91 -21.810 0.609 8.362 629 HG3 GLU 91 2HG GLU 91 -21.475 -0.951 9.103 630 HA PRO 92 HA PRO 92 -17.721 0.859 3.464 631 HB2 PRO 92 1HB PRO 92 -17.209 3.561 3.582 632 HB3 PRO 92 2HB PRO 92 -18.804 2.920 3.093 633 HG2 PRO 92 1HG PRO 92 -17.922 3.831 5.852 634 HG3 PRO 92 2HG PRO 92 -19.343 4.395 4.894 635 HD2 PRO 92 1HD PRO 92 -19.594 2.418 6.747 636 HD3 PRO 92 2HD PRO 92 -20.490 2.394 5.207 637 H MET 93 H MET 93 -15.485 2.586 3.502 638 HA MET 93 HA MET 93 -13.896 1.689 5.793 639 HB2 MET 93 1HB MET 93 -12.410 0.428 4.501 640 HB3 MET 93 2HB MET 93 -13.999 -0.170 4.082 641 HG2 MET 93 1HG MET 93 -13.936 0.955 1.950 642 HG3 MET 93 2HG MET 93 -12.453 1.812 2.379 643 HE1 MET 93 3HE MET 93 -10.242 0.564 3.132 644 HE2 MET 93 1HE MET 93 -10.876 -0.887 3.908 645 HE3 MET 93 2HE MET 93 -9.786 -1.044 2.513 646 H GLN 94 H GLN 94 -11.656 2.425 5.588 647 HA GLN 94 HA GLN 94 -11.180 4.677 3.717 648 HB2 GLN 94 1HB GLN 94 -10.514 4.694 6.678 649 HB3 GLN 94 2HB GLN 94 -9.900 5.856 5.508 650 HG2 GLN 94 1HG GLN 94 -12.075 6.749 5.075 651 HG3 GLN 94 2HG GLN 94 -12.882 5.469 5.975 652 HE21 GLN 94 1HE2 GLN 94 -11.649 8.685 6.288 653 HE22 GLN 94 2HE2 GLN 94 -11.624 8.715 8.043 654 H TRP 95 H TRP 95 -9.382 4.344 2.702 655 HA TRP 95 HA TRP 95 -7.191 2.583 3.725 656 HB2 TRP 95 1HB TRP 95 -7.708 4.126 1.161 657 HB3 TRP 95 2HB TRP 95 -6.067 3.763 1.644 658 HD1 TRP 95 HD TRP 95 -8.211 0.865 2.488 659 HE1 TRP 95 1HE TRP 95 -7.896 -1.031 0.790 660 HE3 TRP 95 3HE TRP 95 -5.608 3.441 -1.065 661 HZ2 TRP 95 2HZ TRP 95 -6.908 -1.288 -1.977 662 HZ3 TRP 95 3HZ TRP 95 -4.873 2.311 -3.155 663 HH2 TRP 95 HH TRP 95 -5.535 -0.054 -3.597 664 H VAL 96 H VAL 96 -6.339 3.569 5.516 665 HA VAL 96 HA VAL 96 -5.208 6.307 5.224 666 HB VAL 96 HB VAL 96 -5.145 4.183 7.409 667 HG11 VAL 96 1HG1 VAL 96 -2.892 4.996 7.351 668 HG12 VAL 96 2HG1 VAL 96 -3.417 6.670 7.102 669 HG13 VAL 96 3HG1 VAL 96 -3.684 5.847 8.666 670 HG21 VAL 96 3HG2 VAL 96 -6.109 5.924 8.819 671 HG22 VAL 96 1HG2 VAL 96 -6.060 7.086 7.477 672 HG23 VAL 96 2HG2 VAL 96 -7.126 5.666 7.402 673 H VAL 97 H VAL 97 -3.068 6.399 4.331 674 HA VAL 97 HA VAL 97 -1.584 3.877 4.303 675 HB VAL 97 HB VAL 97 -1.584 5.346 1.696 676 HG11 VAL 97 1HG1 VAL 97 0.133 3.667 2.243 677 HG12 VAL 97 2HG1 VAL 97 -1.126 2.445 2.452 678 HG13 VAL 97 3HG1 VAL 97 -0.850 3.173 0.856 679 HG21 VAL 97 3HG2 VAL 97 -3.652 3.258 2.319 680 HG22 VAL 97 1HG2 VAL 97 -3.934 4.942 1.840 681 HG23 VAL 97 2HG2 VAL 97 -3.196 3.809 0.698 682 H THR 98 H THR 98 -0.172 4.615 5.815 683 HA THR 98 HA THR 98 0.968 7.295 5.682 684 HB THR 98 HB THR 98 2.334 5.700 7.592 685 HG1 THR 98 1HG THR 98 0.560 4.913 8.845 686 HG21 THR 98 3HG2 THR 98 1.728 8.024 7.897 687 HG22 THR 98 1HG2 THR 98 1.066 7.084 9.223 688 HG23 THR 98 2HG2 THR 98 -0.013 7.614 7.924 689 H VAL 99 H VAL 99 3.277 7.610 5.392 690 HA VAL 99 HA VAL 99 4.759 5.308 4.269 691 HB VAL 99 HB VAL 99 4.940 8.038 2.950 692 HG11 VAL 99 1HG1 VAL 99 5.940 6.684 1.108 693 HG12 VAL 99 2HG1 VAL 99 6.844 6.522 2.609 694 HG13 VAL 99 3HG1 VAL 99 5.756 5.217 2.095 695 HG21 VAL 99 3HG2 VAL 99 3.602 7.088 1.062 696 HG22 VAL 99 1HG2 VAL 99 3.188 5.708 2.094 697 HG23 VAL 99 2HG2 VAL 99 2.652 7.359 2.523 698 H TYR 100 H TYR 100 6.733 5.216 5.017 699 HA TYR 100 HA TYR 100 7.913 7.333 6.718 700 HB2 TYR 100 1HB TYR 100 8.396 4.326 6.613 701 HB3 TYR 100 2HB TYR 100 9.230 5.458 7.666 702 HD1 TYR 100 2HD TYR 100 5.897 3.854 6.976 703 HD2 TYR 100 1HD TYR 100 8.286 6.101 9.760 704 HE1 TYR 100 2HE TYR 100 4.115 3.650 8.677 705 HE2 TYR 100 1HE TYR 100 6.423 6.025 11.418 706 HH TYR 100 HH TYR 100 3.636 5.559 11.128 707 H LYS 101 H LYS 101 10.233 7.552 6.438 708 HA LYS 101 HA LYS 101 11.359 6.764 3.848 709 HB2 LYS 101 1HB LYS 101 10.304 9.115 4.031 710 HB3 LYS 101 2HB LYS 101 11.517 9.467 5.247 711 HG2 LYS 101 1HG LYS 101 12.250 10.416 3.237 712 HG3 LYS 101 2HG LYS 101 13.234 8.972 3.493 713 HD2 LYS 101 1HD LYS 101 11.927 7.746 1.822 714 HD3 LYS 101 2HD LYS 101 10.813 9.098 1.634 715 HE2 LYS 101 1HE LYS 101 13.781 9.115 0.896 716 HE3 LYS 101 2HE LYS 101 12.442 8.923 -0.223 717 HZ1 LYS 101 3HZ LYS 101 13.068 11.090 -0.352 718 HZ2 LYS 101 1HZ LYS 101 13.084 11.388 1.291 719 HZ3 LYS 101 2HZ LYS 101 11.682 11.168 0.446 720 H ASN 102 H ASN 102 13.823 7.527 4.313 721 HA ASN 102 HA ASN 102 15.148 5.873 6.043 722 HB2 ASN 102 1HB ASN 102 17.155 7.204 5.566 723 HB3 ASN 102 2HB ASN 102 16.205 6.787 4.152 724 HD21 ASN 102 1HD2 ASN 102 15.560 8.456 2.790 725 HD22 ASN 102 2HD2 ASN 102 16.085 10.097 3.053 726 H GLY 103 H GLY 103 13.416 6.769 7.970 727 HA2 GLY 103 1HA GLY 103 14.908 7.293 10.217 728 HA3 GLY 103 2HA GLY 103 14.378 8.889 9.657 729 H LYS 104 H LYS 104 11.834 8.714 8.839 730 HA LYS 104 HA LYS 104 10.169 7.300 10.748 731 HB2 LYS 104 1HB LYS 104 9.405 9.297 11.863 732 HB3 LYS 104 2HB LYS 104 11.138 9.080 12.036 733 HG2 LYS 104 1HG LYS 104 10.635 10.733 9.676 734 HG3 LYS 104 2HG LYS 104 9.688 11.329 11.047 735 HD2 LYS 104 1HD LYS 104 11.687 11.346 12.444 736 HD3 LYS 104 2HD LYS 104 12.660 10.670 11.118 737 HE2 LYS 104 1HE LYS 104 12.192 12.695 9.752 738 HE3 LYS 104 2HE LYS 104 11.164 13.317 11.048 739 HZ1 LYS 104 3HZ LYS 104 13.238 13.141 12.466 740 HZ2 LYS 104 1HZ LYS 104 13.194 14.360 11.344 741 HZ3 LYS 104 2HZ LYS 104 14.092 12.990 11.083 742 H GLU 105 H GLU 105 7.940 8.594 10.593 743 HA GLU 105 HA GLU 105 6.705 8.185 8.076 744 HB2 GLU 105 1HB GLU 105 5.622 8.371 10.360 745 HB3 GLU 105 2HB GLU 105 5.799 10.120 10.194 746 HG2 GLU 105 1HG GLU 105 4.592 9.631 7.814 747 HG3 GLU 105 2HG GLU 105 4.047 8.185 8.659 748 H ILE 106 H ILE 106 6.437 9.556 6.292 749 HA ILE 106 HA ILE 106 7.110 12.429 6.556 750 HB ILE 106 HB ILE 106 7.693 12.388 4.156 751 HG12 ILE 106 1HG1 ILE 106 8.016 9.364 4.368 752 HG13 ILE 106 2HG1 ILE 106 6.548 10.080 3.717 753 HG21 ILE 106 1HG2 ILE 106 9.370 12.402 5.983 754 HG22 ILE 106 2HG2 ILE 106 9.448 10.636 5.937 755 HG23 ILE 106 3HG2 ILE 106 9.981 11.595 4.537 756 HD11 ILE 106 3HD1 ILE 106 9.301 10.618 2.577 757 HD12 ILE 106 1HD1 ILE 106 8.089 9.490 1.929 758 HD13 ILE 106 2HD1 ILE 106 7.752 11.234 1.975 759 H GLU 107 H GLU 107 4.795 9.939 5.312 760 HA GLU 107 HA GLU 107 2.971 12.208 4.734 761 HB2 GLU 107 1HB GLU 107 4.018 11.541 2.636 762 HB3 GLU 107 2HB GLU 107 3.502 9.864 2.878 763 HG2 GLU 107 1HG GLU 107 1.999 11.016 1.296 764 HG3 GLU 107 2HG GLU 107 1.151 10.520 2.737 765 H LYS 108 H LYS 108 0.832 11.711 4.812 766 HA LYS 108 HA LYS 108 -0.008 9.614 6.718 767 HB2 LYS 108 1HB LYS 108 -0.519 11.486 8.301 768 HB3 LYS 108 2HB LYS 108 1.188 11.230 8.052 769 HG2 LYS 108 1HG LYS 108 1.539 13.252 7.031 770 HG3 LYS 108 2HG LYS 108 -0.042 13.280 6.239 771 HD2 LYS 108 1HD LYS 108 -1.162 13.871 8.301 772 HD3 LYS 108 2HD LYS 108 0.371 13.747 9.203 773 HE2 LYS 108 1HE LYS 108 1.332 15.586 7.963 774 HE3 LYS 108 2HE LYS 108 -0.069 15.676 6.880 775 HZ1 LYS 108 3HZ LYS 108 -1.388 16.532 8.607 776 HZ2 LYS 108 1HZ LYS 108 0.055 17.296 8.811 777 HZ3 LYS 108 2HZ LYS 108 -0.346 16.059 9.787 778 H LYS 109 H LYS 109 -0.951 9.918 4.101 779 HA LYS 109 HA LYS 109 -3.443 11.562 4.336 780 HB2 LYS 109 1HB LYS 109 -3.408 11.852 1.930 781 HB3 LYS 109 2HB LYS 109 -1.913 12.421 2.620 782 HG2 LYS 109 1HG LYS 109 -0.901 11.354 1.017 783 HG3 LYS 109 2HG LYS 109 -1.074 9.961 2.085 784 HD2 LYS 109 1HD LYS 109 -3.424 9.664 0.825 785 HD3 LYS 109 2HD LYS 109 -2.693 10.773 -0.348 786 HE2 LYS 109 1HE LYS 109 -1.988 8.763 -1.108 787 HE3 LYS 109 2HE LYS 109 -0.593 9.271 -0.174 788 HZ1 LYS 109 3HZ LYS 109 -1.600 7.959 1.721 789 HZ2 LYS 109 1HZ LYS 109 -0.973 7.074 0.512 790 HZ3 LYS 109 2HZ LYS 109 -2.618 7.275 0.633 791 H SER 110 H SER 110 -5.378 10.820 3.530 792 HA SER 110 HA SER 110 -5.661 7.900 3.223 793 HB2 SER 110 1HB SER 110 -5.693 8.604 5.643 794 HB3 SER 110 2HB SER 110 -6.985 9.748 5.280 795 HG SER 110 HG SER 110 -7.290 6.990 4.731 796 H LEU 111 H LEU 111 -7.872 7.343 2.631 797 HA LEU 111 HA LEU 111 -9.302 9.404 1.054 798 HB2 LEU 111 1HB LEU 111 -9.151 6.486 0.274 799 HB3 LEU 111 2HB LEU 111 -9.785 7.831 -0.659 800 HG LEU 111 HG LEU 111 -7.458 8.601 -1.138 801 HD11 LEU 111 1HD1 LEU 111 -6.941 6.280 0.683 802 HD12 LEU 111 2HD1 LEU 111 -6.075 7.842 0.585 803 HD13 LEU 111 3HD1 LEU 111 -5.766 6.594 -0.635 804 HD21 LEU 111 3HD2 LEU 111 -8.697 6.983 -2.583 805 HD22 LEU 111 1HD2 LEU 111 -7.975 5.655 -1.629 806 HD23 LEU 111 2HD2 LEU 111 -6.952 6.722 -2.613 807 H VAL 112 H VAL 112 -11.240 7.595 0.382 808 HA VAL 112 HA VAL 112 -12.357 6.120 2.525 809 HB VAL 112 HB VAL 112 -12.944 8.458 3.078 810 HG11 VAL 112 1HG1 VAL 112 -14.741 9.658 1.996 811 HG12 VAL 112 2HG1 VAL 112 -13.394 9.395 0.876 812 HG13 VAL 112 3HG1 VAL 112 -14.868 8.407 0.748 813 HG21 VAL 112 3HG2 VAL 112 -15.315 7.982 3.692 814 HG22 VAL 112 1HG2 VAL 112 -15.329 6.611 2.568 815 HG23 VAL 112 2HG2 VAL 112 -14.274 6.580 3.992 816 H PHE 113 H PHE 113 -13.930 4.626 1.662 817 HA PHE 113 HA PHE 113 -14.720 4.970 -1.158 818 HB2 PHE 113 1HB PHE 113 -13.789 2.302 -0.045 819 HB3 PHE 113 2HB PHE 113 -14.326 2.642 -1.679 820 HD1 PHE 113 2HD PHE 113 -12.737 4.995 -2.532 821 HD2 PHE 113 1HD PHE 113 -11.574 1.615 -0.115 822 HE1 PHE 113 2HE PHE 113 -10.417 5.258 -3.280 823 HE2 PHE 113 1HE PHE 113 -9.236 1.936 -0.817 824 HZ PHE 113 HZ PHE 113 -8.643 3.704 -2.461 825 H ARG 114 H ARG 114 -16.839 3.998 -1.497 826 HA ARG 114 HA ARG 114 -18.219 2.946 0.880 827 HB2 ARG 114 1HB ARG 114 -19.137 5.366 -0.744 828 HB3 ARG 114 2HB ARG 114 -20.173 4.432 0.346 829 HG2 ARG 114 1HG ARG 114 -18.659 4.959 2.251 830 HG3 ARG 114 2HG ARG 114 -17.652 5.946 1.190 831 HD2 ARG 114 1HD ARG 114 -20.599 6.437 1.774 832 HD3 ARG 114 2HD ARG 114 -19.256 7.221 2.601 833 HE ARG 114 HE ARG 114 -18.567 8.301 0.584 834 HH11 ARG 114 1HH1 ARG 114 -21.742 6.620 0.090 835 HH12 ARG 114 2HH1 ARG 114 -22.124 7.725 -1.205 836 HH21 ARG 114 1HH2 ARG 114 -19.149 9.561 -1.089 837 HH22 ARG 114 2HH2 ARG 114 -20.723 9.352 -1.883 838 H ASP 115 H ASP 115 -20.107 2.005 0.377 839 HA ASP 115 HA ASP 115 -19.383 -0.045 -1.299 840 HB2 ASP 115 1HB ASP 115 -22.100 -0.252 -0.260 841 HB3 ASP 115 2HB ASP 115 -20.707 -1.267 0.074 842 H GLY 116 H GLY 116 -20.799 -1.253 -2.817 843 HA2 GLY 116 1HA GLY 116 -22.319 -1.555 -4.458 844 HA3 GLY 116 2HA GLY 116 -23.238 -0.203 -3.793 845 H LYS 117 H LYS 117 -19.921 -0.153 -5.210 846 HA LYS 117 HA LYS 117 -20.923 1.217 -7.612 847 HB2 LYS 117 1HB LYS 117 -19.323 2.524 -5.410 848 HB3 LYS 117 2HB LYS 117 -18.820 2.899 -7.048 849 HG2 LYS 117 1HG LYS 117 -21.691 3.235 -6.099 850 HG3 LYS 117 2HG LYS 117 -20.473 4.513 -6.015 851 HD2 LYS 117 1HD LYS 117 -20.187 4.544 -8.413 852 HD3 LYS 117 2HD LYS 117 -21.208 3.101 -8.609 853 HE2 LYS 117 1HE LYS 117 -23.063 4.476 -7.496 854 HE3 LYS 117 2HE LYS 117 -22.054 5.896 -7.795 855 HZ1 LYS 117 3HZ LYS 117 -23.551 5.616 -9.614 856 HZ2 LYS 117 1HZ LYS 117 -23.207 4.010 -9.752 857 HZ3 LYS 117 2HZ LYS 117 -22.091 5.139 -10.197 858 H GLU 118 H GLU 118 -18.972 1.642 -9.151 859 HA GLU 118 HA GLU 118 -16.813 -0.345 -8.775 860 HB2 GLU 118 1HB GLU 118 -17.161 -1.129 -11.133 861 HB3 GLU 118 2HB GLU 118 -18.258 -1.753 -9.912 862 HG2 GLU 118 1HG GLU 118 -20.106 -0.708 -10.763 863 HG3 GLU 118 2HG GLU 118 -19.216 0.671 -11.403 864 H ILE 119 H ILE 119 -15.157 1.090 -8.718 865 HA ILE 119 HA ILE 119 -14.942 3.079 -10.911 866 HB ILE 119 HB ILE 119 -14.170 4.755 -9.380 867 HG12 ILE 119 1HG1 ILE 119 -14.800 4.096 -6.820 868 HG13 ILE 119 2HG1 ILE 119 -14.250 2.533 -7.389 869 HG21 ILE 119 1HG2 ILE 119 -16.249 5.320 -8.291 870 HG22 ILE 119 2HG2 ILE 119 -16.572 4.640 -9.889 871 HG23 ILE 119 3HG2 ILE 119 -16.840 3.657 -8.422 872 HD11 ILE 119 3HD1 ILE 119 -12.664 5.111 -7.431 873 HD12 ILE 119 1HD1 ILE 119 -12.380 3.665 -6.421 874 HD13 ILE 119 2HD1 ILE 119 -12.112 3.605 -8.177 875 H SER 120 H SER 120 -12.808 3.889 -11.225 876 HA SER 120 HA SER 120 -10.507 2.430 -10.167 877 HB2 SER 120 1HB SER 120 -11.852 1.281 -12.295 878 HB3 SER 120 2HB SER 120 -10.669 2.303 -13.105 879 HG SER 120 HG SER 120 -9.041 1.219 -12.000 880 H THR 121 H THR 121 -11.370 5.168 -10.085 881 HA THR 121 HA THR 121 -9.691 6.703 -11.904 882 HB THR 121 HB THR 121 -10.052 8.466 -10.069 883 HG1 THR 121 1HG THR 121 -11.382 8.069 -8.529 884 HG21 THR 121 3HG2 THR 121 -12.497 7.327 -11.488 885 HG22 THR 121 1HG2 THR 121 -11.308 8.433 -12.204 886 HG23 THR 121 2HG2 THR 121 -12.316 8.980 -10.857 887 H ASP 122 H ASP 122 -7.957 7.932 -11.241 888 HA ASP 122 HA ASP 122 -5.783 6.645 -9.885 889 HB2 ASP 122 1HB ASP 122 -4.747 8.963 -10.320 890 HB3 ASP 122 2HB ASP 122 -5.223 8.008 -11.704 891 H ASP 123 H ASP 123 -7.857 6.570 -8.228 892 HA ASP 123 HA ASP 123 -8.010 8.516 -6.148 893 HB2 ASP 123 1HB ASP 123 -8.674 5.655 -6.460 894 HB3 ASP 123 2HB ASP 123 -8.070 6.012 -4.847 895 H LEU 124 H LEU 124 -5.422 6.202 -6.917 896 HA LEU 124 HA LEU 124 -3.774 7.721 -5.038 897 HB2 LEU 124 1HB LEU 124 -4.550 5.277 -4.215 898 HB3 LEU 124 2HB LEU 124 -3.270 4.760 -5.221 899 HG LEU 124 HG LEU 124 -1.684 6.158 -3.828 900 HD11 LEU 124 1HD1 LEU 124 -2.771 6.938 -1.586 901 HD12 LEU 124 2HD1 LEU 124 -4.305 6.896 -2.467 902 HD13 LEU 124 3HD1 LEU 124 -3.012 7.970 -3.008 903 HD21 LEU 124 3HD2 LEU 124 -2.119 3.795 -3.203 904 HD22 LEU 124 1HD2 LEU 124 -3.536 4.290 -2.261 905 HD23 LEU 124 2HD2 LEU 124 -1.913 4.777 -1.749 906 H ASN 125 H ASN 125 -1.770 7.919 -5.653 907 HA ASN 125 HA ASN 125 -0.393 6.847 -7.979 908 HB2 ASN 125 1HB ASN 125 -2.143 8.040 -9.231 909 HB3 ASN 125 2HB ASN 125 -1.933 9.467 -8.238 910 HD21 ASN 125 1HD2 ASN 125 0.249 7.322 -10.239 911 HD22 ASN 125 2HD2 ASN 125 1.015 8.730 -11.013 912 H LEU 126 H LEU 126 1.088 6.775 -5.990 913 HA LEU 126 HA LEU 126 2.077 9.452 -5.203 914 HB2 LEU 126 1HB LEU 126 0.570 7.877 -3.618 915 HB3 LEU 126 2HB LEU 126 2.103 7.040 -3.430 916 HG LEU 126 HG LEU 126 3.112 9.344 -2.782 917 HD11 LEU 126 1HD1 LEU 126 1.199 10.746 -3.572 918 HD12 LEU 126 2HD1 LEU 126 1.458 10.949 -1.837 919 HD13 LEU 126 3HD1 LEU 126 0.119 9.930 -2.436 920 HD21 LEU 126 3HD2 LEU 126 2.273 9.060 -0.454 921 HD22 LEU 126 1HD2 LEU 126 2.713 7.516 -1.219 922 HD23 LEU 126 2HD2 LEU 126 1.003 7.963 -1.075 923 H TYR 127 H TYR 127 4.280 9.678 -5.105 924 HA TYR 127 HA TYR 127 6.044 7.333 -5.579 925 HB2 TYR 127 1HB TYR 127 5.718 9.789 -7.330 926 HB3 TYR 127 2HB TYR 127 7.258 8.955 -7.237 927 HD1 TYR 127 1HD TYR 127 3.631 8.404 -8.082 928 HD2 TYR 127 2HD TYR 127 7.707 7.028 -8.542 929 HE1 TYR 127 1HE TYR 127 2.860 6.624 -9.618 930 HE2 TYR 127 2HE TYR 127 6.955 5.271 -10.067 931 HH TYR 127 HH TYR 127 5.141 4.219 -11.043 932 H TYR 128 H TYR 128 8.098 7.554 -4.696 933 HA TYR 128 HA TYR 128 8.988 10.148 -3.648 934 HB2 TYR 128 1HB TYR 128 8.825 7.529 -2.073 935 HB3 TYR 128 2HB TYR 128 9.833 8.873 -1.582 936 HD1 TYR 128 2HD TYR 128 8.588 11.238 -1.480 937 HD2 TYR 128 1HD TYR 128 6.659 7.414 -1.171 938 HE1 TYR 128 2HE TYR 128 6.598 12.342 -0.483 939 HE2 TYR 128 1HE TYR 128 4.640 8.511 -0.255 940 HH TYR 128 HH TYR 128 4.317 12.043 -0.036 941 H ASN 129 H ASN 129 11.254 10.195 -3.371 942 HA ASN 129 HA ASN 129 12.886 7.898 -3.850 943 HB2 ASN 129 1HB ASN 129 14.512 8.973 -5.191 944 HB3 ASN 129 2HB ASN 129 13.000 9.047 -6.079 945 HD21 ASN 129 1HD2 ASN 129 12.356 11.098 -6.802 946 HD22 ASN 129 2HD2 ASN 129 13.128 12.589 -6.285 Start of MODEL 16 1 H1 GLY 1 H GLY 1 38.473 -1.823 10.375 2 HA2 GLY 1 1HA GLY 1 38.098 -0.292 8.480 3 HA3 GLY 1 2HA GLY 1 38.303 -1.691 7.417 4 H ASP 2 H ASP 2 36.065 -0.182 7.327 5 HA ASP 2 HA ASP 2 34.119 -2.096 7.273 6 HB2 ASP 2 1HB ASP 2 33.666 -1.646 9.681 7 HB3 ASP 2 2HB ASP 2 33.474 0.068 9.332 8 H ASP 3 H ASP 3 34.992 -1.221 5.203 9 HA ASP 3 HA ASP 3 34.039 1.392 4.409 10 HB2 ASP 3 1HB ASP 3 36.271 2.292 4.283 11 HB3 ASP 3 2HB ASP 3 35.887 1.758 5.936 12 H ASP 4 H ASP 4 33.837 1.479 2.331 13 HA ASP 4 HA ASP 4 34.978 -0.074 0.237 14 HB2 ASP 4 1HB ASP 4 33.485 -1.812 1.225 15 HB3 ASP 4 2HB ASP 4 32.132 -0.682 1.186 16 H GLU 5 H GLU 5 33.395 0.589 -1.760 17 HA GLU 5 HA GLU 5 31.808 2.999 -1.358 18 HB2 GLU 5 1HB GLU 5 34.530 3.439 -1.823 19 HB3 GLU 5 2HB GLU 5 33.835 3.651 -3.418 20 HG2 GLU 5 1HG GLU 5 32.845 5.038 -0.883 21 HG3 GLU 5 2HG GLU 5 34.008 5.726 -2.010 22 HA PRO 6 HA PRO 6 30.923 -0.351 -4.336 23 HB2 PRO 6 1HB PRO 6 28.257 -0.767 -3.837 24 HB3 PRO 6 2HB PRO 6 29.552 -1.337 -2.732 25 HG2 PRO 6 1HG PRO 6 27.975 1.261 -2.544 26 HG3 PRO 6 2HG PRO 6 28.183 0.018 -1.272 27 HD2 PRO 6 1HD PRO 6 29.789 2.188 -1.351 28 HD3 PRO 6 2HD PRO 6 30.494 0.575 -0.998 29 H GLY 7 H GLY 7 29.642 -0.535 -6.277 30 HA2 GLY 7 1HA GLY 7 29.086 1.983 -7.614 31 HA3 GLY 7 2HA GLY 7 28.949 0.349 -8.278 32 H GLY 8 H GLY 8 27.274 1.939 -5.443 33 HA2 GLY 8 1HA GLY 8 24.714 1.919 -6.832 34 HA3 GLY 8 2HA GLY 8 24.869 0.631 -5.652 35 H LYS 9 H LYS 9 23.353 3.425 -5.884 36 HA LYS 9 HA LYS 9 23.313 3.751 -2.997 37 HB2 LYS 9 1HB LYS 9 24.044 5.886 -4.967 38 HB3 LYS 9 2HB LYS 9 22.704 6.306 -3.905 39 HG2 LYS 9 1HG LYS 9 24.173 5.537 -1.942 40 HG3 LYS 9 2HG LYS 9 25.523 5.516 -3.099 41 HD2 LYS 9 1HD LYS 9 24.978 7.958 -3.610 42 HD3 LYS 9 2HD LYS 9 23.745 7.897 -2.338 43 HE2 LYS 9 1HE LYS 9 25.460 7.179 -0.713 44 HE3 LYS 9 2HE LYS 9 26.712 7.268 -1.954 45 HZ1 LYS 9 3HZ LYS 9 26.635 9.220 -0.531 46 HZ2 LYS 9 1HZ LYS 9 25.105 9.569 -1.006 47 HZ3 LYS 9 2HZ LYS 9 26.328 9.636 -2.095 48 H GLY 10 H GLY 10 21.298 4.650 -2.446 49 HA2 GLY 10 1HA GLY 10 19.004 5.420 -3.628 50 HA3 GLY 10 2HA GLY 10 18.897 3.674 -3.725 51 H ALA 11 H ALA 11 17.242 3.611 -2.111 52 HA ALA 11 HA ALA 11 17.989 4.511 0.654 53 HB1 ALA 11 1HB ALA 11 15.390 5.243 -0.781 54 HB2 ALA 11 2HB ALA 11 15.815 5.668 0.882 55 HB3 ALA 11 3HB ALA 11 16.723 6.367 -0.467 56 H MET 12 H MET 12 16.356 3.789 2.290 57 HA MET 12 HA MET 12 15.098 1.185 1.674 58 HB2 MET 12 1HB MET 12 15.630 2.612 4.293 59 HB3 MET 12 2HB MET 12 14.360 1.394 4.144 60 HG2 MET 12 1HG MET 12 16.500 0.183 2.840 61 HG3 MET 12 2HG MET 12 17.235 1.063 4.138 62 HE1 MET 12 3HE MET 12 13.846 -1.035 3.733 63 HE2 MET 12 1HE MET 12 15.200 -1.909 2.976 64 HE3 MET 12 2HE MET 12 14.418 -2.560 4.432 65 H TYR 13 H TYR 13 12.992 0.893 2.143 66 HA TYR 13 HA TYR 13 11.131 3.178 2.143 67 HB2 TYR 13 1HB TYR 13 11.150 1.084 -0.064 68 HB3 TYR 13 2HB TYR 13 9.987 2.372 0.155 69 HD1 TYR 13 2HD TYR 13 11.387 4.843 0.386 70 HD2 TYR 13 1HD TYR 13 12.205 1.423 -2.069 71 HE1 TYR 13 2HE TYR 13 12.625 6.303 -1.232 72 HE2 TYR 13 1HE TYR 13 13.373 2.906 -3.721 73 HH TYR 13 HH TYR 13 13.610 6.306 -3.571 74 H GLU 14 H GLU 14 9.367 2.620 3.341 75 HA GLU 14 HA GLU 14 8.440 -0.152 3.596 76 HB2 GLU 14 1HB GLU 14 9.942 0.136 5.468 77 HB3 GLU 14 2HB GLU 14 9.316 1.749 5.778 78 HG2 GLU 14 1HG GLU 14 7.057 0.478 6.359 79 HG3 GLU 14 2HG GLU 14 8.091 -0.936 6.453 80 H VAL 15 H VAL 15 6.155 -0.155 4.028 81 HA VAL 15 HA VAL 15 4.725 2.376 4.362 82 HB VAL 15 HB VAL 15 5.016 2.054 1.864 83 HG11 VAL 15 1HG1 VAL 15 4.940 -0.491 1.887 84 HG12 VAL 15 2HG1 VAL 15 3.196 -0.382 2.147 85 HG13 VAL 15 3HG1 VAL 15 3.920 0.294 0.666 86 HG21 VAL 15 3HG2 VAL 15 2.784 2.474 1.137 87 HG22 VAL 15 1HG2 VAL 15 2.087 1.707 2.576 88 HG23 VAL 15 2HG2 VAL 15 2.980 3.229 2.719 89 H THR 16 H THR 16 2.449 2.115 4.934 90 HA THR 16 HA THR 16 1.974 -0.433 6.317 91 HB THR 16 HB THR 16 1.390 2.111 7.698 92 HG1 THR 16 1HG THR 16 3.957 1.627 8.290 93 HG21 THR 16 3HG2 THR 16 1.156 -0.162 8.622 94 HG22 THR 16 1HG2 THR 16 2.232 0.869 9.601 95 HG23 THR 16 2HG2 THR 16 2.926 -0.354 8.507 96 H ILE 17 H ILE 17 -0.053 -0.984 5.968 97 HA ILE 17 HA ILE 17 -1.904 1.053 4.759 98 HB ILE 17 HB ILE 17 -1.037 -0.518 3.160 99 HG12 ILE 17 1HG1 ILE 17 -3.212 -1.748 2.451 100 HG13 ILE 17 2HG1 ILE 17 -3.935 -1.029 3.893 101 HG21 ILE 17 1HG2 ILE 17 -0.291 -2.394 4.392 102 HG22 ILE 17 2HG2 ILE 17 -1.975 -2.846 4.785 103 HG23 ILE 17 3HG2 ILE 17 -1.381 -2.911 3.120 104 HD11 ILE 17 3HD1 ILE 17 -2.746 0.354 1.456 105 HD12 ILE 17 1HD1 ILE 17 -4.398 0.435 2.133 106 HD13 ILE 17 2HD1 ILE 17 -3.047 1.227 2.965 107 H GLU 18 H GLU 18 -3.403 1.591 6.340 108 HA GLU 18 HA GLU 18 -4.354 -0.425 8.298 109 HB2 GLU 18 1HB GLU 18 -4.600 2.597 8.310 110 HB3 GLU 18 2HB GLU 18 -4.997 1.509 9.626 111 HG2 GLU 18 1HG GLU 18 -2.547 0.841 9.684 112 HG3 GLU 18 2HG GLU 18 -2.221 2.103 8.492 113 H GLN 19 H GLN 19 -6.435 -1.223 7.941 114 HA GLN 19 HA GLN 19 -8.293 0.376 6.252 115 HB2 GLN 19 1HB GLN 19 -8.458 -2.562 7.025 116 HB3 GLN 19 2HB GLN 19 -9.407 -1.669 5.840 117 HG2 GLN 19 1HG GLN 19 -7.063 -1.165 4.725 118 HG3 GLN 19 2HG GLN 19 -6.514 -2.539 5.683 119 HE21 GLN 19 1HE2 GLN 19 -6.832 -4.538 4.755 120 HE22 GLN 19 2HE2 GLN 19 -7.777 -4.868 3.332 121 H SER 20 H SER 20 -10.314 1.053 7.066 122 HA SER 20 HA SER 20 -11.132 0.154 9.746 123 HB2 SER 20 1HB SER 20 -10.706 3.056 8.918 124 HB3 SER 20 2HB SER 20 -11.495 2.547 10.417 125 HG SER 20 HG SER 20 -9.640 1.949 11.259 126 H GLY 21 H GLY 21 -13.316 1.052 10.310 127 HA2 GLY 21 1HA GLY 21 -15.527 0.940 9.894 128 HA3 GLY 21 2HA GLY 21 -15.257 1.702 8.330 129 H ASP 22 H ASP 22 -16.790 0.195 7.287 130 HA ASP 22 HA ASP 22 -16.296 -2.690 7.541 131 HB2 ASP 22 1HB ASP 22 -18.610 -1.498 7.147 132 HB3 ASP 22 2HB ASP 22 -18.153 -1.487 5.470 133 H PHE 23 H PHE 23 -14.155 -2.951 6.759 134 HA PHE 23 HA PHE 23 -13.504 -1.891 4.092 135 HB2 PHE 23 1HB PHE 23 -11.223 -2.400 4.673 136 HB3 PHE 23 2HB PHE 23 -12.007 -1.442 5.909 137 HD1 PHE 23 2HD PHE 23 -10.775 -4.913 5.119 138 HD2 PHE 23 1HD PHE 23 -12.095 -2.176 8.185 139 HE1 PHE 23 2HE PHE 23 -10.144 -6.546 6.851 140 HE2 PHE 23 1HE PHE 23 -11.427 -3.806 9.916 141 HZ PHE 23 HZ PHE 23 -10.465 -6.008 9.258 142 H ARG 24 H ARG 24 -15.290 -4.379 4.393 143 HA ARG 24 HA ARG 24 -13.463 -6.488 3.341 144 HB2 ARG 24 1HB ARG 24 -14.638 -8.108 4.752 145 HB3 ARG 24 2HB ARG 24 -13.711 -6.892 5.585 146 HG2 ARG 24 1HG ARG 24 -15.558 -7.115 6.878 147 HG3 ARG 24 2HG ARG 24 -15.846 -5.598 6.025 148 HD2 ARG 24 1HD ARG 24 -17.181 -6.932 4.350 149 HD3 ARG 24 2HD ARG 24 -16.989 -8.336 5.395 150 HE ARG 24 HE ARG 24 -18.338 -5.733 6.060 151 HH11 ARG 24 1HH1 ARG 24 -18.260 -9.256 6.551 152 HH12 ARG 24 2HH1 ARG 24 -19.796 -9.342 7.311 153 HH21 ARG 24 1HH2 ARG 24 -20.141 -5.755 7.363 154 HH22 ARG 24 2HH2 ARG 24 -20.907 -7.242 7.857 155 H SER 25 H SER 25 -15.880 -4.685 2.206 156 HA SER 25 HA SER 25 -16.747 -6.759 0.300 157 HB2 SER 25 1HB SER 25 -18.536 -4.720 1.693 158 HB3 SER 25 2HB SER 25 -19.024 -5.869 0.462 159 HG SER 25 HG SER 25 -19.496 -6.502 2.641 160 H PHE 26 H PHE 26 -14.578 -4.976 -0.082 161 HA PHE 26 HA PHE 26 -15.633 -3.196 -2.185 162 HB2 PHE 26 1HB PHE 26 -13.812 -2.307 0.085 163 HB3 PHE 26 2HB PHE 26 -13.840 -1.501 -1.492 164 HD1 PHE 26 1HD PHE 26 -15.958 -0.633 -2.446 165 HD2 PHE 26 2HD PHE 26 -15.583 -1.835 1.668 166 HE1 PHE 26 1HE PHE 26 -18.234 0.285 -1.966 167 HE2 PHE 26 2HE PHE 26 -17.832 -0.898 2.171 168 HZ PHE 26 HZ PHE 26 -19.167 0.122 0.288 169 H ILE 27 H ILE 27 -14.466 -3.368 -4.018 170 HA ILE 27 HA ILE 27 -12.468 -5.459 -4.102 171 HB ILE 27 HB ILE 27 -13.444 -3.547 -6.227 172 HG12 ILE 27 1HG1 ILE 27 -14.365 -6.405 -5.736 173 HG13 ILE 27 2HG1 ILE 27 -15.283 -4.978 -5.244 174 HG21 ILE 27 1HG2 ILE 27 -12.504 -5.104 -7.861 175 HG22 ILE 27 2HG2 ILE 27 -11.242 -4.639 -6.743 176 HG23 ILE 27 3HG2 ILE 27 -12.021 -6.226 -6.565 177 HD11 ILE 27 3HD1 ILE 27 -16.208 -5.829 -7.278 178 HD12 ILE 27 1HD1 ILE 27 -15.475 -4.251 -7.590 179 HD13 ILE 27 2HD1 ILE 27 -14.649 -5.741 -8.113 180 H LYS 28 H LYS 28 -10.817 -4.669 -2.785 181 HA LYS 28 HA LYS 28 -9.487 -2.112 -3.229 182 HB2 LYS 28 1HB LYS 28 -8.735 -4.596 -1.620 183 HB3 LYS 28 2HB LYS 28 -7.846 -3.076 -1.558 184 HG2 LYS 28 1HG LYS 28 -9.466 -1.937 -0.396 185 HG3 LYS 28 2HG LYS 28 -10.789 -2.938 -0.966 186 HD2 LYS 28 1HD LYS 28 -8.730 -3.904 1.037 187 HD3 LYS 28 2HD LYS 28 -10.326 -3.208 1.423 188 HE2 LYS 28 1HE LYS 28 -11.404 -4.947 0.003 189 HE3 LYS 28 2HE LYS 28 -9.853 -5.747 -0.201 190 HZ1 LYS 28 3HZ LYS 28 -11.247 -6.679 1.547 191 HZ2 LYS 28 1HZ LYS 28 -11.233 -5.278 2.360 192 HZ3 LYS 28 2HZ LYS 28 -9.816 -6.132 2.160 193 H SER 29 H SER 29 -7.208 -1.855 -3.868 194 HA SER 29 HA SER 29 -5.837 -4.223 -4.934 195 HB2 SER 29 1HB SER 29 -6.867 -3.373 -6.913 196 HB3 SER 29 2HB SER 29 -6.386 -1.711 -6.563 197 HG SER 29 HG SER 29 -5.133 -3.477 -8.011 198 H VAL 30 H VAL 30 -3.613 -3.985 -4.977 199 HA VAL 30 HA VAL 30 -2.301 -1.461 -4.370 200 HB VAL 30 HB VAL 30 -1.838 -3.966 -2.704 201 HG11 VAL 30 1HG1 VAL 30 0.008 -2.740 -1.594 202 HG12 VAL 30 2HG1 VAL 30 0.356 -3.086 -3.288 203 HG13 VAL 30 3HG1 VAL 30 -0.140 -1.447 -2.812 204 HG21 VAL 30 3HG2 VAL 30 -2.571 -1.110 -1.907 205 HG22 VAL 30 1HG2 VAL 30 -3.602 -2.543 -1.763 206 HG23 VAL 30 2HG2 VAL 30 -2.160 -2.412 -0.763 207 H VAL 31 H VAL 31 -1.222 -1.382 -6.333 208 HA VAL 31 HA VAL 31 0.408 -3.719 -7.201 209 HB VAL 31 HB VAL 31 -0.242 -2.282 -9.006 210 HG11 VAL 31 1HG1 VAL 31 -0.672 -0.194 -8.011 211 HG12 VAL 31 2HG1 VAL 31 1.055 0.039 -7.586 212 HG13 VAL 31 3HG1 VAL 31 0.531 0.019 -9.278 213 HG21 VAL 31 3HG2 VAL 31 2.164 -3.230 -8.973 214 HG22 VAL 31 1HG2 VAL 31 1.876 -1.854 -10.048 215 HG23 VAL 31 2HG2 VAL 31 2.684 -1.618 -8.490 216 H VAL 32 H VAL 32 2.613 -3.821 -6.549 217 HA VAL 32 HA VAL 32 3.768 -1.610 -4.999 218 HB VAL 32 HB VAL 32 3.243 -3.087 -3.311 219 HG11 VAL 32 1HG1 VAL 32 3.821 -5.511 -3.300 220 HG12 VAL 32 2HG1 VAL 32 2.570 -5.058 -4.465 221 HG13 VAL 32 3HG1 VAL 32 4.227 -5.362 -5.031 222 HG21 VAL 32 3HG2 VAL 32 5.654 -2.325 -3.357 223 HG22 VAL 32 1HG2 VAL 32 5.363 -3.808 -2.434 224 HG23 VAL 32 2HG2 VAL 32 6.083 -3.891 -4.059 225 H VAL 33 H VAL 33 5.834 -1.100 -5.768 226 HA VAL 33 HA VAL 33 6.921 -2.845 -7.921 227 HB VAL 33 HB VAL 33 7.043 0.185 -7.786 228 HG11 VAL 33 1HG1 VAL 33 7.709 -0.035 -10.208 229 HG12 VAL 33 2HG1 VAL 33 8.919 -0.630 -9.106 230 HG13 VAL 33 3HG1 VAL 33 7.870 -1.780 -9.985 231 HG21 VAL 33 3HG2 VAL 33 5.247 -1.647 -9.452 232 HG22 VAL 33 1HG2 VAL 33 4.732 -0.448 -8.239 233 HG23 VAL 33 2HG2 VAL 33 5.457 0.090 -9.747 234 H ALA 34 H ALA 34 9.318 -2.555 -8.238 235 HA ALA 34 HA ALA 34 10.826 -1.512 -6.019 236 HB1 ALA 34 1HB ALA 34 10.539 -3.909 -5.324 237 HB2 ALA 34 2HB ALA 34 11.076 -4.431 -6.935 238 HB3 ALA 34 3HB ALA 34 12.213 -3.602 -5.862 239 H ASN 35 H ASN 35 12.952 -1.144 -6.600 240 HA ASN 35 HA ASN 35 13.829 -1.775 -9.367 241 HB2 ASN 35 1HB ASN 35 13.131 0.616 -9.230 242 HB3 ASN 35 2HB ASN 35 14.337 0.847 -7.967 243 HD21 ASN 35 1HD2 ASN 35 14.155 2.076 -10.657 244 HD22 ASN 35 2HD2 ASN 35 15.592 1.644 -11.539 245 H GLY 36 H GLY 36 15.210 -3.403 -8.761 246 HA2 GLY 36 1HA GLY 36 17.361 -4.068 -8.350 247 HA3 GLY 36 2HA GLY 36 17.712 -2.448 -7.735 248 H THR 37 H THR 37 15.189 -4.518 -6.344 249 HA THR 37 HA THR 37 16.723 -6.167 -4.879 250 HB THR 37 HB THR 37 17.256 -4.162 -3.468 251 HG1 THR 37 1HG THR 37 17.186 -5.260 -1.646 252 HG21 THR 37 3HG2 THR 37 15.718 -3.238 -1.972 253 HG22 THR 37 1HG2 THR 37 14.519 -4.502 -2.261 254 HG23 THR 37 2HG2 THR 37 14.859 -3.302 -3.526 255 H GLN 38 H GLN 38 14.743 -6.735 -2.802 256 HA GLN 38 HA GLN 38 12.290 -7.245 -4.387 257 HB2 GLN 38 1HB GLN 38 14.169 -9.224 -3.141 258 HB3 GLN 38 2HB GLN 38 12.435 -9.566 -3.011 259 HG2 GLN 38 1HG GLN 38 12.152 -9.517 -5.387 260 HG3 GLN 38 2HG GLN 38 13.701 -8.756 -5.624 261 HE21 GLN 38 1HE2 GLN 38 12.190 -11.974 -4.939 262 HE22 GLN 38 2HE2 GLN 38 13.555 -12.837 -5.538 263 H LEU 39 H LEU 39 10.601 -8.187 -2.780 264 HA LEU 39 HA LEU 39 10.276 -6.016 -0.749 265 HB2 LEU 39 1HB LEU 39 8.536 -7.363 -2.691 266 HB3 LEU 39 2HB LEU 39 7.852 -7.475 -1.099 267 HG LEU 39 HG LEU 39 7.064 -5.573 -2.482 268 HD11 LEU 39 1HD1 LEU 39 8.383 -4.566 0.045 269 HD12 LEU 39 2HD1 LEU 39 6.955 -5.614 0.046 270 HD13 LEU 39 3HD1 LEU 39 6.896 -4.004 -0.705 271 HD21 LEU 39 3HD2 LEU 39 8.365 -3.632 -2.919 272 HD22 LEU 39 1HD2 LEU 39 9.438 -4.975 -3.378 273 HD23 LEU 39 2HD2 LEU 39 9.654 -4.156 -1.824 274 H LYS 40 H LYS 40 9.110 -6.599 1.212 275 HA LYS 40 HA LYS 40 9.442 -9.396 2.073 276 HB2 LYS 40 1HB LYS 40 11.266 -7.834 2.880 277 HB3 LYS 40 2HB LYS 40 10.069 -7.044 3.900 278 HG2 LYS 40 1HG LYS 40 9.609 -9.106 5.070 279 HG3 LYS 40 2HG LYS 40 10.554 -10.063 3.909 280 HD2 LYS 40 1HD LYS 40 12.628 -8.899 4.601 281 HD3 LYS 40 2HD LYS 40 11.704 -8.005 5.825 282 HE2 LYS 40 1HE LYS 40 11.171 -10.038 7.022 283 HE3 LYS 40 2HE LYS 40 11.846 -11.051 5.729 284 HZ1 LYS 40 3HZ LYS 40 14.019 -10.268 6.251 285 HZ2 LYS 40 1HZ LYS 40 13.345 -10.695 7.705 286 HZ3 LYS 40 2HZ LYS 40 13.451 -9.143 7.313 287 H ASP 41 H ASP 41 7.571 -10.104 2.560 288 HA ASP 41 HA ASP 41 5.239 -8.380 2.892 289 HB2 ASP 41 1HB ASP 41 5.572 -10.778 1.714 290 HB3 ASP 41 2HB ASP 41 5.157 -11.346 3.326 291 H GLY 42 H GLY 42 4.306 -7.821 4.858 292 HA2 GLY 42 1HA GLY 42 5.552 -8.215 7.298 293 HA3 GLY 42 2HA GLY 42 3.860 -7.752 7.087 294 H ALA 43 H ALA 43 3.315 -10.400 5.707 295 HA ALA 43 HA ALA 43 2.083 -11.863 7.582 296 HB1 ALA 43 1HB ALA 43 2.321 -13.810 5.984 297 HB2 ALA 43 2HB ALA 43 1.780 -12.318 5.219 298 HB3 ALA 43 3HB ALA 43 3.467 -12.856 5.039 299 H THR 44 H THR 44 5.411 -12.587 6.458 300 HA THR 44 HA THR 44 6.014 -13.520 9.196 301 HB THR 44 HB THR 44 5.089 -15.440 7.606 302 HG1 THR 44 1HG THR 44 7.539 -15.717 9.033 303 HG21 THR 44 3HG2 THR 44 8.042 -15.741 6.945 304 HG22 THR 44 1HG2 THR 44 6.902 -14.968 5.859 305 HG23 THR 44 2HG2 THR 44 6.649 -16.659 6.346 306 H GLY 45 H GLY 45 6.985 -11.695 6.501 307 HA2 GLY 45 1HA GLY 45 9.124 -10.830 6.121 308 HA3 GLY 45 2HA GLY 45 9.881 -12.200 6.943 309 H GLU 46 H GLU 46 7.228 -12.510 4.530 310 HA GLU 46 HA GLU 46 8.582 -14.542 3.019 311 HB2 GLU 46 1HB GLU 46 6.220 -12.880 2.176 312 HB3 GLU 46 2HB GLU 46 6.758 -14.400 1.530 313 HG2 GLU 46 1HG GLU 46 5.670 -14.066 4.390 314 HG3 GLU 46 2HG GLU 46 4.739 -14.442 2.963 315 H SER 47 H SER 47 10.262 -14.038 1.462 316 HA SER 47 HA SER 47 10.711 -11.388 0.634 317 HB2 SER 47 1HB SER 47 12.260 -13.512 -0.571 318 HB3 SER 47 2HB SER 47 12.708 -12.183 0.490 319 HG SER 47 HG SER 47 12.718 -14.699 1.137 320 H LEU 48 H LEU 48 9.718 -10.543 -1.034 321 HA LEU 48 HA LEU 48 8.351 -12.319 -3.018 322 HB2 LEU 48 1HB LEU 48 7.612 -9.511 -2.185 323 HB3 LEU 48 2HB LEU 48 6.689 -10.586 -3.220 324 HG LEU 48 HG LEU 48 7.182 -10.877 -0.244 325 HD11 LEU 48 1HD1 LEU 48 4.669 -10.581 -0.262 326 HD12 LEU 48 2HD1 LEU 48 4.774 -10.188 -1.972 327 HD13 LEU 48 3HD1 LEU 48 5.612 -9.167 -0.784 328 HD21 LEU 48 3HD2 LEU 48 5.655 -12.803 -0.273 329 HD22 LEU 48 1HD2 LEU 48 7.102 -13.149 -1.210 330 HD23 LEU 48 2HD2 LEU 48 5.577 -12.758 -2.040 331 H ALA 49 H ALA 49 8.201 -11.830 -5.134 332 HA ALA 49 HA ALA 49 10.489 -10.394 -6.241 333 HB1 ALA 49 1HB ALA 49 8.472 -12.375 -7.305 334 HB2 ALA 49 2HB ALA 49 9.780 -11.665 -8.271 335 HB3 ALA 49 3HB ALA 49 10.160 -12.670 -6.855 336 H SER 50 H SER 50 9.225 -8.215 -5.569 337 HA SER 50 HA SER 50 7.095 -7.260 -7.039 338 HB2 SER 50 1HB SER 50 9.572 -5.995 -5.885 339 HB3 SER 50 2HB SER 50 8.358 -5.030 -6.733 340 HG SER 50 HG SER 50 7.872 -5.175 -4.522 341 HA PRO 51 HA PRO 51 6.564 -5.112 -8.093 342 HB2 PRO 51 1HB PRO 51 5.114 -4.669 -10.398 343 HB3 PRO 51 2HB PRO 51 6.509 -3.677 -9.889 344 HG2 PRO 51 1HG PRO 51 6.483 -5.959 -11.849 345 HG3 PRO 51 2HG PRO 51 7.262 -4.360 -12.026 346 HD2 PRO 51 1HD PRO 51 8.666 -6.566 -11.251 347 HD3 PRO 51 2HD PRO 51 9.024 -4.962 -10.564 348 H VAL 52 H VAL 52 4.422 -5.696 -7.549 349 HA VAL 52 HA VAL 52 3.259 -8.210 -8.546 350 HB VAL 52 HB VAL 52 4.271 -7.716 -5.709 351 HG11 VAL 52 1HG1 VAL 52 3.140 -9.768 -4.928 352 HG12 VAL 52 2HG1 VAL 52 1.988 -8.504 -5.341 353 HG13 VAL 52 3HG1 VAL 52 2.251 -9.864 -6.457 354 HG21 VAL 52 3HG2 VAL 52 4.545 -10.095 -7.591 355 HG22 VAL 52 1HG2 VAL 52 5.802 -8.921 -7.241 356 HG23 VAL 52 2HG2 VAL 52 5.245 -9.986 -5.961 357 H ILE 53 H ILE 53 1.043 -8.407 -7.920 358 HA ILE 53 HA ILE 53 -0.252 -5.853 -7.121 359 HB ILE 53 HB ILE 53 -1.361 -7.995 -8.942 360 HG12 ILE 53 1HG1 ILE 53 0.431 -7.100 -10.243 361 HG13 ILE 53 2HG1 ILE 53 -1.084 -6.432 -10.820 362 HG21 ILE 53 1HG2 ILE 53 -3.024 -6.241 -9.529 363 HG22 ILE 53 2HG2 ILE 53 -3.080 -6.667 -7.826 364 HG23 ILE 53 3HG2 ILE 53 -2.296 -5.153 -8.320 365 HD11 ILE 53 3HD1 ILE 53 0.812 -4.928 -9.058 366 HD12 ILE 53 1HD1 ILE 53 0.716 -4.772 -10.806 367 HD13 ILE 53 2HD1 ILE 53 -0.679 -4.304 -9.814 368 H LEU 54 H LEU 54 -1.854 -6.091 -5.594 369 HA LEU 54 HA LEU 54 -2.372 -8.802 -4.473 370 HB2 LEU 54 1HB LEU 54 -2.130 -6.130 -3.046 371 HB3 LEU 54 2HB LEU 54 -2.720 -7.604 -2.297 372 HG LEU 54 HG LEU 54 0.082 -7.159 -3.422 373 HD11 LEU 54 1HD1 LEU 54 0.772 -7.326 -1.069 374 HD12 LEU 54 2HD1 LEU 54 -0.925 -7.528 -0.573 375 HD13 LEU 54 3HD1 LEU 54 -0.374 -5.991 -1.314 376 HD21 LEU 54 3HD2 LEU 54 -1.073 -9.628 -2.028 377 HD22 LEU 54 1HD2 LEU 54 0.633 -9.350 -2.463 378 HD23 LEU 54 2HD2 LEU 54 -0.551 -9.530 -3.723 379 H SER 55 H SER 55 -4.281 -9.402 -4.986 380 HA SER 55 HA SER 55 -6.385 -7.687 -5.840 381 HB2 SER 55 1HB SER 55 -6.690 -10.540 -4.861 382 HB3 SER 55 2HB SER 55 -7.578 -9.725 -6.149 383 HG SER 55 HG SER 55 -5.467 -11.277 -6.394 384 H ASP 56 H ASP 56 -8.590 -8.040 -4.811 385 HA ASP 56 HA ASP 56 -8.869 -6.974 -2.235 386 HB2 ASP 56 1HB ASP 56 -10.579 -6.800 -3.905 387 HB3 ASP 56 2HB ASP 56 -10.675 -8.557 -4.077 388 H GLU 57 H GLU 57 -8.593 -10.369 -3.244 389 HA GLU 57 HA GLU 57 -9.469 -11.578 -0.756 390 HB2 GLU 57 1HB GLU 57 -7.938 -12.436 -3.221 391 HB3 GLU 57 2HB GLU 57 -7.870 -13.455 -1.781 392 HG2 GLU 57 1HG GLU 57 -10.493 -12.552 -3.045 393 HG3 GLU 57 2HG GLU 57 -9.678 -14.059 -3.454 394 H GLU 58 H GLU 58 -6.350 -10.401 -2.029 395 HA GLU 58 HA GLU 58 -4.879 -11.552 0.177 396 HB2 GLU 58 1HB GLU 58 -3.819 -9.395 -1.627 397 HB3 GLU 58 2HB GLU 58 -2.956 -10.728 -0.871 398 HG2 GLU 58 1HG GLU 58 -4.829 -10.807 -3.269 399 HG3 GLU 58 2HG GLU 58 -3.088 -11.011 -3.292 400 H LEU 59 H LEU 59 -6.333 -8.490 -0.657 401 HA LEU 59 HA LEU 59 -5.280 -7.009 1.655 402 HB2 LEU 59 1HB LEU 59 -7.138 -6.339 -0.645 403 HB3 LEU 59 2HB LEU 59 -6.768 -5.181 0.634 404 HG LEU 59 HG LEU 59 -4.516 -6.529 -0.889 405 HD11 LEU 59 1HD1 LEU 59 -6.042 -5.451 -2.546 406 HD12 LEU 59 2HD1 LEU 59 -4.431 -4.745 -2.456 407 HD13 LEU 59 3HD1 LEU 59 -5.794 -3.898 -1.699 408 HD21 LEU 59 3HD2 LEU 59 -3.244 -4.581 -0.202 409 HD22 LEU 59 1HD2 LEU 59 -4.021 -5.244 1.233 410 HD23 LEU 59 2HD2 LEU 59 -4.693 -3.796 0.471 411 H ALA 60 H ALA 60 -7.026 -9.429 2.112 412 HA ALA 60 HA ALA 60 -9.457 -8.363 3.284 413 HB1 ALA 60 1HB ALA 60 -9.844 -10.678 3.976 414 HB2 ALA 60 2HB ALA 60 -9.328 -10.627 2.285 415 HB3 ALA 60 3HB ALA 60 -8.175 -11.105 3.546 416 H VAL 61 H VAL 61 -6.366 -7.966 4.413 417 HA VAL 61 HA VAL 61 -6.861 -8.698 7.213 418 HB VAL 61 HB VAL 61 -4.545 -7.929 7.551 419 HG11 VAL 61 1HG1 VAL 61 -3.452 -9.694 6.422 420 HG12 VAL 61 2HG1 VAL 61 -5.082 -10.259 6.761 421 HG13 VAL 61 3HG1 VAL 61 -4.670 -9.751 5.118 422 HG21 VAL 61 3HG2 VAL 61 -4.539 -7.258 4.566 423 HG22 VAL 61 1HG2 VAL 61 -4.295 -6.134 5.921 424 HG23 VAL 61 2HG2 VAL 61 -3.107 -7.400 5.582 425 H GLU 62 H GLU 62 -7.012 -7.253 8.944 426 HA GLU 62 HA GLU 62 -8.128 -4.693 8.664 427 HB2 GLU 62 1HB GLU 62 -7.680 -4.424 11.033 428 HB3 GLU 62 2HB GLU 62 -8.232 -6.063 10.709 429 HG2 GLU 62 1HG GLU 62 -5.712 -6.723 10.623 430 HG3 GLU 62 2HG GLU 62 -5.405 -5.087 11.201 431 H LYS 63 H LYS 63 -4.662 -5.576 8.757 432 HA LYS 63 HA LYS 63 -3.883 -3.044 7.733 433 HB2 LYS 63 1HB LYS 63 -4.190 -2.283 10.036 434 HB3 LYS 63 2HB LYS 63 -3.329 -3.667 10.676 435 HG2 LYS 63 1HG LYS 63 -1.722 -1.917 8.832 436 HG3 LYS 63 2HG LYS 63 -2.290 -1.164 10.310 437 HD2 LYS 63 1HD LYS 63 -1.247 -2.752 11.701 438 HD3 LYS 63 2HD LYS 63 -0.787 -3.782 10.324 439 HE2 LYS 63 1HE LYS 63 0.811 -2.185 9.536 440 HE3 LYS 63 2HE LYS 63 0.172 -0.909 10.583 441 HZ1 LYS 63 3HZ LYS 63 1.040 -1.953 12.465 442 HZ2 LYS 63 1HZ LYS 63 2.261 -1.911 11.383 443 HZ3 LYS 63 2HZ LYS 63 1.459 -3.339 11.660 444 H VAL 64 H VAL 64 -1.663 -3.233 6.890 445 HA VAL 64 HA VAL 64 -0.055 -5.266 8.108 446 HB VAL 64 HB VAL 64 -1.272 -6.569 6.519 447 HG11 VAL 64 1HG1 VAL 64 -0.977 -6.438 4.096 448 HG12 VAL 64 2HG1 VAL 64 -1.858 -5.067 4.742 449 HG13 VAL 64 3HG1 VAL 64 -0.140 -4.890 4.271 450 HG21 VAL 64 3HG2 VAL 64 1.559 -6.382 5.501 451 HG22 VAL 64 1HG2 VAL 64 1.097 -7.144 7.053 452 HG23 VAL 64 2HG2 VAL 64 0.477 -7.760 5.517 453 H THR 65 H THR 65 2.278 -5.121 7.000 454 HA THR 65 HA THR 65 2.702 -2.429 5.942 455 HB THR 65 HB THR 65 3.362 -2.634 8.443 456 HG1 THR 65 1HG THR 65 4.477 -1.228 6.566 457 HG21 THR 65 3HG2 THR 65 4.455 -4.895 8.065 458 HG22 THR 65 1HG2 THR 65 5.404 -3.716 8.980 459 HG23 THR 65 2HG2 THR 65 5.782 -3.983 7.260 460 H LEU 66 H LEU 66 4.674 -2.389 4.632 461 HA LEU 66 HA LEU 66 5.715 -4.972 3.692 462 HB2 LEU 66 1HB LEU 66 4.411 -2.822 1.989 463 HB3 LEU 66 2HB LEU 66 5.601 -3.915 1.320 464 HG LEU 66 HG LEU 66 3.349 -5.253 2.789 465 HD11 LEU 66 1HD1 LEU 66 2.175 -3.437 1.711 466 HD12 LEU 66 2HD1 LEU 66 1.813 -4.973 0.905 467 HD13 LEU 66 3HD1 LEU 66 2.964 -3.847 0.152 468 HD21 LEU 66 3HD2 LEU 66 4.637 -5.775 0.073 469 HD22 LEU 66 1HD2 LEU 66 3.509 -6.834 0.918 470 HD23 LEU 66 2HD2 LEU 66 5.111 -6.555 1.604 471 H SER 67 H SER 67 7.787 -4.568 2.629 472 HA SER 67 HA SER 67 9.062 -2.009 2.760 473 HB2 SER 67 1HB SER 67 8.951 -2.593 5.244 474 HB3 SER 67 2HB SER 67 9.966 -3.997 4.892 475 HG SER 67 HG SER 67 11.471 -2.508 5.307 476 H THR 68 H THR 68 11.343 -2.268 2.113 477 HA THR 68 HA THR 68 11.571 -4.449 0.159 478 HB THR 68 HB THR 68 13.702 -3.182 -0.314 479 HG1 THR 68 1HG THR 68 13.568 -0.982 0.601 480 HG21 THR 68 3HG2 THR 68 12.503 -1.365 -1.454 481 HG22 THR 68 1HG2 THR 68 11.228 -1.355 -0.226 482 HG23 THR 68 2HG2 THR 68 11.353 -2.703 -1.351 483 H THR 69 H THR 69 13.462 -5.956 0.104 484 HA THR 69 HA THR 69 14.342 -6.625 2.768 485 HB THR 69 HB THR 69 15.618 -8.427 1.796 486 HG1 THR 69 1HG THR 69 16.416 -7.925 -0.080 487 HG21 THR 69 3HG2 THR 69 13.803 -9.756 1.014 488 HG22 THR 69 1HG2 THR 69 12.976 -8.357 0.300 489 HG23 THR 69 2HG2 THR 69 13.085 -8.575 2.069 490 H GLY 70 H GLY 70 15.386 -4.226 0.602 491 HA2 GLY 70 1HA GLY 70 17.744 -3.644 2.143 492 HA3 GLY 70 2HA GLY 70 18.140 -4.363 0.580 493 H LYS 71 H LYS 71 19.170 -2.240 0.357 494 HA LYS 71 HA LYS 71 17.834 0.227 -0.115 495 HB2 LYS 71 1HB LYS 71 20.413 -0.566 -0.108 496 HB3 LYS 71 2HB LYS 71 20.061 -0.814 -1.834 497 HG2 LYS 71 1HG LYS 71 19.138 1.735 -1.490 498 HG3 LYS 71 2HG LYS 71 20.445 1.697 -0.303 499 HD2 LYS 71 1HD LYS 71 21.615 2.252 -2.276 500 HD3 LYS 71 2HD LYS 71 21.824 0.498 -2.237 501 HE2 LYS 71 1HE LYS 71 19.510 0.414 -3.468 502 HE3 LYS 71 2HE LYS 71 19.781 2.136 -3.763 503 HZ1 LYS 71 3HZ LYS 71 21.714 -0.005 -4.539 504 HZ2 LYS 71 1HZ LYS 71 21.555 1.527 -5.221 505 HZ3 LYS 71 2HZ LYS 71 20.468 0.368 -5.488 506 H ALA 72 H ALA 72 16.540 0.847 -1.777 507 HA ALA 72 HA ALA 72 16.464 -0.700 -4.268 508 HB1 ALA 72 1HB ALA 72 13.904 0.317 -2.985 509 HB2 ALA 72 2HB ALA 72 14.085 -0.809 -4.344 510 HB3 ALA 72 3HB ALA 72 14.472 -1.323 -2.691 511 H ILE 73 H ILE 73 15.248 0.718 -5.919 512 HA ILE 73 HA ILE 73 15.522 3.617 -5.284 513 HB ILE 73 HB ILE 73 15.642 2.676 -8.109 514 HG12 ILE 73 1HG1 ILE 73 17.135 0.972 -7.239 515 HG13 ILE 73 2HG1 ILE 73 17.931 2.162 -8.189 516 HG21 ILE 73 1HG2 ILE 73 17.354 4.491 -8.193 517 HG22 ILE 73 2HG2 ILE 73 15.814 5.039 -7.520 518 HG23 ILE 73 3HG2 ILE 73 17.163 4.738 -6.447 519 HD11 ILE 73 3HD1 ILE 73 18.261 1.635 -5.257 520 HD12 ILE 73 1HD1 ILE 73 19.449 1.798 -6.543 521 HD13 ILE 73 2HD1 ILE 73 18.659 3.247 -5.919 522 H GLU 74 H GLU 74 13.053 1.447 -5.350 523 HA GLU 74 HA GLU 74 11.302 3.590 -6.135 524 HB2 GLU 74 1HB GLU 74 11.363 0.962 -7.650 525 HB3 GLU 74 2HB GLU 74 9.807 1.714 -7.302 526 HG2 GLU 74 1HG GLU 74 11.042 3.893 -8.194 527 HG3 GLU 74 2HG GLU 74 12.035 2.701 -9.055 528 H PHE 75 H PHE 75 9.334 3.518 -5.231 529 HA PHE 75 HA PHE 75 8.173 1.144 -4.084 530 HB2 PHE 75 1HB PHE 75 9.645 2.665 -2.297 531 HB3 PHE 75 2HB PHE 75 8.085 3.384 -2.084 532 HD1 PHE 75 2HD PHE 75 9.230 -0.121 -2.729 533 HD2 PHE 75 1HD PHE 75 7.172 2.499 0.027 534 HE1 PHE 75 2HE PHE 75 8.800 -2.035 -1.220 535 HE2 PHE 75 1HE PHE 75 6.802 0.598 1.495 536 HZ PHE 75 HZ PHE 75 7.555 -1.679 0.905 537 H ALA 76 H ALA 76 7.155 1.839 -6.184 538 HA ALA 76 HA ALA 76 5.223 4.051 -5.937 539 HB1 ALA 76 1HB ALA 76 4.585 3.488 -8.211 540 HB2 ALA 76 2HB ALA 76 6.358 3.592 -8.113 541 HB3 ALA 76 3HB ALA 76 5.562 2.008 -8.166 542 H VAL 77 H VAL 77 3.042 3.796 -5.602 543 HA VAL 77 HA VAL 77 1.922 1.102 -5.105 544 HB VAL 77 HB VAL 77 1.952 3.442 -3.145 545 HG11 VAL 77 1HG1 VAL 77 0.368 0.840 -3.009 546 HG12 VAL 77 2HG1 VAL 77 0.574 1.982 -1.658 547 HG13 VAL 77 3HG1 VAL 77 -0.291 2.490 -3.106 548 HG21 VAL 77 3HG2 VAL 77 2.952 0.575 -2.885 549 HG22 VAL 77 1HG2 VAL 77 3.959 2.024 -3.005 550 HG23 VAL 77 2HG2 VAL 77 2.943 1.792 -1.583 551 H SER 78 H SER 78 -0.031 0.981 -6.182 552 HA SER 78 HA SER 78 -1.769 3.327 -6.301 553 HB2 SER 78 1HB SER 78 -0.503 3.564 -8.365 554 HB3 SER 78 2HB SER 78 -0.718 1.868 -8.765 555 HG SER 78 HG SER 78 -2.325 2.559 -9.852 556 H GLY 79 H GLY 79 -3.998 2.483 -7.184 557 HA2 GLY 79 1HA GLY 79 -4.839 -0.050 -7.553 558 HA3 GLY 79 2HA GLY 79 -4.616 -0.042 -5.796 559 H GLY 80 H GLY 80 -5.992 1.219 -4.482 560 HA2 GLY 80 1HA GLY 80 -7.633 3.035 -4.207 561 HA3 GLY 80 2HA GLY 80 -8.245 2.672 -5.811 562 H VAL 81 H VAL 81 -10.274 2.433 -4.682 563 HA VAL 81 HA VAL 81 -10.773 -0.386 -4.302 564 HB VAL 81 HB VAL 81 -12.912 0.406 -3.004 565 HG11 VAL 81 1HG1 VAL 81 -11.879 -0.024 -0.843 566 HG12 VAL 81 2HG1 VAL 81 -11.345 -1.138 -2.107 567 HG13 VAL 81 3HG1 VAL 81 -10.257 0.173 -1.571 568 HG21 VAL 81 3HG2 VAL 81 -12.463 2.840 -3.103 569 HG22 VAL 81 1HG2 VAL 81 -12.652 2.233 -1.446 570 HG23 VAL 81 2HG2 VAL 81 -11.032 2.605 -2.075 571 H VAL 82 H VAL 82 -12.654 -0.974 -5.467 572 HA VAL 82 HA VAL 82 -14.229 1.247 -6.586 573 HB VAL 82 HB VAL 82 -12.884 0.285 -8.408 574 HG11 VAL 82 1HG1 VAL 82 -13.376 -1.982 -9.280 575 HG12 VAL 82 2HG1 VAL 82 -12.600 -2.030 -7.687 576 HG13 VAL 82 3HG1 VAL 82 -14.357 -2.313 -7.836 577 HG21 VAL 82 3HG2 VAL 82 -15.119 1.183 -8.817 578 HG22 VAL 82 1HG2 VAL 82 -14.706 -0.116 -9.967 579 HG23 VAL 82 2HG2 VAL 82 -15.830 -0.415 -8.635 580 H ASP 83 H ASP 83 -16.576 0.701 -6.650 581 HA ASP 83 HA ASP 83 -17.321 -1.127 -4.569 582 HB2 ASP 83 1HB ASP 83 -18.330 1.262 -5.340 583 HB3 ASP 83 2HB ASP 83 -19.266 0.232 -6.422 584 H GLY 84 H GLY 84 -18.611 -2.909 -5.032 585 HA2 GLY 84 1HA GLY 84 -19.286 -3.657 -7.791 586 HA3 GLY 84 2HA GLY 84 -18.370 -4.844 -6.842 587 H GLU 85 H GLU 85 -20.508 -2.603 -5.118 588 HA GLU 85 HA GLU 85 -22.689 -4.596 -5.216 589 HB2 GLU 85 1HB GLU 85 -23.246 -4.105 -2.834 590 HB3 GLU 85 2HB GLU 85 -21.964 -5.220 -3.222 591 HG2 GLU 85 1HG GLU 85 -20.313 -3.435 -2.618 592 HG3 GLU 85 2HG GLU 85 -21.654 -2.459 -2.009 593 H ASP 86 H ASP 86 -24.767 -3.723 -4.612 594 HA ASP 86 HA ASP 86 -25.419 -0.950 -5.102 595 HB2 ASP 86 1HB ASP 86 -24.735 -1.449 -7.375 596 HB3 ASP 86 2HB ASP 86 -25.630 -2.970 -7.364 597 H GLY 87 H GLY 87 -26.626 -1.381 -3.238 598 HA2 GLY 87 1HA GLY 87 -29.111 -1.599 -3.033 599 HA3 GLY 87 2HA GLY 87 -28.906 -3.304 -3.441 600 H VAL 88 H VAL 88 -26.322 -3.390 -1.735 601 HA VAL 88 HA VAL 88 -27.672 -3.902 0.820 602 HB VAL 88 HB VAL 88 -26.185 -5.591 0.177 603 HG11 VAL 88 1HG1 VAL 88 -24.042 -3.469 -0.168 604 HG12 VAL 88 2HG1 VAL 88 -23.746 -5.214 -0.123 605 HG13 VAL 88 3HG1 VAL 88 -24.766 -4.539 -1.394 606 HG21 VAL 88 3HG2 VAL 88 -24.744 -4.021 2.338 607 HG22 VAL 88 1HG2 VAL 88 -26.197 -5.034 2.594 608 HG23 VAL 88 2HG2 VAL 88 -24.681 -5.768 2.036 609 H VAL 89 H VAL 89 -27.517 -2.622 2.626 610 HA VAL 89 HA VAL 89 -26.220 0.034 2.236 611 HB VAL 89 HB VAL 89 -28.620 -0.791 3.931 612 HG11 VAL 89 1HG1 VAL 89 -28.816 1.782 4.147 613 HG12 VAL 89 2HG1 VAL 89 -27.579 0.982 5.119 614 HG13 VAL 89 3HG1 VAL 89 -27.109 1.825 3.638 615 HG21 VAL 89 3HG2 VAL 89 -29.197 -0.731 1.561 616 HG22 VAL 89 1HG2 VAL 89 -29.832 0.735 2.314 617 HG23 VAL 89 2HG2 VAL 89 -28.340 0.803 1.342 618 H ASN 90 H ASN 90 -24.231 -0.773 2.754 619 HA ASN 90 HA ASN 90 -23.660 -2.253 5.217 620 HB2 ASN 90 1HB ASN 90 -22.485 -2.253 2.888 621 HB3 ASN 90 2HB ASN 90 -21.516 -0.960 3.627 622 HD21 ASN 90 1HD2 ASN 90 -20.916 -3.631 2.846 623 HD22 ASN 90 2HD2 ASN 90 -19.908 -4.131 4.226 624 H GLU 91 H GLU 91 -21.628 -1.184 6.549 625 HA GLU 91 HA GLU 91 -22.157 1.676 7.126 626 HB2 GLU 91 1HB GLU 91 -20.666 -0.523 8.568 627 HB3 GLU 91 2HB GLU 91 -19.980 1.096 8.615 628 HG2 GLU 91 1HG GLU 91 -22.416 1.869 9.259 629 HG3 GLU 91 2HG GLU 91 -22.627 0.180 9.723 630 HA PRO 92 HA PRO 92 -18.880 2.587 4.351 631 HB2 PRO 92 1HB PRO 92 -18.139 5.111 5.100 632 HB3 PRO 92 2HB PRO 92 -19.847 4.754 4.674 633 HG2 PRO 92 1HG PRO 92 -18.649 4.805 7.458 634 HG3 PRO 92 2HG PRO 92 -20.072 5.707 6.845 635 HD2 PRO 92 1HD PRO 92 -20.320 3.306 8.111 636 HD3 PRO 92 2HD PRO 92 -21.399 3.791 6.766 637 H MET 93 H MET 93 -16.462 3.732 4.382 638 HA MET 93 HA MET 93 -14.910 2.399 6.499 639 HB2 MET 93 1HB MET 93 -13.812 0.984 5.068 640 HB3 MET 93 2HB MET 93 -15.466 0.864 4.553 641 HG2 MET 93 1HG MET 93 -15.098 2.065 2.578 642 HG3 MET 93 2HG MET 93 -13.559 2.727 3.117 643 HE1 MET 93 3HE MET 93 -11.292 1.463 3.217 644 HE2 MET 93 1HE MET 93 -11.960 0.267 4.343 645 HE3 MET 93 2HE MET 93 -11.100 -0.279 2.895 646 H GLN 94 H GLN 94 -12.526 2.762 6.136 647 HA GLN 94 HA GLN 94 -11.780 5.031 4.492 648 HB2 GLN 94 1HB GLN 94 -11.396 5.119 7.525 649 HB3 GLN 94 2HB GLN 94 -10.375 6.021 6.402 650 HG2 GLN 94 1HG GLN 94 -12.559 6.923 5.392 651 HG3 GLN 94 2HG GLN 94 -13.330 6.363 6.888 652 HE21 GLN 94 1HE2 GLN 94 -10.835 8.471 5.491 653 HE22 GLN 94 2HE2 GLN 94 -10.940 9.730 6.720 654 H TRP 95 H TRP 95 -9.418 5.257 4.458 655 HA TRP 95 HA TRP 95 -7.859 2.856 5.159 656 HB2 TRP 95 1HB TRP 95 -8.286 4.093 2.452 657 HB3 TRP 95 2HB TRP 95 -6.628 3.778 2.903 658 HD1 TRP 95 HD TRP 95 -9.162 1.171 4.014 659 HE1 TRP 95 1HE TRP 95 -8.764 -0.986 2.696 660 HE3 TRP 95 3HE TRP 95 -5.706 2.880 0.633 661 HZ2 TRP 95 2HZ TRP 95 -7.159 -1.881 0.511 662 HZ3 TRP 95 3HZ TRP 95 -4.724 1.309 -1.019 663 HH2 TRP 95 HH TRP 95 -5.459 -1.052 -1.123 664 H VAL 96 H VAL 96 -5.989 3.505 6.177 665 HA VAL 96 HA VAL 96 -5.008 6.268 5.703 666 HB VAL 96 HB VAL 96 -4.251 4.674 8.161 667 HG11 VAL 96 1HG1 VAL 96 -3.625 6.822 9.077 668 HG12 VAL 96 2HG1 VAL 96 -2.828 6.562 7.528 669 HG13 VAL 96 3HG1 VAL 96 -4.226 7.664 7.634 670 HG21 VAL 96 3HG2 VAL 96 -5.849 5.984 9.517 671 HG22 VAL 96 1HG2 VAL 96 -6.595 6.591 8.019 672 HG23 VAL 96 2HG2 VAL 96 -6.635 4.850 8.436 673 H VAL 97 H VAL 97 -2.964 6.141 4.647 674 HA VAL 97 HA VAL 97 -1.520 3.569 4.955 675 HB VAL 97 HB VAL 97 -1.102 5.209 2.539 676 HG11 VAL 97 1HG1 VAL 97 -0.938 2.240 2.945 677 HG12 VAL 97 2HG1 VAL 97 -0.435 3.150 1.503 678 HG13 VAL 97 3HG1 VAL 97 0.407 3.394 3.037 679 HG21 VAL 97 3HG2 VAL 97 -3.459 3.349 2.689 680 HG22 VAL 97 1HG2 VAL 97 -3.437 5.058 2.228 681 HG23 VAL 97 2HG2 VAL 97 -2.686 3.863 1.173 682 H THR 98 H THR 98 0.710 3.947 5.335 683 HA THR 98 HA THR 98 1.520 6.747 5.897 684 HB THR 98 HB THR 98 2.097 4.352 7.695 685 HG1 THR 98 1HG THR 98 0.141 6.328 8.293 686 HG21 THR 98 3HG2 THR 98 2.731 6.033 9.334 687 HG22 THR 98 1HG2 THR 98 2.283 7.352 8.231 688 HG23 THR 98 2HG2 THR 98 3.645 6.288 7.844 689 H VAL 99 H VAL 99 3.630 7.035 5.101 690 HA VAL 99 HA VAL 99 5.056 4.553 4.181 691 HB VAL 99 HB VAL 99 5.323 7.313 2.999 692 HG11 VAL 99 1HG1 VAL 99 7.241 5.867 2.650 693 HG12 VAL 99 2HG1 VAL 99 6.185 4.583 1.999 694 HG13 VAL 99 3HG1 VAL 99 6.392 6.112 1.126 695 HG21 VAL 99 3HG2 VAL 99 3.785 5.001 1.735 696 HG22 VAL 99 1HG2 VAL 99 2.989 6.380 2.516 697 HG23 VAL 99 2HG2 VAL 99 3.995 6.624 1.093 698 H TYR 100 H TYR 100 7.214 4.367 4.742 699 HA TYR 100 HA TYR 100 8.445 6.483 6.400 700 HB2 TYR 100 1HB TYR 100 8.557 3.473 6.855 701 HB3 TYR 100 2HB TYR 100 9.598 4.642 7.654 702 HD1 TYR 100 2HD TYR 100 5.901 3.775 7.203 703 HD2 TYR 100 1HD TYR 100 8.965 5.316 9.803 704 HE1 TYR 100 2HE TYR 100 4.242 4.023 9.000 705 HE2 TYR 100 1HE TYR 100 7.296 5.603 11.608 706 HH TYR 100 HH TYR 100 3.902 4.565 11.370 707 H LYS 101 H LYS 101 10.734 6.647 5.991 708 HA LYS 101 HA LYS 101 11.686 5.251 3.517 709 HB2 LYS 101 1HB LYS 101 11.194 7.794 3.517 710 HB3 LYS 101 2HB LYS 101 12.726 7.942 4.387 711 HG2 LYS 101 1HG LYS 101 13.898 6.864 2.504 712 HG3 LYS 101 2HG LYS 101 12.360 6.300 1.884 713 HD2 LYS 101 1HD LYS 101 13.049 7.816 0.432 714 HD3 LYS 101 2HD LYS 101 11.765 8.645 1.266 715 HE2 LYS 101 1HE LYS 101 14.748 9.064 1.848 716 HE3 LYS 101 2HE LYS 101 13.847 9.992 0.656 717 HZ1 LYS 101 3HZ LYS 101 12.374 10.735 2.490 718 HZ2 LYS 101 1HZ LYS 101 13.906 11.250 2.602 719 HZ3 LYS 101 2HZ LYS 101 13.441 10.034 3.573 720 H ASN 102 H ASN 102 14.326 6.088 3.869 721 HA ASN 102 HA ASN 102 15.483 4.527 5.998 722 HB2 ASN 102 1HB ASN 102 17.571 5.277 5.316 723 HB3 ASN 102 2HB ASN 102 16.693 4.989 3.838 724 HD21 ASN 102 1HD2 ASN 102 16.028 7.073 2.573 725 HD22 ASN 102 2HD2 ASN 102 17.047 8.473 2.900 726 H GLY 103 H GLY 103 14.057 5.356 7.669 727 HA2 GLY 103 1HA GLY 103 15.442 6.676 9.575 728 HA3 GLY 103 2HA GLY 103 14.714 8.043 8.723 729 H LYS 104 H LYS 104 12.323 7.941 8.356 730 HA LYS 104 HA LYS 104 10.739 6.643 10.411 731 HB2 LYS 104 1HB LYS 104 10.095 8.538 11.562 732 HB3 LYS 104 2HB LYS 104 11.845 8.441 11.566 733 HG2 LYS 104 1HG LYS 104 11.977 10.505 10.819 734 HG3 LYS 104 2HG LYS 104 11.219 10.040 9.305 735 HD2 LYS 104 1HD LYS 104 9.857 11.791 10.104 736 HD3 LYS 104 2HD LYS 104 8.973 10.294 10.454 737 HE2 LYS 104 1HE LYS 104 9.821 10.315 12.774 738 HE3 LYS 104 2HE LYS 104 10.694 11.813 12.406 739 HZ1 LYS 104 3HZ LYS 104 8.608 12.246 13.522 740 HZ2 LYS 104 1HZ LYS 104 7.740 11.531 12.333 741 HZ3 LYS 104 2HZ LYS 104 8.569 12.877 11.990 742 H GLU 105 H GLU 105 8.486 8.007 10.267 743 HA GLU 105 HA GLU 105 7.105 7.633 7.927 744 HB2 GLU 105 1HB GLU 105 6.137 8.170 10.141 745 HB3 GLU 105 2HB GLU 105 6.809 9.802 10.031 746 HG2 GLU 105 1HG GLU 105 5.347 10.190 7.991 747 HG3 GLU 105 2HG GLU 105 4.556 8.655 8.359 748 H ILE 106 H ILE 106 6.811 8.807 6.052 749 HA ILE 106 HA ILE 106 8.012 11.512 5.779 750 HB ILE 106 HB ILE 106 8.862 10.812 3.533 751 HG12 ILE 106 1HG1 ILE 106 8.941 7.928 4.319 752 HG13 ILE 106 2HG1 ILE 106 7.370 8.517 3.817 753 HG21 ILE 106 1HG2 ILE 106 10.191 9.345 5.833 754 HG22 ILE 106 2HG2 ILE 106 10.950 9.955 4.349 755 HG23 ILE 106 3HG2 ILE 106 10.303 11.081 5.552 756 HD11 ILE 106 3HD1 ILE 106 9.847 8.889 2.147 757 HD12 ILE 106 1HD1 ILE 106 8.661 7.591 1.924 758 HD13 ILE 106 2HD1 ILE 106 8.184 9.289 1.708 759 H GLU 107 H GLU 107 5.244 9.505 5.218 760 HA GLU 107 HA GLU 107 4.158 11.571 3.429 761 HB2 GLU 107 1HB GLU 107 5.130 9.421 2.190 762 HB3 GLU 107 2HB GLU 107 3.611 8.709 2.714 763 HG2 GLU 107 1HG GLU 107 3.854 11.283 1.156 764 HG3 GLU 107 2HG GLU 107 3.606 9.710 0.395 765 H LYS 108 H LYS 108 1.835 11.636 3.549 766 HA LYS 108 HA LYS 108 0.523 9.893 5.479 767 HB2 LYS 108 1HB LYS 108 1.601 11.765 6.780 768 HB3 LYS 108 2HB LYS 108 0.629 12.916 5.864 769 HG2 LYS 108 1HG LYS 108 -1.451 11.791 6.759 770 HG3 LYS 108 2HG LYS 108 -0.386 10.682 7.657 771 HD2 LYS 108 1HD LYS 108 0.677 12.766 8.696 772 HD3 LYS 108 2HD LYS 108 -0.710 13.677 8.054 773 HE2 LYS 108 1HE LYS 108 -2.271 12.291 9.317 774 HE3 LYS 108 2HE LYS 108 -0.981 11.156 9.750 775 HZ1 LYS 108 3HZ LYS 108 0.079 12.882 11.008 776 HZ2 LYS 108 1HZ LYS 108 -1.461 12.627 11.550 777 HZ3 LYS 108 2HZ LYS 108 -1.157 13.954 10.645 778 H LYS 109 H LYS 109 -0.649 9.181 3.626 779 HA LYS 109 HA LYS 109 -2.866 11.132 3.132 780 HB2 LYS 109 1HB LYS 109 -3.294 10.415 0.943 781 HB3 LYS 109 2HB LYS 109 -1.577 10.763 1.040 782 HG2 LYS 109 1HG LYS 109 -1.085 8.765 0.207 783 HG3 LYS 109 2HG LYS 109 -1.806 7.994 1.609 784 HD2 LYS 109 1HD LYS 109 -2.913 6.977 -0.099 785 HD3 LYS 109 2HD LYS 109 -4.080 8.229 0.313 786 HE2 LYS 109 1HE LYS 109 -1.988 8.530 -1.904 787 HE3 LYS 109 2HE LYS 109 -3.557 7.766 -2.182 788 HZ1 LYS 109 3HZ LYS 109 -3.572 10.024 -2.827 789 HZ2 LYS 109 1HZ LYS 109 -3.254 10.552 -1.307 790 HZ3 LYS 109 2HZ LYS 109 -4.672 9.757 -1.663 791 H SER 110 H SER 110 -5.050 10.389 3.232 792 HA SER 110 HA SER 110 -5.586 7.623 3.842 793 HB2 SER 110 1HB SER 110 -7.174 9.001 5.548 794 HB3 SER 110 2HB SER 110 -5.552 8.390 5.948 795 HG SER 110 HG SER 110 -5.843 10.508 6.645 796 H LEU 111 H LEU 111 -7.919 7.198 3.448 797 HA LEU 111 HA LEU 111 -9.156 9.076 1.537 798 HB2 LEU 111 1HB LEU 111 -9.226 6.073 1.155 799 HB3 LEU 111 2HB LEU 111 -9.701 7.329 0.046 800 HG LEU 111 HG LEU 111 -7.376 7.846 -0.508 801 HD11 LEU 111 1HD1 LEU 111 -6.029 7.303 1.297 802 HD12 LEU 111 2HD1 LEU 111 -5.796 5.837 0.340 803 HD13 LEU 111 3HD1 LEU 111 -6.991 5.856 1.682 804 HD21 LEU 111 3HD2 LEU 111 -7.011 5.758 -1.721 805 HD22 LEU 111 1HD2 LEU 111 -8.755 6.008 -1.625 806 HD23 LEU 111 2HD2 LEU 111 -7.994 4.862 -0.516 807 H VAL 112 H VAL 112 -11.122 7.621 1.004 808 HA VAL 112 HA VAL 112 -12.698 6.664 3.246 809 HB VAL 112 HB VAL 112 -12.628 9.122 3.524 810 HG11 VAL 112 1HG1 VAL 112 -13.979 10.622 2.152 811 HG12 VAL 112 2HG1 VAL 112 -12.646 9.919 1.233 812 HG13 VAL 112 3HG1 VAL 112 -14.296 9.307 0.998 813 HG21 VAL 112 3HG2 VAL 112 -14.500 7.776 4.457 814 HG22 VAL 112 1HG2 VAL 112 -14.986 9.434 4.079 815 HG23 VAL 112 2HG2 VAL 112 -15.451 8.099 3.001 816 H PHE 113 H PHE 113 -14.613 5.575 2.628 817 HA PHE 113 HA PHE 113 -15.712 5.990 0.006 818 HB2 PHE 113 1HB PHE 113 -13.897 3.907 0.134 819 HB3 PHE 113 2HB PHE 113 -15.354 3.084 0.639 820 HD1 PHE 113 2HD PHE 113 -13.743 5.071 -2.051 821 HD2 PHE 113 1HD PHE 113 -17.096 2.586 -0.986 822 HE1 PHE 113 2HE PHE 113 -14.406 4.930 -4.451 823 HE2 PHE 113 1HE PHE 113 -17.781 2.466 -3.366 824 HZ PHE 113 HZ PHE 113 -16.435 3.640 -5.094 825 H ARG 114 H ARG 114 -18.000 5.160 0.057 826 HA ARG 114 HA ARG 114 -18.958 4.229 2.672 827 HB2 ARG 114 1HB ARG 114 -20.296 6.456 1.282 828 HB3 ARG 114 2HB ARG 114 -20.534 5.931 2.915 829 HG2 ARG 114 1HG ARG 114 -18.085 6.835 3.253 830 HG3 ARG 114 2HG ARG 114 -18.480 7.854 1.840 831 HD2 ARG 114 1HD ARG 114 -19.939 7.611 4.509 832 HD3 ARG 114 2HD ARG 114 -19.015 9.015 3.941 833 HE ARG 114 HE ARG 114 -21.020 8.642 2.054 834 HH11 ARG 114 1HH1 ARG 114 -21.162 8.811 5.655 835 HH12 ARG 114 2HH1 ARG 114 -22.525 9.872 5.634 836 HH21 ARG 114 1HH2 ARG 114 -22.845 10.083 2.155 837 HH22 ARG 114 2HH2 ARG 114 -23.649 10.344 3.675 838 H ASP 115 H ASP 115 -18.828 3.360 -0.184 839 HA ASP 115 HA ASP 115 -19.939 2.167 -1.721 840 HB2 ASP 115 1HB ASP 115 -21.634 0.880 -1.091 841 HB3 ASP 115 2HB ASP 115 -21.096 1.456 0.478 842 H GLY 116 H GLY 116 -21.611 2.202 -3.393 843 HA2 GLY 116 1HA GLY 116 -23.569 4.130 -3.709 844 HA3 GLY 116 2HA GLY 116 -22.112 4.854 -4.414 845 H LYS 117 H LYS 117 -20.908 3.181 -5.939 846 HA LYS 117 HA LYS 117 -22.290 1.225 -7.356 847 HB2 LYS 117 1HB LYS 117 -22.702 4.063 -8.276 848 HB3 LYS 117 2HB LYS 117 -22.069 3.012 -9.522 849 HG2 LYS 117 1HG LYS 117 -24.567 2.390 -7.903 850 HG3 LYS 117 2HG LYS 117 -24.573 3.219 -9.437 851 HD2 LYS 117 1HD LYS 117 -23.408 0.412 -9.099 852 HD3 LYS 117 2HD LYS 117 -25.098 0.727 -9.421 853 HE2 LYS 117 1HE LYS 117 -24.170 2.169 -11.447 854 HE3 LYS 117 2HE LYS 117 -22.728 1.154 -11.247 855 HZ1 LYS 117 3HZ LYS 117 -25.499 0.306 -11.775 856 HZ2 LYS 117 1HZ LYS 117 -24.258 -0.768 -11.462 857 HZ3 LYS 117 2HZ LYS 117 -24.239 0.154 -12.813 858 H GLU 118 H GLU 118 -20.927 0.575 -9.230 859 HA GLU 118 HA GLU 118 -18.175 0.730 -8.724 860 HB2 GLU 118 1HB GLU 118 -17.842 -0.468 -10.760 861 HB3 GLU 118 2HB GLU 118 -19.287 -1.072 -9.946 862 HG2 GLU 118 1HG GLU 118 -20.616 0.486 -11.560 863 HG3 GLU 118 2HG GLU 118 -19.106 0.591 -12.467 864 H ILE 119 H ILE 119 -16.414 1.639 -9.980 865 HA ILE 119 HA ILE 119 -16.747 4.124 -11.407 866 HB ILE 119 HB ILE 119 -15.516 5.475 -9.758 867 HG12 ILE 119 1HG1 ILE 119 -15.764 4.816 -7.350 868 HG13 ILE 119 2HG1 ILE 119 -16.054 3.157 -7.866 869 HG21 ILE 119 1HG2 ILE 119 -17.985 5.600 -10.008 870 HG22 ILE 119 2HG2 ILE 119 -18.131 4.511 -8.622 871 HG23 ILE 119 3HG2 ILE 119 -17.373 6.092 -8.422 872 HD11 ILE 119 3HD1 ILE 119 -13.577 4.724 -8.599 873 HD12 ILE 119 1HD1 ILE 119 -13.691 3.740 -7.125 874 HD13 ILE 119 2HD1 ILE 119 -13.800 2.973 -8.717 875 H SER 120 H SER 120 -14.335 5.145 -11.319 876 HA SER 120 HA SER 120 -12.272 3.275 -10.746 877 HB2 SER 120 1HB SER 120 -11.058 3.766 -12.984 878 HB3 SER 120 2HB SER 120 -12.260 2.482 -12.904 879 HG SER 120 HG SER 120 -13.791 4.080 -13.718 880 H THR 121 H THR 121 -11.031 4.523 -9.380 881 HA THR 121 HA THR 121 -10.657 7.380 -10.010 882 HB THR 121 HB THR 121 -10.845 7.718 -7.479 883 HG1 THR 121 1HG THR 121 -11.921 6.233 -6.303 884 HG21 THR 121 3HG2 THR 121 -12.564 8.576 -9.025 885 HG22 THR 121 1HG2 THR 121 -13.275 8.028 -7.498 886 HG23 THR 121 2HG2 THR 121 -13.423 7.021 -8.951 887 H ASP 122 H ASP 122 -8.661 7.799 -10.122 888 HA ASP 122 HA ASP 122 -6.523 6.159 -9.062 889 HB2 ASP 122 1HB ASP 122 -6.516 8.881 -10.381 890 HB3 ASP 122 2HB ASP 122 -5.060 8.073 -9.809 891 H ASP 123 H ASP 123 -8.101 6.590 -6.929 892 HA ASP 123 HA ASP 123 -7.435 8.803 -5.189 893 HB2 ASP 123 1HB ASP 123 -9.224 6.680 -5.107 894 HB3 ASP 123 2HB ASP 123 -8.026 6.170 -3.958 895 H LEU 124 H LEU 124 -5.786 5.880 -6.143 896 HA LEU 124 HA LEU 124 -3.610 6.407 -4.196 897 HB2 LEU 124 1HB LEU 124 -5.245 4.169 -4.088 898 HB3 LEU 124 2HB LEU 124 -4.034 3.649 -5.230 899 HG LEU 124 HG LEU 124 -2.251 4.370 -3.525 900 HD11 LEU 124 1HD1 LEU 124 -3.766 5.781 -2.144 901 HD12 LEU 124 2HD1 LEU 124 -3.014 4.505 -1.183 902 HD13 LEU 124 3HD1 LEU 124 -4.711 4.349 -1.701 903 HD21 LEU 124 3HD2 LEU 124 -2.691 2.028 -3.889 904 HD22 LEU 124 1HD2 LEU 124 -4.211 2.105 -2.988 905 HD23 LEU 124 2HD2 LEU 124 -2.650 2.276 -2.140 906 H ASN 125 H ASN 125 -2.066 7.224 -5.372 907 HA ASN 125 HA ASN 125 -0.776 5.569 -7.303 908 HB2 ASN 125 1HB ASN 125 -2.378 6.662 -8.885 909 HB3 ASN 125 2HB ASN 125 -1.644 8.224 -8.490 910 HD21 ASN 125 1HD2 ASN 125 -0.122 8.782 -10.045 911 HD22 ASN 125 2HD2 ASN 125 0.905 7.661 -10.921 912 H LEU 126 H LEU 126 0.531 5.806 -5.393 913 HA LEU 126 HA LEU 126 2.105 8.302 -5.071 914 HB2 LEU 126 1HB LEU 126 1.598 5.878 -3.394 915 HB3 LEU 126 2HB LEU 126 3.302 6.318 -3.509 916 HG LEU 126 HG LEU 126 2.777 8.647 -2.839 917 HD11 LEU 126 1HD1 LEU 126 0.609 9.113 -1.765 918 HD12 LEU 126 2HD1 LEU 126 0.006 7.509 -2.270 919 HD13 LEU 126 3HD1 LEU 126 0.414 8.749 -3.487 920 HD21 LEU 126 3HD2 LEU 126 2.000 6.383 -0.961 921 HD22 LEU 126 1HD2 LEU 126 2.413 8.031 -0.454 922 HD23 LEU 126 2HD2 LEU 126 3.622 7.012 -1.262 923 H TYR 127 H TYR 127 4.199 8.330 -5.456 924 HA TYR 127 HA TYR 127 5.664 6.060 -6.673 925 HB2 TYR 127 1HB TYR 127 4.894 7.419 -8.557 926 HB3 TYR 127 2HB TYR 127 5.517 8.884 -7.808 927 HD1 TYR 127 2HD TYR 127 6.532 5.577 -9.300 928 HD2 TYR 127 1HD TYR 127 7.788 9.576 -8.204 929 HE1 TYR 127 2HE TYR 127 8.629 5.263 -10.560 930 HE2 TYR 127 1HE TYR 127 9.841 9.288 -9.548 931 HH TYR 127 HH TYR 127 10.407 6.487 -11.658 932 H TYR 128 H TYR 128 7.527 5.811 -5.565 933 HA TYR 128 HA TYR 128 8.939 8.158 -4.580 934 HB2 TYR 128 1HB TYR 128 8.334 5.664 -2.943 935 HB3 TYR 128 2HB TYR 128 9.836 6.551 -2.708 936 HD1 TYR 128 2HD TYR 128 9.485 9.249 -2.677 937 HD2 TYR 128 1HD TYR 128 6.613 6.277 -1.420 938 HE1 TYR 128 2HE TYR 128 8.326 10.964 -1.338 939 HE2 TYR 128 1HE TYR 128 5.417 8.017 -0.103 940 HH TYR 128 HH TYR 128 5.892 11.325 -0.320 941 H ASN 129 H ASN 129 11.118 7.970 -4.806 942 HA ASN 129 HA ASN 129 12.291 5.785 -6.285 943 HB2 ASN 129 1HB ASN 129 12.672 7.089 -8.251 944 HB3 ASN 129 2HB ASN 129 10.967 7.219 -7.909 945 HD21 ASN 129 1HD2 ASN 129 13.984 8.981 -8.066 946 HD22 ASN 129 2HD2 ASN 129 13.317 10.587 -7.762 Start of MODEL 17 1 H1 GLY 1 H GLY 1 38.297 -10.887 1.787 2 HA2 GLY 1 1HA GLY 1 36.163 -9.689 1.125 3 HA3 GLY 1 2HA GLY 1 37.305 -8.686 2.067 4 H ASP 2 H ASP 2 35.842 -9.230 -1.029 5 HA ASP 2 HA ASP 2 37.794 -7.609 -2.494 6 HB2 ASP 2 1HB ASP 2 37.357 -10.443 -3.469 7 HB3 ASP 2 2HB ASP 2 38.709 -9.361 -3.777 8 H ASP 3 H ASP 3 35.399 -6.839 -1.903 9 HA ASP 3 HA ASP 3 33.437 -7.779 -3.865 10 HB2 ASP 3 1HB ASP 3 32.087 -8.711 -2.134 11 HB3 ASP 3 2HB ASP 3 33.732 -9.384 -2.125 12 H ASP 4 H ASP 4 32.967 -5.961 -4.761 13 HA ASP 4 HA ASP 4 33.124 -3.387 -3.771 14 HB2 ASP 4 1HB ASP 4 31.378 -4.399 -6.066 15 HB3 ASP 4 2HB ASP 4 32.031 -2.764 -5.887 16 H GLU 5 H GLU 5 31.111 -1.809 -4.275 17 HA GLU 5 HA GLU 5 28.482 -2.913 -3.880 18 HB2 GLU 5 1HB GLU 5 27.676 -1.625 -2.099 19 HB3 GLU 5 2HB GLU 5 28.970 -2.661 -1.546 20 HG2 GLU 5 1HG GLU 5 30.079 -0.950 -0.626 21 HG3 GLU 5 2HG GLU 5 30.097 -0.044 -2.113 22 HA PRO 6 HA PRO 6 29.043 0.638 -6.790 23 HB2 PRO 6 1HB PRO 6 27.932 -0.518 -9.002 24 HB3 PRO 6 2HB PRO 6 29.637 -0.777 -8.507 25 HG2 PRO 6 1HG PRO 6 27.229 -2.555 -8.009 26 HG3 PRO 6 2HG PRO 6 28.854 -3.030 -8.612 27 HD2 PRO 6 1HD PRO 6 28.131 -3.260 -5.988 28 HD3 PRO 6 2HD PRO 6 29.807 -2.844 -6.480 29 H GLY 7 H GLY 7 27.526 2.209 -6.543 30 HA2 GLY 7 1HA GLY 7 24.803 2.089 -7.180 31 HA3 GLY 7 2HA GLY 7 24.956 1.654 -5.467 32 H GLY 8 H GLY 8 24.414 4.263 -7.443 33 HA2 GLY 8 1HA GLY 8 26.128 6.261 -6.331 34 HA3 GLY 8 2HA GLY 8 24.702 6.530 -7.329 35 H LYS 9 H LYS 9 22.610 5.516 -5.701 36 HA LYS 9 HA LYS 9 22.734 6.181 -3.029 37 HB2 LYS 9 1HB LYS 9 22.533 8.541 -4.559 38 HB3 LYS 9 2HB LYS 9 20.849 8.175 -4.166 39 HG2 LYS 9 1HG LYS 9 21.520 8.007 -1.752 40 HG3 LYS 9 2HG LYS 9 23.183 8.422 -2.217 41 HD2 LYS 9 1HD LYS 9 22.295 10.588 -3.163 42 HD3 LYS 9 2HD LYS 9 20.688 10.141 -2.522 43 HE2 LYS 9 1HE LYS 9 21.790 9.911 -0.247 44 HE3 LYS 9 2HE LYS 9 23.271 10.562 -0.947 45 HZ1 LYS 9 3HZ LYS 9 22.034 12.596 -1.479 46 HZ2 LYS 9 1HZ LYS 9 22.012 12.268 0.107 47 HZ3 LYS 9 2HZ LYS 9 20.669 11.959 -0.797 48 H GLY 10 H GLY 10 20.515 5.986 -2.115 49 HA2 GLY 10 1HA GLY 10 18.213 5.599 -3.765 50 HA3 GLY 10 2HA GLY 10 18.701 4.084 -2.963 51 H ALA 11 H ALA 11 17.311 3.873 -1.237 52 HA ALA 11 HA ALA 11 17.784 5.438 1.055 53 HB1 ALA 11 1HB ALA 11 16.047 6.969 0.084 54 HB2 ALA 11 2HB ALA 11 14.907 5.604 0.033 55 HB3 ALA 11 3HB ALA 11 15.532 6.225 1.585 56 H MET 12 H MET 12 15.984 4.399 2.847 57 HA MET 12 HA MET 12 15.040 1.757 1.905 58 HB2 MET 12 1HB MET 12 14.655 2.929 4.677 59 HB3 MET 12 2HB MET 12 14.458 1.274 4.164 60 HG2 MET 12 1HG MET 12 17.104 2.771 4.387 61 HG3 MET 12 2HG MET 12 16.382 1.672 5.520 62 HE1 MET 12 3HE MET 12 15.889 -0.717 5.189 63 HE2 MET 12 1HE MET 12 15.390 -0.922 3.492 64 HE3 MET 12 2HE MET 12 16.788 -1.823 4.113 65 H TYR 13 H TYR 13 12.812 1.506 2.492 66 HA TYR 13 HA TYR 13 11.121 3.806 2.992 67 HB2 TYR 13 1HB TYR 13 10.968 2.362 0.324 68 HB3 TYR 13 2HB TYR 13 9.575 3.127 1.057 69 HD1 TYR 13 1HD TYR 13 9.835 5.617 1.848 70 HD2 TYR 13 2HD TYR 13 12.096 3.741 -1.306 71 HE1 TYR 13 1HE TYR 13 10.264 7.824 0.819 72 HE2 TYR 13 2HE TYR 13 12.517 5.939 -2.358 73 HH TYR 13 HH TYR 13 12.284 8.391 -2.065 74 H GLU 14 H GLU 14 9.060 3.205 3.732 75 HA GLU 14 HA GLU 14 8.273 0.394 4.082 76 HB2 GLU 14 1HB GLU 14 9.703 0.779 5.954 77 HB3 GLU 14 2HB GLU 14 9.162 2.443 6.130 78 HG2 GLU 14 1HG GLU 14 6.983 1.680 6.996 79 HG3 GLU 14 2HG GLU 14 7.482 0.000 6.796 80 H VAL 15 H VAL 15 6.075 0.316 3.942 81 HA VAL 15 HA VAL 15 4.469 2.797 4.325 82 HB VAL 15 HB VAL 15 4.671 2.298 1.927 83 HG11 VAL 15 1HG1 VAL 15 3.705 0.318 0.895 84 HG12 VAL 15 2HG1 VAL 15 4.866 -0.222 2.114 85 HG13 VAL 15 3HG1 VAL 15 3.139 -0.289 2.460 86 HG21 VAL 15 3HG2 VAL 15 1.817 1.727 2.767 87 HG22 VAL 15 1HG2 VAL 15 2.555 3.330 2.811 88 HG23 VAL 15 2HG2 VAL 15 2.392 2.470 1.271 89 H THR 16 H THR 16 2.368 2.529 5.272 90 HA THR 16 HA THR 16 1.750 -0.199 6.298 91 HB THR 16 HB THR 16 0.596 1.070 8.143 92 HG1 THR 16 1HG THR 16 0.593 3.100 8.122 93 HG21 THR 16 3HG2 THR 16 2.703 0.032 8.636 94 HG22 THR 16 1HG2 THR 16 2.666 1.621 9.411 95 HG23 THR 16 2HG2 THR 16 3.623 1.390 7.935 96 H ILE 17 H ILE 17 -0.479 -0.754 6.421 97 HA ILE 17 HA ILE 17 -2.388 1.054 5.138 98 HB ILE 17 HB ILE 17 -1.625 -0.278 3.311 99 HG12 ILE 17 1HG1 ILE 17 -3.647 -1.514 2.602 100 HG13 ILE 17 2HG1 ILE 17 -4.242 -1.518 4.260 101 HG21 ILE 17 1HG2 ILE 17 -0.551 -2.168 4.464 102 HG22 ILE 17 2HG2 ILE 17 -2.165 -2.867 4.756 103 HG23 ILE 17 3HG2 ILE 17 -1.567 -2.652 3.108 104 HD11 ILE 17 3HD1 ILE 17 -4.408 0.958 4.210 105 HD12 ILE 17 1HD1 ILE 17 -3.764 0.954 2.548 106 HD13 ILE 17 2HD1 ILE 17 -5.347 0.217 2.904 107 H GLU 18 H GLU 18 -3.845 1.358 6.771 108 HA GLU 18 HA GLU 18 -4.571 -0.975 8.504 109 HB2 GLU 18 1HB GLU 18 -4.224 1.979 8.905 110 HB3 GLU 18 2HB GLU 18 -5.560 1.233 9.768 111 HG2 GLU 18 1HG GLU 18 -2.736 0.090 9.864 112 HG3 GLU 18 2HG GLU 18 -3.217 1.413 10.895 113 H GLN 19 H GLN 19 -6.695 -1.711 8.312 114 HA GLN 19 HA GLN 19 -8.366 -0.314 6.281 115 HB2 GLN 19 1HB GLN 19 -7.906 -3.261 6.912 116 HB3 GLN 19 2HB GLN 19 -9.235 -2.699 5.902 117 HG2 GLN 19 1HG GLN 19 -7.828 -1.943 4.185 118 HG3 GLN 19 2HG GLN 19 -6.436 -1.787 5.248 119 HE21 GLN 19 1HE2 GLN 19 -8.611 -4.631 4.326 120 HE22 GLN 19 2HE2 GLN 19 -7.253 -5.646 3.978 121 H SER 20 H SER 20 -10.245 0.542 7.000 122 HA SER 20 HA SER 20 -11.717 -0.904 9.103 123 HB2 SER 20 1HB SER 20 -11.519 2.118 8.954 124 HB3 SER 20 2HB SER 20 -12.268 1.154 10.250 125 HG SER 20 HG SER 20 -10.098 0.396 10.759 126 H GLY 21 H GLY 21 -14.003 0.045 9.238 127 HA2 GLY 21 1HA GLY 21 -16.019 0.185 8.200 128 HA3 GLY 21 2HA GLY 21 -15.249 0.804 6.738 129 H ASP 22 H ASP 22 -16.652 -0.769 5.591 130 HA ASP 22 HA ASP 22 -16.555 -3.497 6.503 131 HB2 ASP 22 1HB ASP 22 -18.480 -1.909 5.609 132 HB3 ASP 22 2HB ASP 22 -18.116 -2.646 4.068 133 H PHE 23 H PHE 23 -14.145 -3.354 5.870 134 HA PHE 23 HA PHE 23 -13.246 -3.711 3.199 135 HB2 PHE 23 1HB PHE 23 -11.125 -4.057 4.116 136 HB3 PHE 23 2HB PHE 23 -11.915 -2.950 5.222 137 HD1 PHE 23 2HD PHE 23 -12.520 -3.720 7.551 138 HD2 PHE 23 1HD PHE 23 -10.419 -6.299 4.786 139 HE1 PHE 23 2HE PHE 23 -11.843 -5.228 9.407 140 HE2 PHE 23 1HE PHE 23 -9.758 -7.755 6.639 141 HZ PHE 23 HZ PHE 23 -10.480 -7.243 8.965 142 H ARG 24 H ARG 24 -15.410 -5.611 3.850 143 HA ARG 24 HA ARG 24 -14.052 -8.183 3.250 144 HB2 ARG 24 1HB ARG 24 -16.743 -7.851 4.641 145 HB3 ARG 24 2HB ARG 24 -15.765 -9.304 4.483 146 HG2 ARG 24 1HG ARG 24 -15.349 -8.760 6.666 147 HG3 ARG 24 2HG ARG 24 -13.973 -7.962 5.904 148 HD2 ARG 24 1HD ARG 24 -15.257 -5.796 6.001 149 HD3 ARG 24 2HD ARG 24 -16.616 -6.626 6.696 150 HE ARG 24 HE ARG 24 -14.044 -5.891 7.954 151 HH11 ARG 24 1HH1 ARG 24 -17.035 -7.679 8.265 152 HH12 ARG 24 2HH1 ARG 24 -17.117 -7.652 9.994 153 HH21 ARG 24 1HH2 ARG 24 -14.282 -5.477 10.326 154 HH22 ARG 24 2HH2 ARG 24 -15.556 -6.333 11.132 155 H SER 25 H SER 25 -15.313 -5.769 1.630 156 HA SER 25 HA SER 25 -17.435 -7.230 0.131 157 HB2 SER 25 1HB SER 25 -17.565 -4.458 1.394 158 HB3 SER 25 2HB SER 25 -18.851 -5.258 0.497 159 HG SER 25 HG SER 25 -18.918 -5.347 2.857 160 H PHE 26 H PHE 26 -14.515 -5.611 -0.328 161 HA PHE 26 HA PHE 26 -15.397 -4.247 -2.818 162 HB2 PHE 26 1HB PHE 26 -13.545 -3.087 -0.715 163 HB3 PHE 26 2HB PHE 26 -14.034 -2.371 -2.241 164 HD1 PHE 26 1HD PHE 26 -16.626 -2.031 -2.614 165 HD2 PHE 26 2HD PHE 26 -14.684 -2.455 1.200 166 HE1 PHE 26 1HE PHE 26 -18.538 -0.951 -1.530 167 HE2 PHE 26 2HE PHE 26 -16.691 -1.407 2.317 168 HZ PHE 26 HZ PHE 26 -18.608 -0.650 0.919 169 H ILE 27 H ILE 27 -14.125 -4.964 -4.463 170 HA ILE 27 HA ILE 27 -11.872 -6.614 -4.172 171 HB ILE 27 HB ILE 27 -12.628 -4.855 -6.542 172 HG12 ILE 27 1HG1 ILE 27 -13.345 -7.792 -6.024 173 HG13 ILE 27 2HG1 ILE 27 -14.442 -6.431 -5.852 174 HG21 ILE 27 1HG2 ILE 27 -10.951 -7.433 -6.424 175 HG22 ILE 27 2HG2 ILE 27 -11.296 -6.473 -7.889 176 HG23 ILE 27 3HG2 ILE 27 -10.260 -5.819 -6.646 177 HD11 ILE 27 3HD1 ILE 27 -14.928 -7.462 -7.934 178 HD12 ILE 27 1HD1 ILE 27 -14.180 -5.887 -8.265 179 HD13 ILE 27 2HD1 ILE 27 -13.240 -7.391 -8.459 180 H LYS 28 H LYS 28 -10.394 -5.690 -2.682 181 HA LYS 28 HA LYS 28 -9.132 -3.143 -3.225 182 HB2 LYS 28 1HB LYS 28 -9.481 -4.672 -1.025 183 HB3 LYS 28 2HB LYS 28 -7.866 -5.213 -1.418 184 HG2 LYS 28 1HG LYS 28 -8.302 -2.251 -1.377 185 HG3 LYS 28 2HG LYS 28 -8.596 -3.066 0.136 186 HD2 LYS 28 1HD LYS 28 -6.381 -4.059 0.126 187 HD3 LYS 28 2HD LYS 28 -5.964 -3.260 -1.400 188 HE2 LYS 28 1HE LYS 28 -6.854 -1.785 1.109 189 HE3 LYS 28 2HE LYS 28 -5.154 -2.153 0.808 190 HZ1 LYS 28 3HZ LYS 28 -5.160 -0.633 -1.025 191 HZ2 LYS 28 1HZ LYS 28 -6.196 0.123 0.023 192 HZ3 LYS 28 2HZ LYS 28 -6.750 -0.743 -1.222 193 H SER 29 H SER 29 -6.710 -2.969 -3.603 194 HA SER 29 HA SER 29 -5.326 -5.086 -5.028 195 HB2 SER 29 1HB SER 29 -5.077 -3.385 -6.930 196 HB3 SER 29 2HB SER 29 -6.621 -4.258 -6.888 197 HG SER 29 HG SER 29 -7.608 -2.434 -6.105 198 H VAL 30 H VAL 30 -3.077 -4.763 -4.615 199 HA VAL 30 HA VAL 30 -2.214 -1.968 -4.248 200 HB VAL 30 HB VAL 30 -1.077 -4.120 -2.501 201 HG11 VAL 30 1HG1 VAL 30 -0.254 -2.244 -1.222 202 HG12 VAL 30 2HG1 VAL 30 0.040 -1.827 -2.924 203 HG13 VAL 30 3HG1 VAL 30 -1.323 -1.105 -2.066 204 HG21 VAL 30 3HG2 VAL 30 -3.481 -2.379 -1.829 205 HG22 VAL 30 1HG2 VAL 30 -3.367 -4.140 -1.812 206 HG23 VAL 30 2HG2 VAL 30 -2.466 -3.207 -0.616 207 H VAL 31 H VAL 31 -1.197 -1.744 -6.108 208 HA VAL 31 HA VAL 31 0.727 -3.653 -7.267 209 HB VAL 31 HB VAL 31 0.331 -0.652 -7.670 210 HG11 VAL 31 1HG1 VAL 31 2.479 -1.549 -8.514 211 HG12 VAL 31 2HG1 VAL 31 1.590 -2.689 -9.544 212 HG13 VAL 31 3HG1 VAL 31 1.447 -0.935 -9.800 213 HG21 VAL 31 3HG2 VAL 31 -0.972 -2.796 -9.385 214 HG22 VAL 31 1HG2 VAL 31 -1.825 -1.776 -8.210 215 HG23 VAL 31 2HG2 VAL 31 -1.049 -1.041 -9.596 216 H VAL 32 H VAL 32 2.842 -3.780 -6.248 217 HA VAL 32 HA VAL 32 3.871 -1.276 -5.068 218 HB VAL 32 HB VAL 32 4.105 -3.929 -3.642 219 HG11 VAL 32 1HG1 VAL 32 5.030 -1.107 -2.916 220 HG12 VAL 32 2HG1 VAL 32 5.096 -2.499 -1.816 221 HG13 VAL 32 3HG1 VAL 32 6.075 -2.491 -3.285 222 HG21 VAL 32 3HG2 VAL 32 2.769 -2.882 -1.815 223 HG22 VAL 32 1HG2 VAL 32 2.408 -1.526 -2.907 224 HG23 VAL 32 2HG2 VAL 32 1.851 -3.179 -3.290 225 H VAL 33 H VAL 33 5.865 -0.858 -5.837 226 HA VAL 33 HA VAL 33 7.413 -3.031 -7.164 227 HB VAL 33 HB VAL 33 7.563 -0.034 -7.682 228 HG11 VAL 33 1HG1 VAL 33 8.690 -0.619 -9.764 229 HG12 VAL 33 2HG1 VAL 33 9.583 -1.341 -8.449 230 HG13 VAL 33 3HG1 VAL 33 8.527 -2.346 -9.460 231 HG21 VAL 33 3HG2 VAL 33 5.935 -2.144 -9.175 232 HG22 VAL 33 1HG2 VAL 33 5.334 -0.675 -8.362 233 HG23 VAL 33 2HG2 VAL 33 6.327 -0.536 -9.812 234 H ALA 34 H ALA 34 9.798 -2.912 -6.875 235 HA ALA 34 HA ALA 34 10.866 -0.977 -5.037 236 HB1 ALA 34 1HB ALA 34 10.248 -2.680 -3.419 237 HB2 ALA 34 2HB ALA 34 11.227 -3.885 -4.297 238 HB3 ALA 34 3HB ALA 34 12.006 -2.473 -3.559 239 H ASN 35 H ASN 35 12.071 -0.242 -6.672 240 HA ASN 35 HA ASN 35 13.821 -1.635 -8.419 241 HB2 ASN 35 1HB ASN 35 13.190 0.806 -8.552 242 HB3 ASN 35 2HB ASN 35 14.222 1.108 -7.146 243 HD21 ASN 35 1HD2 ASN 35 14.645 2.476 -9.581 244 HD22 ASN 35 2HD2 ASN 35 16.188 1.963 -10.220 245 H GLY 36 H GLY 36 15.066 -3.288 -7.508 246 HA2 GLY 36 1HA GLY 36 17.269 -3.717 -7.135 247 HA3 GLY 36 2HA GLY 36 17.448 -2.201 -6.278 248 H THR 37 H THR 37 14.927 -4.141 -4.814 249 HA THR 37 HA THR 37 16.440 -6.194 -3.777 250 HB THR 37 HB THR 37 17.433 -4.249 -2.372 251 HG1 THR 37 1HG THR 37 17.717 -6.442 -1.802 252 HG21 THR 37 3HG2 THR 37 14.974 -4.606 -0.690 253 HG22 THR 37 1HG2 THR 37 15.154 -3.288 -1.863 254 HG23 THR 37 2HG2 THR 37 16.283 -3.426 -0.524 255 H GLN 38 H GLN 38 14.980 -7.183 -1.703 256 HA GLN 38 HA GLN 38 12.322 -7.346 -2.914 257 HB2 GLN 38 1HB GLN 38 14.107 -9.257 -1.433 258 HB3 GLN 38 2HB GLN 38 12.362 -9.390 -1.205 259 HG2 GLN 38 1HG GLN 38 12.582 -10.724 -3.061 260 HG3 GLN 38 2HG GLN 38 12.191 -9.173 -3.778 261 HE21 GLN 38 1HE2 GLN 38 13.419 -11.357 -5.168 262 HE22 GLN 38 2HE2 GLN 38 15.006 -10.758 -5.680 263 H LEU 39 H LEU 39 10.516 -7.777 -1.418 264 HA LEU 39 HA LEU 39 10.450 -5.616 0.614 265 HB2 LEU 39 1HB LEU 39 8.604 -6.789 -1.363 266 HB3 LEU 39 2HB LEU 39 7.857 -6.703 0.205 267 HG LEU 39 HG LEU 39 7.633 -4.778 -1.558 268 HD11 LEU 39 1HD1 LEU 39 7.822 -4.595 1.406 269 HD12 LEU 39 2HD1 LEU 39 6.497 -4.257 0.267 270 HD13 LEU 39 3HD1 LEU 39 7.770 -3.067 0.505 271 HD21 LEU 39 3HD2 LEU 39 10.098 -4.498 -1.806 272 HD22 LEU 39 1HD2 LEU 39 10.103 -3.718 -0.187 273 HD23 LEU 39 2HD2 LEU 39 9.175 -3.010 -1.505 274 H LYS 40 H LYS 40 9.109 -6.093 2.543 275 HA LYS 40 HA LYS 40 9.362 -8.901 3.479 276 HB2 LYS 40 1HB LYS 40 11.252 -7.524 4.237 277 HB3 LYS 40 2HB LYS 40 10.139 -6.414 5.055 278 HG2 LYS 40 1HG LYS 40 9.356 -8.289 6.494 279 HG3 LYS 40 2HG LYS 40 10.436 -9.404 5.624 280 HD2 LYS 40 1HD LYS 40 12.390 -7.980 6.319 281 HD3 LYS 40 2HD LYS 40 11.267 -6.992 7.289 282 HE2 LYS 40 1HE LYS 40 10.627 -9.086 8.543 283 HE3 LYS 40 2HE LYS 40 11.870 -9.960 7.629 284 HZ1 LYS 40 3HZ LYS 40 12.324 -7.687 9.470 285 HZ2 LYS 40 1HZ LYS 40 13.490 -8.391 8.561 286 HZ3 LYS 40 2HZ LYS 40 12.745 -9.255 9.742 287 H ASP 41 H ASP 41 7.420 -9.568 4.119 288 HA ASP 41 HA ASP 41 5.205 -7.680 4.527 289 HB2 ASP 41 1HB ASP 41 5.081 -10.146 3.569 290 HB3 ASP 41 2HB ASP 41 4.930 -10.574 5.268 291 H GLY 42 H GLY 42 4.129 -7.290 6.401 292 HA2 GLY 42 1HA GLY 42 5.463 -7.378 8.925 293 HA3 GLY 42 2HA GLY 42 3.745 -7.014 8.646 294 H ALA 43 H ALA 43 3.381 -9.687 7.205 295 HA ALA 43 HA ALA 43 2.052 -11.074 9.090 296 HB1 ALA 43 1HB ALA 43 1.870 -11.550 6.669 297 HB2 ALA 43 2HB ALA 43 3.494 -12.244 6.649 298 HB3 ALA 43 3HB ALA 43 2.194 -13.036 7.562 299 H THR 44 H THR 44 5.218 -12.116 7.914 300 HA THR 44 HA THR 44 5.919 -13.030 10.640 301 HB THR 44 HB THR 44 4.691 -14.833 9.286 302 HG1 THR 44 1HG THR 44 7.235 -15.293 10.456 303 HG21 THR 44 3HG2 THR 44 5.493 -15.633 7.440 304 HG22 THR 44 1HG2 THR 44 6.900 -16.238 8.302 305 HG23 THR 44 2HG2 THR 44 6.957 -14.637 7.552 306 H GLY 45 H GLY 45 6.930 -11.047 8.322 307 HA2 GLY 45 1HA GLY 45 9.032 -10.299 7.728 308 HA3 GLY 45 2HA GLY 45 9.795 -11.621 8.625 309 H GLU 46 H GLU 46 7.169 -12.204 6.346 310 HA GLU 46 HA GLU 46 8.532 -14.068 4.706 311 HB2 GLU 46 1HB GLU 46 6.088 -12.324 4.161 312 HB3 GLU 46 2HB GLU 46 6.674 -13.643 3.157 313 HG2 GLU 46 1HG GLU 46 6.420 -15.145 5.211 314 HG3 GLU 46 2HG GLU 46 5.518 -13.820 5.986 315 H SER 47 H SER 47 10.180 -13.603 3.252 316 HA SER 47 HA SER 47 10.624 -10.859 2.346 317 HB2 SER 47 1HB SER 47 11.986 -13.304 1.272 318 HB3 SER 47 2HB SER 47 12.611 -11.653 1.409 319 HG SER 47 HG SER 47 13.244 -13.457 2.985 320 H LEU 48 H LEU 48 9.642 -10.081 0.561 321 HA LEU 48 HA LEU 48 8.072 -11.949 -1.155 322 HB2 LEU 48 1HB LEU 48 7.602 -9.028 -0.556 323 HB3 LEU 48 2HB LEU 48 6.581 -10.091 -1.545 324 HG LEU 48 HG LEU 48 7.025 -10.269 1.467 325 HD11 LEU 48 1HD1 LEU 48 4.633 -9.617 1.501 326 HD12 LEU 48 2HD1 LEU 48 4.638 -9.495 -0.262 327 HD13 LEU 48 3HD1 LEU 48 5.666 -8.419 0.713 328 HD21 LEU 48 3HD2 LEU 48 5.305 -12.046 -0.331 329 HD22 LEU 48 1HD2 LEU 48 5.257 -12.021 1.448 330 HD23 LEU 48 2HD2 LEU 48 6.715 -12.547 0.624 331 H ALA 49 H ALA 49 8.360 -11.987 -3.226 332 HA ALA 49 HA ALA 49 10.533 -10.724 -4.556 333 HB1 ALA 49 1HB ALA 49 9.698 -13.033 -4.980 334 HB2 ALA 49 2HB ALA 49 8.164 -12.367 -5.569 335 HB3 ALA 49 3HB ALA 49 9.659 -12.058 -6.475 336 H SER 50 H SER 50 9.825 -8.349 -4.154 337 HA SER 50 HA SER 50 7.746 -7.157 -5.592 338 HB2 SER 50 1HB SER 50 9.708 -5.276 -5.567 339 HB3 SER 50 2HB SER 50 8.685 -5.636 -4.189 340 HG SER 50 HG SER 50 11.368 -6.079 -4.533 341 HA PRO 51 HA PRO 51 7.271 -5.324 -6.985 342 HB2 PRO 51 1HB PRO 51 5.998 -5.136 -9.415 343 HB3 PRO 51 2HB PRO 51 7.420 -4.151 -8.991 344 HG2 PRO 51 1HG PRO 51 7.372 -6.710 -10.598 345 HG3 PRO 51 2HG PRO 51 8.212 -5.170 -10.979 346 HD2 PRO 51 1HD PRO 51 9.479 -7.290 -9.809 347 HD3 PRO 51 2HD PRO 51 9.900 -5.601 -9.391 348 H VAL 52 H VAL 52 4.950 -5.836 -6.733 349 HA VAL 52 HA VAL 52 3.989 -8.361 -7.832 350 HB VAL 52 HB VAL 52 5.194 -8.809 -5.597 351 HG11 VAL 52 1HG1 VAL 52 2.696 -7.507 -4.443 352 HG12 VAL 52 2HG1 VAL 52 3.984 -8.331 -3.548 353 HG13 VAL 52 3HG1 VAL 52 4.308 -6.803 -4.398 354 HG21 VAL 52 3HG2 VAL 52 3.573 -10.389 -6.625 355 HG22 VAL 52 1HG2 VAL 52 3.567 -10.423 -4.856 356 HG23 VAL 52 2HG2 VAL 52 2.257 -9.602 -5.717 357 H ILE 53 H ILE 53 1.690 -8.623 -7.510 358 HA ILE 53 HA ILE 53 0.244 -6.105 -6.961 359 HB ILE 53 HB ILE 53 -0.581 -8.490 -8.677 360 HG12 ILE 53 1HG1 ILE 53 0.966 -7.456 -10.073 361 HG13 ILE 53 2HG1 ILE 53 -0.592 -6.819 -10.566 362 HG21 ILE 53 1HG2 ILE 53 -2.527 -7.113 -9.287 363 HG22 ILE 53 2HG2 ILE 53 -2.480 -7.401 -7.554 364 HG23 ILE 53 3HG2 ILE 53 -1.984 -5.817 -8.193 365 HD11 ILE 53 3HD1 ILE 53 1.610 -5.381 -9.109 366 HD12 ILE 53 1HD1 ILE 53 0.831 -4.971 -10.639 367 HD13 ILE 53 2HD1 ILE 53 -0.065 -4.772 -9.118 368 H LEU 54 H LEU 54 -0.049 -6.332 -4.854 369 HA LEU 54 HA LEU 54 -0.790 -8.873 -3.605 370 HB2 LEU 54 1HB LEU 54 -0.051 -6.167 -2.797 371 HB3 LEU 54 2HB LEU 54 -1.485 -6.673 -1.967 372 HG LEU 54 HG LEU 54 -0.421 -8.182 -0.635 373 HD11 LEU 54 1HD1 LEU 54 0.461 -9.832 -2.100 374 HD12 LEU 54 2HD1 LEU 54 1.820 -9.265 -1.150 375 HD13 LEU 54 3HD1 LEU 54 1.620 -8.702 -2.824 376 HD21 LEU 54 3HD2 LEU 54 1.713 -7.227 0.054 377 HD22 LEU 54 1HD2 LEU 54 0.565 -5.944 -0.388 378 HD23 LEU 54 2HD2 LEU 54 1.870 -6.398 -1.515 379 H SER 55 H SER 55 -2.679 -9.660 -4.198 380 HA SER 55 HA SER 55 -4.734 -7.977 -5.359 381 HB2 SER 55 1HB SER 55 -4.764 -10.957 -4.726 382 HB3 SER 55 2HB SER 55 -5.944 -10.077 -5.710 383 HG SER 55 HG SER 55 -4.671 -10.256 -7.339 384 H ASP 56 H ASP 56 -7.058 -8.580 -4.559 385 HA ASP 56 HA ASP 56 -7.655 -7.414 -2.093 386 HB2 ASP 56 1HB ASP 56 -9.114 -7.917 -4.138 387 HB3 ASP 56 2HB ASP 56 -9.208 -9.574 -3.565 388 H GLU 57 H GLU 57 -7.020 -10.773 -2.964 389 HA GLU 57 HA GLU 57 -7.858 -12.053 -0.583 390 HB2 GLU 57 1HB GLU 57 -5.874 -12.829 -2.793 391 HB3 GLU 57 2HB GLU 57 -6.449 -13.911 -1.541 392 HG2 GLU 57 1HG GLU 57 -7.991 -14.474 -3.105 393 HG3 GLU 57 2HG GLU 57 -8.869 -13.082 -2.485 394 H GLU 58 H GLU 58 -4.791 -10.625 -1.526 395 HA GLU 58 HA GLU 58 -3.229 -11.832 0.615 396 HB2 GLU 58 1HB GLU 58 -2.490 -9.335 -0.920 397 HB3 GLU 58 2HB GLU 58 -1.418 -10.551 -0.227 398 HG2 GLU 58 1HG GLU 58 -3.232 -10.870 -2.663 399 HG3 GLU 58 2HG GLU 58 -1.517 -10.585 -2.703 400 H LEU 59 H LEU 59 -5.045 -8.893 0.025 401 HA LEU 59 HA LEU 59 -4.285 -7.626 2.585 402 HB2 LEU 59 1HB LEU 59 -5.797 -6.834 0.099 403 HB3 LEU 59 2HB LEU 59 -6.075 -5.917 1.553 404 HG LEU 59 HG LEU 59 -4.346 -5.015 0.006 405 HD11 LEU 59 1HD1 LEU 59 -2.824 -4.240 1.766 406 HD12 LEU 59 2HD1 LEU 59 -3.494 -5.473 2.869 407 HD13 LEU 59 3HD1 LEU 59 -4.523 -4.180 2.249 408 HD21 LEU 59 3HD2 LEU 59 -2.083 -5.796 0.022 409 HD22 LEU 59 1HD2 LEU 59 -3.159 -7.092 -0.543 410 HD23 LEU 59 2HD2 LEU 59 -2.493 -7.146 1.100 411 H ALA 60 H ALA 60 -6.078 -10.140 2.301 412 HA ALA 60 HA ALA 60 -8.623 -9.456 3.480 413 HB1 ALA 60 1HB ALA 60 -7.145 -12.103 3.245 414 HB2 ALA 60 2HB ALA 60 -8.873 -11.888 3.617 415 HB3 ALA 60 3HB ALA 60 -8.250 -11.402 2.026 416 H VAL 61 H VAL 61 -6.811 -8.175 4.986 417 HA VAL 61 HA VAL 61 -6.789 -9.435 7.651 418 HB VAL 61 HB VAL 61 -4.411 -8.397 7.855 419 HG11 VAL 61 1HG1 VAL 61 -4.667 -10.892 6.149 420 HG12 VAL 61 2HG1 VAL 61 -3.290 -10.405 7.167 421 HG13 VAL 61 3HG1 VAL 61 -4.838 -10.820 7.919 422 HG21 VAL 61 3HG2 VAL 61 -3.034 -8.444 5.831 423 HG22 VAL 61 1HG2 VAL 61 -4.422 -8.771 4.827 424 HG23 VAL 61 2HG2 VAL 61 -4.317 -7.210 5.680 425 H GLU 62 H GLU 62 -6.379 -7.760 9.347 426 HA GLU 62 HA GLU 62 -7.978 -5.407 8.777 427 HB2 GLU 62 1HB GLU 62 -7.700 -4.867 11.106 428 HB3 GLU 62 2HB GLU 62 -8.087 -6.581 10.927 429 HG2 GLU 62 1HG GLU 62 -5.704 -7.172 11.278 430 HG3 GLU 62 2HG GLU 62 -5.287 -5.464 11.355 431 H LYS 63 H LYS 63 -4.520 -5.982 8.809 432 HA LYS 63 HA LYS 63 -3.940 -3.274 7.955 433 HB2 LYS 63 1HB LYS 63 -4.089 -2.770 10.253 434 HB3 LYS 63 2HB LYS 63 -3.215 -4.203 10.749 435 HG2 LYS 63 1HG LYS 63 -1.755 -2.227 8.974 436 HG3 LYS 63 2HG LYS 63 -2.057 -1.749 10.591 437 HD2 LYS 63 1HD LYS 63 -0.941 -4.472 10.486 438 HD3 LYS 63 2HD LYS 63 0.081 -3.205 9.792 439 HE2 LYS 63 1HE LYS 63 0.467 -3.599 12.228 440 HE3 LYS 63 2HE LYS 63 0.118 -1.929 11.757 441 HZ1 LYS 63 3HZ LYS 63 -1.840 -3.771 12.985 442 HZ2 LYS 63 1HZ LYS 63 -2.115 -2.181 12.578 443 HZ3 LYS 63 2HZ LYS 63 -0.999 -2.560 13.737 444 H VAL 64 H VAL 64 -1.849 -3.203 6.919 445 HA VAL 64 HA VAL 64 -0.042 -5.374 7.683 446 HB VAL 64 HB VAL 64 -0.048 -4.571 4.784 447 HG11 VAL 64 1HG1 VAL 64 0.717 -7.111 6.276 448 HG12 VAL 64 2HG1 VAL 64 0.955 -6.834 4.566 449 HG13 VAL 64 3HG1 VAL 64 1.867 -5.898 5.742 450 HG21 VAL 64 3HG2 VAL 64 -1.753 -6.757 6.004 451 HG22 VAL 64 1HG2 VAL 64 -2.346 -5.380 5.044 452 HG23 VAL 64 2HG2 VAL 64 -1.383 -6.652 4.279 453 H THR 65 H THR 65 2.177 -4.836 7.222 454 HA THR 65 HA THR 65 2.999 -2.014 6.942 455 HB THR 65 HB THR 65 4.265 -4.083 8.797 456 HG1 THR 65 1HG THR 65 2.430 -3.730 9.743 457 HG21 THR 65 3HG2 THR 65 5.801 -2.311 8.085 458 HG22 THR 65 1HG2 THR 65 5.418 -2.164 9.805 459 HG23 THR 65 2HG2 THR 65 4.665 -1.066 8.627 460 H LEU 66 H LEU 66 4.288 -2.022 5.040 461 HA LEU 66 HA LEU 66 5.702 -4.552 4.304 462 HB2 LEU 66 1HB LEU 66 4.073 -2.687 2.626 463 HB3 LEU 66 2HB LEU 66 5.468 -3.373 1.913 464 HG LEU 66 HG LEU 66 3.492 -4.634 1.278 465 HD11 LEU 66 1HD1 LEU 66 5.539 -5.952 1.317 466 HD12 LEU 66 2HD1 LEU 66 4.214 -6.936 1.945 467 HD13 LEU 66 3HD1 LEU 66 5.380 -6.225 3.056 468 HD21 LEU 66 3HD2 LEU 66 2.195 -5.901 2.819 469 HD22 LEU 66 1HD2 LEU 66 2.228 -4.237 3.430 470 HD23 LEU 66 2HD2 LEU 66 3.266 -5.493 4.160 471 H SER 67 H SER 67 7.733 -4.301 3.943 472 HA SER 67 HA SER 67 8.890 -1.579 3.667 473 HB2 SER 67 1HB SER 67 10.126 -3.293 5.780 474 HB3 SER 67 2HB SER 67 9.923 -1.533 5.598 475 HG SER 67 HG SER 67 8.010 -3.389 6.550 476 H THR 68 H THR 68 11.314 -1.622 3.546 477 HA THR 68 HA THR 68 12.098 -3.377 1.320 478 HB THR 68 HB THR 68 14.171 -1.828 1.619 479 HG1 THR 68 1HG THR 68 12.205 -0.253 2.967 480 HG21 THR 68 3HG2 THR 68 12.979 0.085 0.469 481 HG22 THR 68 1HG2 THR 68 11.436 -0.727 0.790 482 HG23 THR 68 2HG2 THR 68 12.645 -1.478 -0.258 483 H THR 69 H THR 69 13.712 -5.005 1.391 484 HA THR 69 HA THR 69 14.581 -5.775 4.063 485 HB THR 69 HB THR 69 15.865 -7.539 2.766 486 HG1 THR 69 1HG THR 69 14.243 -6.716 0.609 487 HG21 THR 69 3HG2 THR 69 13.675 -8.070 3.727 488 HG22 THR 69 1HG2 THR 69 13.852 -8.850 2.143 489 HG23 THR 69 2HG2 THR 69 12.850 -7.391 2.303 490 H GLY 70 H GLY 70 16.169 -4.516 1.143 491 HA2 GLY 70 1HA GLY 70 18.754 -4.498 2.603 492 HA3 GLY 70 2HA GLY 70 18.536 -4.502 0.862 493 H LYS 71 H LYS 71 18.018 -2.636 -0.147 494 HA LYS 71 HA LYS 71 17.419 -0.040 0.897 495 HB2 LYS 71 1HB LYS 71 19.966 -0.246 1.142 496 HB3 LYS 71 2HB LYS 71 20.031 -0.549 -0.595 497 HG2 LYS 71 1HG LYS 71 18.913 1.652 -1.003 498 HG3 LYS 71 2HG LYS 71 19.165 2.027 0.718 499 HD2 LYS 71 1HD LYS 71 21.490 2.112 0.494 500 HD3 LYS 71 2HD LYS 71 21.499 1.030 -0.922 501 HE2 LYS 71 1HE LYS 71 20.337 2.808 -2.234 502 HE3 LYS 71 2HE LYS 71 20.545 3.858 -0.833 503 HZ1 LYS 71 3HZ LYS 71 22.415 3.898 -2.620 504 HZ2 LYS 71 1HZ LYS 71 22.834 2.456 -2.049 505 HZ3 LYS 71 2HZ LYS 71 22.913 3.705 -1.037 506 H ALA 72 H ALA 72 16.241 0.947 -0.816 507 HA ALA 72 HA ALA 72 16.503 -0.262 -3.480 508 HB1 ALA 72 1HB ALA 72 13.983 -0.188 -1.834 509 HB2 ALA 72 2HB ALA 72 13.888 -0.081 -3.605 510 HB3 ALA 72 3HB ALA 72 14.626 -1.485 -2.850 511 H ILE 73 H ILE 73 15.397 1.089 -5.118 512 HA ILE 73 HA ILE 73 16.086 3.923 -4.497 513 HB ILE 73 HB ILE 73 16.150 2.911 -7.290 514 HG12 ILE 73 1HG1 ILE 73 17.233 1.011 -6.262 515 HG13 ILE 73 2HG1 ILE 73 18.354 1.958 -7.183 516 HG21 ILE 73 1HG2 ILE 73 16.726 5.264 -6.612 517 HG22 ILE 73 2HG2 ILE 73 18.114 4.633 -5.739 518 HG23 ILE 73 3HG2 ILE 73 18.019 4.429 -7.495 519 HD11 ILE 73 3HD1 ILE 73 18.169 2.259 -4.149 520 HD12 ILE 73 1HD1 ILE 73 19.143 1.048 -4.957 521 HD13 ILE 73 2HD1 ILE 73 19.472 2.769 -5.227 522 H GLU 74 H GLU 74 13.287 2.184 -4.951 523 HA GLU 74 HA GLU 74 11.904 4.618 -5.426 524 HB2 GLU 74 1HB GLU 74 11.879 2.490 -7.587 525 HB3 GLU 74 2HB GLU 74 10.346 3.240 -7.132 526 HG2 GLU 74 1HG GLU 74 11.814 5.458 -7.360 527 HG3 GLU 74 2HG GLU 74 12.720 4.433 -8.476 528 H PHE 75 H PHE 75 9.704 4.398 -4.772 529 HA PHE 75 HA PHE 75 8.722 1.731 -4.097 530 HB2 PHE 75 1HB PHE 75 9.808 2.928 -1.991 531 HB3 PHE 75 2HB PHE 75 8.364 3.903 -1.994 532 HD1 PHE 75 2HD PHE 75 8.575 0.186 -2.771 533 HD2 PHE 75 1HD PHE 75 7.507 3.172 0.195 534 HE1 PHE 75 2HE PHE 75 7.552 -1.533 -1.382 535 HE2 PHE 75 1HE PHE 75 6.667 1.399 1.616 536 HZ PHE 75 HZ PHE 75 6.635 -0.962 0.856 537 H ALA 76 H ALA 76 6.948 1.667 -5.358 538 HA ALA 76 HA ALA 76 5.229 4.087 -5.586 539 HB1 ALA 76 1HB ALA 76 6.398 3.663 -7.738 540 HB2 ALA 76 2HB ALA 76 5.762 2.003 -7.744 541 HB3 ALA 76 3HB ALA 76 4.655 3.395 -7.851 542 H VAL 77 H VAL 77 3.216 3.772 -4.850 543 HA VAL 77 HA VAL 77 2.269 1.002 -4.373 544 HB VAL 77 HB VAL 77 2.253 3.352 -2.434 545 HG11 VAL 77 1HG1 VAL 77 0.940 0.602 -2.208 546 HG12 VAL 77 2HG1 VAL 77 1.113 1.760 -0.877 547 HG13 VAL 77 3HG1 VAL 77 0.105 2.173 -2.263 548 HG21 VAL 77 3HG2 VAL 77 3.501 0.567 -2.260 549 HG22 VAL 77 1HG2 VAL 77 4.394 2.081 -2.492 550 HG23 VAL 77 2HG2 VAL 77 3.517 1.796 -0.982 551 H SER 78 H SER 78 0.430 0.712 -5.426 552 HA SER 78 HA SER 78 -1.292 3.040 -6.094 553 HB2 SER 78 1HB SER 78 0.653 1.941 -7.793 554 HB3 SER 78 2HB SER 78 -0.820 1.093 -8.275 555 HG SER 78 HG SER 78 -1.707 2.874 -8.891 556 H GLY 79 H GLY 79 -3.499 2.341 -6.784 557 HA2 GLY 79 1HA GLY 79 -4.564 -0.139 -7.030 558 HA3 GLY 79 2HA GLY 79 -4.317 -0.019 -5.279 559 H GLY 80 H GLY 80 -6.700 -0.345 -5.451 560 HA2 GLY 80 1HA GLY 80 -8.120 1.942 -4.610 561 HA3 GLY 80 2HA GLY 80 -8.442 1.714 -6.341 562 H VAL 81 H VAL 81 -10.632 1.556 -4.979 563 HA VAL 81 HA VAL 81 -11.371 -1.284 -5.139 564 HB VAL 81 HB VAL 81 -13.079 -0.762 -3.248 565 HG11 VAL 81 1HG1 VAL 81 -10.201 -1.301 -2.565 566 HG12 VAL 81 2HG1 VAL 81 -11.615 -1.584 -1.501 567 HG13 VAL 81 3HG1 VAL 81 -11.465 -2.474 -3.003 568 HG21 VAL 81 3HG2 VAL 81 -12.413 0.678 -1.461 569 HG22 VAL 81 1HG2 VAL 81 -10.966 1.215 -2.351 570 HG23 VAL 81 2HG2 VAL 81 -12.591 1.610 -2.938 571 H VAL 82 H VAL 82 -14.030 -0.999 -4.819 572 HA VAL 82 HA VAL 82 -15.042 1.112 -6.580 573 HB VAL 82 HB VAL 82 -14.902 -1.032 -7.786 574 HG11 VAL 82 1HG1 VAL 82 -14.911 -2.634 -5.917 575 HG12 VAL 82 2HG1 VAL 82 -16.618 -2.260 -5.582 576 HG13 VAL 82 3HG1 VAL 82 -16.143 -3.036 -7.101 577 HG21 VAL 82 3HG2 VAL 82 -16.931 0.507 -8.053 578 HG22 VAL 82 1HG2 VAL 82 -17.053 -1.143 -8.676 579 HG23 VAL 82 2HG2 VAL 82 -17.836 -0.733 -7.149 580 H ASP 83 H ASP 83 -17.478 1.463 -5.953 581 HA ASP 83 HA ASP 83 -18.186 0.695 -3.170 582 HB2 ASP 83 1HB ASP 83 -17.123 2.991 -3.252 583 HB3 ASP 83 2HB ASP 83 -18.447 3.497 -4.306 584 H GLY 84 H GLY 84 -18.965 -0.160 -5.915 585 HA2 GLY 84 1HA GLY 84 -21.254 1.464 -6.762 586 HA3 GLY 84 2HA GLY 84 -20.375 0.234 -7.667 587 H GLU 85 H GLU 85 -21.277 -0.900 -4.635 588 HA GLU 85 HA GLU 85 -22.683 -3.062 -5.774 589 HB2 GLU 85 1HB GLU 85 -22.440 -2.212 -2.871 590 HB3 GLU 85 2HB GLU 85 -23.179 -3.719 -3.398 591 HG2 GLU 85 1HG GLU 85 -20.775 -3.922 -2.652 592 HG3 GLU 85 2HG GLU 85 -21.165 -4.630 -4.210 593 H ASP 86 H ASP 86 -24.712 -3.568 -6.022 594 HA ASP 86 HA ASP 86 -26.886 -1.651 -5.322 595 HB2 ASP 86 1HB ASP 86 -25.907 -1.223 -7.565 596 HB3 ASP 86 2HB ASP 86 -26.238 -2.891 -8.020 597 H GLY 87 H GLY 87 -25.806 -4.750 -5.313 598 HA2 GLY 87 1HA GLY 87 -28.479 -6.072 -5.422 599 HA3 GLY 87 2HA GLY 87 -26.886 -6.847 -5.514 600 H VAL 88 H VAL 88 -26.572 -4.680 -2.990 601 HA VAL 88 HA VAL 88 -27.557 -6.443 -0.904 602 HB VAL 88 HB VAL 88 -25.562 -7.585 -1.652 603 HG11 VAL 88 1HG1 VAL 88 -24.077 -5.011 -1.041 604 HG12 VAL 88 2HG1 VAL 88 -23.313 -6.579 -1.392 605 HG13 VAL 88 3HG1 VAL 88 -24.289 -5.776 -2.631 606 HG21 VAL 88 3HG2 VAL 88 -26.149 -7.482 0.832 607 HG22 VAL 88 1HG2 VAL 88 -24.514 -7.988 0.389 608 HG23 VAL 88 2HG2 VAL 88 -24.773 -6.360 1.000 609 H VAL 89 H VAL 89 -26.574 -5.464 1.276 610 HA VAL 89 HA VAL 89 -26.385 -2.533 1.116 611 HB VAL 89 HB VAL 89 -28.586 -2.979 1.831 612 HG11 VAL 89 1HG1 VAL 89 -27.646 -4.828 4.039 613 HG12 VAL 89 2HG1 VAL 89 -29.303 -4.311 3.706 614 HG13 VAL 89 3HG1 VAL 89 -28.466 -5.347 2.553 615 HG21 VAL 89 3HG2 VAL 89 -28.621 -1.965 4.023 616 HG22 VAL 89 1HG2 VAL 89 -26.918 -2.399 4.305 617 HG23 VAL 89 2HG2 VAL 89 -27.329 -1.230 3.035 618 H ASN 90 H ASN 90 -24.244 -2.424 1.195 619 HA ASN 90 HA ASN 90 -22.796 -3.820 3.396 620 HB2 ASN 90 1HB ASN 90 -21.791 -2.425 0.884 621 HB3 ASN 90 2HB ASN 90 -20.742 -2.964 2.181 622 HD21 ASN 90 1HD2 ASN 90 -21.983 -5.583 2.788 623 HD22 ASN 90 2HD2 ASN 90 -21.609 -6.545 1.385 624 H GLU 91 H GLU 91 -21.087 -2.389 4.406 625 HA GLU 91 HA GLU 91 -21.967 0.435 4.734 626 HB2 GLU 91 1HB GLU 91 -20.553 -1.560 6.460 627 HB3 GLU 91 2HB GLU 91 -19.770 0.002 6.386 628 HG2 GLU 91 1HG GLU 91 -22.719 0.151 6.814 629 HG3 GLU 91 2HG GLU 91 -21.842 -0.729 8.063 630 HA PRO 92 HA PRO 92 -18.412 1.199 2.180 631 HB2 PRO 92 1HB PRO 92 -17.831 3.819 2.692 632 HB3 PRO 92 2HB PRO 92 -19.417 3.355 2.005 633 HG2 PRO 92 1HG PRO 92 -18.687 3.865 4.921 634 HG3 PRO 92 2HG PRO 92 -20.063 4.556 4.006 635 HD2 PRO 92 1HD PRO 92 -20.270 2.347 5.615 636 HD3 PRO 92 2HD PRO 92 -21.284 2.559 4.157 637 H MET 93 H MET 93 -16.049 2.370 2.372 638 HA MET 93 HA MET 93 -14.820 1.445 4.916 639 HB2 MET 93 1HB MET 93 -13.251 0.187 3.952 640 HB3 MET 93 2HB MET 93 -14.692 -0.307 3.085 641 HG2 MET 93 1HG MET 93 -13.968 1.181 1.155 642 HG3 MET 93 2HG MET 93 -12.533 1.603 2.073 643 HE1 MET 93 3HE MET 93 -11.154 -0.697 3.341 644 HE2 MET 93 1HE MET 93 -12.530 -1.782 3.293 645 HE3 MET 93 2HE MET 93 -11.046 -2.240 2.436 646 H GLN 94 H GLN 94 -12.626 2.163 5.303 647 HA GLN 94 HA GLN 94 -11.784 4.610 3.875 648 HB2 GLN 94 1HB GLN 94 -12.499 4.433 6.811 649 HB3 GLN 94 2HB GLN 94 -11.319 5.605 6.225 650 HG2 GLN 94 1HG GLN 94 -12.804 6.777 4.929 651 HG3 GLN 94 2HG GLN 94 -14.042 5.511 4.916 652 HE21 GLN 94 1HE2 GLN 94 -14.725 4.822 7.322 653 HE22 GLN 94 2HE2 GLN 94 -15.027 6.167 8.410 654 H TRP 95 H TRP 95 -9.612 4.884 3.897 655 HA TRP 95 HA TRP 95 -7.940 2.854 5.347 656 HB2 TRP 95 1HB TRP 95 -7.467 4.188 2.656 657 HB3 TRP 95 2HB TRP 95 -6.284 3.211 3.498 658 HD1 TRP 95 HD TRP 95 -8.935 1.088 4.196 659 HE1 TRP 95 1HE TRP 95 -9.787 -0.390 2.287 660 HE3 TRP 95 3HE TRP 95 -6.328 3.127 0.244 661 HZ2 TRP 95 2HZ TRP 95 -9.681 -0.478 -0.520 662 HZ3 TRP 95 3HZ TRP 95 -6.896 2.425 -2.065 663 HH2 TRP 95 HH TRP 95 -8.634 0.707 -2.457 664 H VAL 96 H VAL 96 -6.270 3.695 6.630 665 HA VAL 96 HA VAL 96 -5.313 6.357 5.977 666 HB VAL 96 HB VAL 96 -4.338 6.082 8.337 667 HG11 VAL 96 1HG1 VAL 96 -6.263 7.387 9.300 668 HG12 VAL 96 2HG1 VAL 96 -5.793 7.939 7.687 669 HG13 VAL 96 3HG1 VAL 96 -7.240 6.920 7.893 670 HG21 VAL 96 3HG2 VAL 96 -5.556 5.079 10.063 671 HG22 VAL 96 1HG2 VAL 96 -6.936 4.729 9.014 672 HG23 VAL 96 2HG2 VAL 96 -5.401 3.839 8.817 673 H VAL 97 H VAL 97 -3.116 6.329 5.506 674 HA VAL 97 HA VAL 97 -1.595 3.854 5.635 675 HB VAL 97 HB VAL 97 -0.959 4.401 3.286 676 HG11 VAL 97 1HG1 VAL 97 -2.458 2.576 3.674 677 HG12 VAL 97 2HG1 VAL 97 -3.875 3.640 3.609 678 HG13 VAL 97 3HG1 VAL 97 -2.869 3.371 2.159 679 HG21 VAL 97 3HG2 VAL 97 -3.452 6.159 3.173 680 HG22 VAL 97 1HG2 VAL 97 -1.791 6.756 3.156 681 HG23 VAL 97 2HG2 VAL 97 -2.357 5.756 1.824 682 H THR 98 H THR 98 0.749 4.460 5.397 683 HA THR 98 HA THR 98 1.400 7.307 5.362 684 HB THR 98 HB THR 98 2.221 5.541 7.711 685 HG1 THR 98 1HG THR 98 0.021 7.066 7.271 686 HG21 THR 98 3HG2 THR 98 2.484 8.541 7.235 687 HG22 THR 98 1HG2 THR 98 3.823 7.365 7.225 688 HG23 THR 98 2HG2 THR 98 2.931 7.697 8.724 689 H VAL 99 H VAL 99 3.452 7.521 4.393 690 HA VAL 99 HA VAL 99 5.082 5.048 4.103 691 HB VAL 99 HB VAL 99 5.407 7.465 2.322 692 HG11 VAL 99 1HG1 VAL 99 7.298 5.801 2.475 693 HG12 VAL 99 2HG1 VAL 99 6.182 4.518 2.006 694 HG13 VAL 99 3HG1 VAL 99 6.568 5.847 0.875 695 HG21 VAL 99 3HG2 VAL 99 3.690 4.998 1.810 696 HG22 VAL 99 1HG2 VAL 99 3.154 6.683 1.863 697 HG23 VAL 99 2HG2 VAL 99 4.203 6.162 0.564 698 H TYR 100 H TYR 100 7.044 4.998 4.844 699 HA TYR 100 HA TYR 100 8.253 7.320 6.224 700 HB2 TYR 100 1HB TYR 100 8.409 4.392 7.011 701 HB3 TYR 100 2HB TYR 100 9.061 5.760 7.886 702 HD1 TYR 100 2HD TYR 100 5.935 3.971 6.889 703 HD2 TYR 100 1HD TYR 100 7.641 7.016 9.441 704 HE1 TYR 100 2HE TYR 100 3.879 3.973 8.239 705 HE2 TYR 100 1HE TYR 100 5.559 7.033 10.790 706 HH TYR 100 HH TYR 100 2.640 5.234 9.949 707 H LYS 101 H LYS 101 10.056 7.837 5.214 708 HA LYS 101 HA LYS 101 11.657 6.019 3.515 709 HB2 LYS 101 1HB LYS 101 11.311 8.636 3.240 710 HB3 LYS 101 2HB LYS 101 12.499 8.771 4.516 711 HG2 LYS 101 1HG LYS 101 14.221 7.908 3.128 712 HG3 LYS 101 2HG LYS 101 13.073 6.944 2.194 713 HD2 LYS 101 1HD LYS 101 13.663 8.410 0.670 714 HD3 LYS 101 2HD LYS 101 12.172 9.152 1.218 715 HE2 LYS 101 1HE LYS 101 14.921 9.981 2.222 716 HE3 LYS 101 2HE LYS 101 14.219 10.595 0.732 717 HZ1 LYS 101 3HZ LYS 101 13.774 12.124 2.535 718 HZ2 LYS 101 1HZ LYS 101 13.045 10.988 3.404 719 HZ3 LYS 101 2HZ LYS 101 12.365 11.527 1.967 720 H ASN 102 H ASN 102 13.864 5.654 4.347 721 HA ASN 102 HA ASN 102 14.286 4.336 6.489 722 HB2 ASN 102 1HB ASN 102 16.639 4.584 6.406 723 HB3 ASN 102 2HB ASN 102 16.017 4.709 4.768 724 HD21 ASN 102 1HD2 ASN 102 15.285 7.433 4.650 725 HD22 ASN 102 2HD2 ASN 102 16.732 8.374 4.616 726 H GLY 103 H GLY 103 12.962 5.150 8.095 727 HA2 GLY 103 1HA GLY 103 12.639 5.823 10.267 728 HA3 GLY 103 2HA GLY 103 14.336 6.264 10.402 729 H LYS 104 H LYS 104 11.797 7.515 8.126 730 HA LYS 104 HA LYS 104 11.048 9.564 9.861 731 HB2 LYS 104 1HB LYS 104 13.004 10.481 7.878 732 HB3 LYS 104 2HB LYS 104 11.400 11.175 7.582 733 HG2 LYS 104 1HG LYS 104 12.691 11.268 10.308 734 HG3 LYS 104 2HG LYS 104 13.018 12.477 9.051 735 HD2 LYS 104 1HD LYS 104 10.488 12.832 8.868 736 HD3 LYS 104 2HD LYS 104 10.337 11.799 10.300 737 HE2 LYS 104 1HE LYS 104 12.191 13.453 11.266 738 HE3 LYS 104 2HE LYS 104 11.576 14.538 10.001 739 HZ1 LYS 104 3HZ LYS 104 10.468 14.829 12.131 740 HZ2 LYS 104 1HZ LYS 104 10.017 13.262 12.170 741 HZ3 LYS 104 2HZ LYS 104 9.354 14.270 11.046 742 H GLU 105 H GLU 105 9.079 10.211 9.342 743 HA GLU 105 HA GLU 105 7.417 8.906 7.311 744 HB2 GLU 105 1HB GLU 105 6.712 9.635 9.638 745 HB3 GLU 105 2HB GLU 105 6.884 11.315 9.112 746 HG2 GLU 105 1HG GLU 105 5.196 10.793 7.277 747 HG3 GLU 105 2HG GLU 105 4.973 9.217 8.034 748 H ILE 106 H ILE 106 6.864 9.895 5.145 749 HA ILE 106 HA ILE 106 7.619 12.757 4.868 750 HB ILE 106 HB ILE 106 8.150 12.218 2.566 751 HG12 ILE 106 1HG1 ILE 106 6.598 10.022 2.694 752 HG13 ILE 106 2HG1 ILE 106 7.819 10.280 1.525 753 HG21 ILE 106 1HG2 ILE 106 9.958 12.280 4.207 754 HG22 ILE 106 2HG2 ILE 106 9.774 10.555 4.535 755 HG23 ILE 106 3HG2 ILE 106 10.294 11.093 2.925 756 HD11 ILE 106 3HD1 ILE 106 7.768 8.011 2.448 757 HD12 ILE 106 1HD1 ILE 106 9.331 8.800 2.584 758 HD13 ILE 106 2HD1 ILE 106 8.286 8.665 4.022 759 H GLU 107 H GLU 107 4.964 10.513 4.806 760 HA GLU 107 HA GLU 107 3.296 12.283 3.143 761 HB2 GLU 107 1HB GLU 107 4.299 10.772 1.606 762 HB3 GLU 107 2HB GLU 107 4.105 9.392 2.652 763 HG2 GLU 107 1HG GLU 107 1.749 10.903 1.440 764 HG3 GLU 107 2HG GLU 107 2.547 9.538 0.650 765 H LYS 108 H LYS 108 0.886 11.691 3.577 766 HA LYS 108 HA LYS 108 0.330 9.971 5.824 767 HB2 LYS 108 1HB LYS 108 -0.454 11.885 7.173 768 HB3 LYS 108 2HB LYS 108 1.280 11.822 7.012 769 HG2 LYS 108 1HG LYS 108 1.035 13.640 5.185 770 HG3 LYS 108 2HG LYS 108 -0.652 13.757 5.698 771 HD2 LYS 108 1HD LYS 108 0.259 14.135 8.069 772 HD3 LYS 108 2HD LYS 108 1.853 14.326 7.315 773 HE2 LYS 108 1HE LYS 108 0.808 16.087 5.800 774 HE3 LYS 108 2HE LYS 108 -0.663 15.975 6.784 775 HZ1 LYS 108 3HZ LYS 108 0.852 16.521 8.710 776 HZ2 LYS 108 1HZ LYS 108 0.628 17.758 7.635 777 HZ3 LYS 108 2HZ LYS 108 2.013 16.865 7.619 778 H LYS 109 H LYS 109 -0.739 9.830 3.120 779 HA LYS 109 HA LYS 109 -3.183 11.442 3.005 780 HB2 LYS 109 1HB LYS 109 -1.538 10.468 1.076 781 HB3 LYS 109 2HB LYS 109 -2.686 9.131 1.174 782 HG2 LYS 109 1HG LYS 109 -4.475 11.112 1.091 783 HG3 LYS 109 2HG LYS 109 -3.092 12.046 0.516 784 HD2 LYS 109 1HD LYS 109 -3.960 9.516 -0.844 785 HD3 LYS 109 2HD LYS 109 -4.792 11.033 -1.154 786 HE2 LYS 109 1HE LYS 109 -1.815 10.573 -1.611 787 HE3 LYS 109 2HE LYS 109 -3.096 10.568 -2.842 788 HZ1 LYS 109 3HZ LYS 109 -2.188 12.881 -1.274 789 HZ2 LYS 109 1HZ LYS 109 -3.590 12.877 -2.148 790 HZ3 LYS 109 2HZ LYS 109 -2.157 12.672 -2.902 791 H SER 110 H SER 110 -5.290 10.256 2.551 792 HA SER 110 HA SER 110 -5.739 7.690 3.781 793 HB2 SER 110 1HB SER 110 -5.791 9.185 5.713 794 HB3 SER 110 2HB SER 110 -6.847 10.329 4.882 795 HG SER 110 HG SER 110 -7.635 7.652 5.411 796 H LEU 111 H LEU 111 -8.082 7.035 3.140 797 HA LEU 111 HA LEU 111 -9.199 8.711 0.956 798 HB2 LEU 111 1HB LEU 111 -8.796 5.695 0.955 799 HB3 LEU 111 2HB LEU 111 -9.720 6.606 -0.253 800 HG LEU 111 HG LEU 111 -6.746 6.767 0.271 801 HD11 LEU 111 1HD1 LEU 111 -8.285 5.667 -2.093 802 HD12 LEU 111 2HD1 LEU 111 -7.598 4.732 -0.763 803 HD13 LEU 111 3HD1 LEU 111 -6.512 5.624 -1.850 804 HD21 LEU 111 3HD2 LEU 111 -6.533 8.118 -1.782 805 HD22 LEU 111 1HD2 LEU 111 -7.458 8.973 -0.564 806 HD23 LEU 111 2HD2 LEU 111 -8.300 8.200 -1.917 807 H VAL 112 H VAL 112 -11.363 8.770 0.932 808 HA VAL 112 HA VAL 112 -12.956 6.924 2.556 809 HB VAL 112 HB VAL 112 -12.620 8.778 3.970 810 HG11 VAL 112 1HG1 VAL 112 -11.943 10.559 2.476 811 HG12 VAL 112 2HG1 VAL 112 -13.588 10.653 1.813 812 HG13 VAL 112 3HG1 VAL 112 -13.290 11.070 3.491 813 HG21 VAL 112 3HG2 VAL 112 -15.401 9.077 2.756 814 HG22 VAL 112 1HG2 VAL 112 -14.914 7.732 3.802 815 HG23 VAL 112 2HG2 VAL 112 -14.916 9.385 4.435 816 H PHE 113 H PHE 113 -14.175 5.904 1.122 817 HA PHE 113 HA PHE 113 -15.490 7.463 -1.017 818 HB2 PHE 113 1HB PHE 113 -14.145 4.870 -1.052 819 HB3 PHE 113 2HB PHE 113 -15.826 4.627 -1.386 820 HD1 PHE 113 2HD PHE 113 -12.712 6.353 -2.451 821 HD2 PHE 113 1HD PHE 113 -16.813 5.505 -3.504 822 HE1 PHE 113 2HE PHE 113 -12.280 7.160 -4.743 823 HE2 PHE 113 1HE PHE 113 -16.363 6.312 -5.818 824 HZ PHE 113 HZ PHE 113 -14.114 7.180 -6.426 825 H ARG 114 H ARG 114 -17.492 7.811 -0.644 826 HA ARG 114 HA ARG 114 -19.190 5.983 0.850 827 HB2 ARG 114 1HB ARG 114 -18.782 8.843 1.874 828 HB3 ARG 114 2HB ARG 114 -20.141 7.775 2.315 829 HG2 ARG 114 1HG ARG 114 -18.540 6.137 3.219 830 HG3 ARG 114 2HG ARG 114 -17.209 7.197 2.739 831 HD2 ARG 114 1HD ARG 114 -17.821 8.851 4.376 832 HD3 ARG 114 2HD ARG 114 -19.390 8.093 4.642 833 HE ARG 114 HE ARG 114 -16.744 7.017 5.485 834 HH11 ARG 114 1HH1 ARG 114 -20.231 7.182 6.126 835 HH12 ARG 114 2HH1 ARG 114 -20.288 5.764 7.124 836 HH21 ARG 114 1HH2 ARG 114 -16.749 5.267 6.995 837 HH22 ARG 114 2HH2 ARG 114 -18.174 4.919 7.890 838 H ASP 115 H ASP 115 -20.401 5.805 -0.805 839 HA ASP 115 HA ASP 115 -21.690 6.160 -2.712 840 HB2 ASP 115 1HB ASP 115 -23.355 7.092 -1.296 841 HB3 ASP 115 2HB ASP 115 -22.451 8.570 -1.027 842 H GLY 116 H GLY 116 -20.131 6.073 -4.119 843 HA2 GLY 116 1HA GLY 116 -19.236 8.693 -5.281 844 HA3 GLY 116 2HA GLY 116 -18.225 7.237 -5.296 845 H LYS 117 H LYS 117 -19.261 5.333 -6.374 846 HA LYS 117 HA LYS 117 -21.108 5.337 -8.405 847 HB2 LYS 117 1HB LYS 117 -18.718 7.008 -8.983 848 HB3 LYS 117 2HB LYS 117 -18.927 5.717 -10.124 849 HG2 LYS 117 1HG LYS 117 -21.194 7.566 -9.348 850 HG3 LYS 117 2HG LYS 117 -20.085 7.933 -10.653 851 HD2 LYS 117 1HD LYS 117 -20.794 6.149 -11.992 852 HD3 LYS 117 2HD LYS 117 -21.489 5.244 -10.666 853 HE2 LYS 117 1HE LYS 117 -22.670 7.892 -11.587 854 HE3 LYS 117 2HE LYS 117 -23.140 6.320 -12.258 855 HZ1 LYS 117 3HZ LYS 117 -23.660 5.640 -9.934 856 HZ2 LYS 117 1HZ LYS 117 -24.647 6.759 -10.551 857 HZ3 LYS 117 2HZ LYS 117 -23.496 7.236 -9.493 858 H GLU 118 H GLU 118 -20.422 3.639 -10.094 859 HA GLU 118 HA GLU 118 -18.492 1.646 -9.116 860 HB2 GLU 118 1HB GLU 118 -20.092 1.947 -11.684 861 HB3 GLU 118 2HB GLU 118 -18.858 0.695 -11.478 862 HG2 GLU 118 1HG GLU 118 -20.053 -0.376 -9.717 863 HG3 GLU 118 2HG GLU 118 -21.163 1.002 -9.535 864 H ILE 119 H ILE 119 -16.514 2.312 -9.080 865 HA ILE 119 HA ILE 119 -15.105 3.370 -11.381 866 HB ILE 119 HB ILE 119 -13.808 4.892 -10.011 867 HG12 ILE 119 1HG1 ILE 119 -15.147 5.471 -7.734 868 HG13 ILE 119 2HG1 ILE 119 -15.475 3.757 -7.777 869 HG21 ILE 119 1HG2 ILE 119 -16.725 5.604 -9.621 870 HG22 ILE 119 2HG2 ILE 119 -15.358 6.704 -9.839 871 HG23 ILE 119 3HG2 ILE 119 -15.920 5.693 -11.193 872 HD11 ILE 119 3HD1 ILE 119 -13.447 4.222 -6.474 873 HD12 ILE 119 1HD1 ILE 119 -13.084 3.266 -7.903 874 HD13 ILE 119 2HD1 ILE 119 -12.701 4.999 -7.895 875 H SER 120 H SER 120 -12.775 2.795 -11.029 876 HA SER 120 HA SER 120 -12.137 0.859 -8.929 877 HB2 SER 120 1HB SER 120 -12.347 -0.003 -11.838 878 HB3 SER 120 2HB SER 120 -11.632 -0.950 -10.542 879 HG SER 120 HG SER 120 -14.051 -0.198 -9.749 880 H THR 121 H THR 121 -11.076 3.236 -10.491 881 HA THR 121 HA THR 121 -8.241 2.672 -10.272 882 HB THR 121 HB THR 121 -8.811 1.352 -12.232 883 HG1 THR 121 1HG THR 121 -7.141 3.299 -13.291 884 HG21 THR 121 3HG2 THR 121 -10.588 2.612 -13.268 885 HG22 THR 121 1HG2 THR 121 -9.277 2.269 -14.404 886 HG23 THR 121 2HG2 THR 121 -9.445 3.894 -13.712 887 H ASP 122 H ASP 122 -9.589 4.668 -8.996 888 HA ASP 122 HA ASP 122 -8.167 7.000 -10.126 889 HB2 ASP 122 1HB ASP 122 -10.615 7.006 -10.924 890 HB3 ASP 122 2HB ASP 122 -11.045 7.377 -9.259 891 H ASP 123 H ASP 123 -8.025 5.070 -7.760 892 HA ASP 123 HA ASP 123 -8.549 6.816 -5.421 893 HB2 ASP 123 1HB ASP 123 -7.955 3.902 -5.832 894 HB3 ASP 123 2HB ASP 123 -7.699 4.629 -4.250 895 H LEU 124 H LEU 124 -5.839 4.507 -6.077 896 HA LEU 124 HA LEU 124 -4.205 6.315 -4.413 897 HB2 LEU 124 1HB LEU 124 -5.215 3.868 -3.849 898 HB3 LEU 124 2HB LEU 124 -3.667 3.385 -4.525 899 HG LEU 124 HG LEU 124 -4.039 5.403 -2.262 900 HD11 LEU 124 1HD1 LEU 124 -3.195 2.487 -2.084 901 HD12 LEU 124 2HD1 LEU 124 -4.786 3.134 -1.612 902 HD13 LEU 124 3HD1 LEU 124 -3.340 3.634 -0.735 903 HD21 LEU 124 3HD2 LEU 124 -1.546 3.968 -3.282 904 HD22 LEU 124 1HD2 LEU 124 -1.645 4.912 -1.782 905 HD23 LEU 124 2HD2 LEU 124 -1.866 5.723 -3.338 906 H ASN 125 H ASN 125 -2.360 7.057 -5.167 907 HA ASN 125 HA ASN 125 -1.137 6.120 -7.678 908 HB2 ASN 125 1HB ASN 125 -1.449 8.552 -8.383 909 HB3 ASN 125 2HB ASN 125 -2.945 7.651 -8.265 910 HD21 ASN 125 1HD2 ASN 125 -4.547 8.563 -7.042 911 HD22 ASN 125 2HD2 ASN 125 -4.328 9.922 -5.962 912 H LEU 126 H LEU 126 -0.006 5.939 -5.120 913 HA LEU 126 HA LEU 126 1.770 8.309 -4.753 914 HB2 LEU 126 1HB LEU 126 1.016 5.928 -3.129 915 HB3 LEU 126 2HB LEU 126 2.692 6.416 -3.005 916 HG LEU 126 HG LEU 126 2.207 8.570 -2.165 917 HD11 LEU 126 1HD1 LEU 126 -0.208 9.302 -1.655 918 HD12 LEU 126 2HD1 LEU 126 -0.704 8.009 -2.784 919 HD13 LEU 126 3HD1 LEU 126 0.266 9.359 -3.363 920 HD21 LEU 126 3HD2 LEU 126 0.986 7.934 -0.125 921 HD22 LEU 126 1HD2 LEU 126 2.096 6.654 -0.613 922 HD23 LEU 126 2HD2 LEU 126 0.351 6.485 -0.916 923 H TYR 127 H TYR 127 3.977 8.310 -5.046 924 HA TYR 127 HA TYR 127 5.511 6.022 -5.731 925 HB2 TYR 127 1HB TYR 127 6.324 7.429 -7.856 926 HB3 TYR 127 2HB TYR 127 5.111 6.164 -7.880 927 HD1 TYR 127 1HD TYR 127 5.247 9.936 -7.485 928 HD2 TYR 127 2HD TYR 127 3.164 6.479 -8.993 929 HE1 TYR 127 1HE TYR 127 3.479 11.409 -8.419 930 HE2 TYR 127 2HE TYR 127 1.396 7.931 -9.928 931 HH TYR 127 HH TYR 127 0.663 10.107 -10.230 932 H TYR 128 H TYR 128 7.560 6.278 -5.116 933 HA TYR 128 HA TYR 128 8.662 8.917 -4.489 934 HB2 TYR 128 1HB TYR 128 8.354 6.568 -2.565 935 HB3 TYR 128 2HB TYR 128 9.436 7.926 -2.291 936 HD1 TYR 128 2HD TYR 128 8.253 10.342 -2.791 937 HD2 TYR 128 1HD TYR 128 6.315 6.747 -1.358 938 HE1 TYR 128 2HE TYR 128 6.357 11.688 -2.046 939 HE2 TYR 128 1HE TYR 128 4.401 8.132 -0.555 940 HH TYR 128 HH TYR 128 4.287 11.673 -1.168 941 H ASN 129 H ASN 129 11.004 8.794 -4.095 942 HA ASN 129 HA ASN 129 12.506 6.460 -4.834 943 HB2 ASN 129 1HB ASN 129 13.488 7.171 -6.775 944 HB3 ASN 129 2HB ASN 129 11.812 7.597 -7.066 945 HD21 ASN 129 1HD2 ASN 129 11.228 9.783 -7.252 946 HD22 ASN 129 2HD2 ASN 129 12.402 11.071 -7.389 Start of MODEL 18 1 H1 GLY 1 H GLY 1 28.698 -10.044 3.006 2 HA2 GLY 1 1HA GLY 1 30.945 -10.201 1.935 3 HA3 GLY 1 2HA GLY 1 30.852 -10.925 3.548 4 H ASP 2 H ASP 2 32.816 -11.841 1.974 5 HA ASP 2 HA ASP 2 33.675 -13.020 0.282 6 HB2 ASP 2 1HB ASP 2 32.761 -14.440 -1.079 7 HB3 ASP 2 2HB ASP 2 31.727 -14.733 0.282 8 H ASP 3 H ASP 3 30.644 -11.403 -0.894 9 HA ASP 3 HA ASP 3 32.467 -9.307 -1.955 10 HB2 ASP 3 1HB ASP 3 32.300 -11.086 -3.474 11 HB3 ASP 3 2HB ASP 3 30.553 -11.276 -3.219 12 H ASP 4 H ASP 4 31.718 -7.438 -1.057 13 HA ASP 4 HA ASP 4 28.852 -6.742 -1.094 14 HB2 ASP 4 1HB ASP 4 29.265 -8.364 0.839 15 HB3 ASP 4 2HB ASP 4 30.267 -7.147 1.572 16 H GLU 5 H GLU 5 29.622 -4.900 -2.314 17 HA GLU 5 HA GLU 5 30.498 -2.717 -0.644 18 HB2 GLU 5 1HB GLU 5 32.733 -3.639 -1.272 19 HB3 GLU 5 2HB GLU 5 32.336 -3.350 -2.970 20 HG2 GLU 5 1HG GLU 5 31.811 -0.882 -2.186 21 HG3 GLU 5 2HG GLU 5 32.643 -1.321 -0.706 22 HA PRO 6 HA PRO 6 27.852 -1.360 -4.149 23 HB2 PRO 6 1HB PRO 6 25.777 -0.308 -2.812 24 HB3 PRO 6 2HB PRO 6 26.031 -2.072 -2.999 25 HG2 PRO 6 1HG PRO 6 26.743 -0.359 -0.590 26 HG3 PRO 6 2HG PRO 6 25.812 -1.887 -0.612 27 HD2 PRO 6 1HD PRO 6 28.533 -1.766 -0.140 28 HD3 PRO 6 2HD PRO 6 27.732 -3.175 -0.901 29 H GLY 7 H GLY 7 28.084 0.639 -5.070 30 HA2 GLY 7 1HA GLY 7 28.990 2.895 -3.345 31 HA3 GLY 7 2HA GLY 7 29.620 2.531 -4.952 32 H GLY 8 H GLY 8 26.649 3.561 -3.180 33 HA2 GLY 8 1HA GLY 8 25.882 5.274 -5.472 34 HA3 GLY 8 2HA GLY 8 24.748 4.025 -4.973 35 H LYS 9 H LYS 9 23.385 6.160 -4.613 36 HA LYS 9 HA LYS 9 23.234 6.340 -1.786 37 HB2 LYS 9 1HB LYS 9 22.762 8.782 -2.005 38 HB3 LYS 9 2HB LYS 9 24.441 8.246 -2.213 39 HG2 LYS 9 1HG LYS 9 24.293 8.621 -4.629 40 HG3 LYS 9 2HG LYS 9 22.612 9.173 -4.431 41 HD2 LYS 9 1HD LYS 9 23.297 11.027 -3.063 42 HD3 LYS 9 2HD LYS 9 24.963 10.452 -2.950 43 HE2 LYS 9 1HE LYS 9 23.893 10.911 -5.708 44 HE3 LYS 9 2HE LYS 9 24.097 12.351 -4.705 45 HZ1 LYS 9 3HZ LYS 9 26.430 11.748 -4.420 46 HZ2 LYS 9 1HZ LYS 9 26.048 11.895 -5.995 47 HZ3 LYS 9 2HZ LYS 9 26.228 10.401 -5.332 48 H GLY 10 H GLY 10 21.032 7.100 -1.293 49 HA2 GLY 10 1HA GLY 10 18.762 7.374 -2.728 50 HA3 GLY 10 2HA GLY 10 19.022 5.634 -2.781 51 H ALA 11 H ALA 11 17.351 5.080 -1.287 52 HA ALA 11 HA ALA 11 17.461 6.361 1.426 53 HB1 ALA 11 1HB ALA 11 15.042 6.800 1.296 54 HB2 ALA 11 2HB ALA 11 15.839 7.524 -0.096 55 HB3 ALA 11 3HB ALA 11 14.961 5.995 -0.287 56 H MET 12 H MET 12 15.339 5.270 2.628 57 HA MET 12 HA MET 12 15.016 2.481 1.955 58 HB2 MET 12 1HB MET 12 15.083 3.593 4.793 59 HB3 MET 12 2HB MET 12 14.137 2.177 4.338 60 HG2 MET 12 1HG MET 12 16.509 1.605 3.096 61 HG3 MET 12 2HG MET 12 17.043 2.558 4.437 62 HE1 MET 12 3HE MET 12 14.100 -0.134 4.070 63 HE2 MET 12 1HE MET 12 15.505 -0.636 3.106 64 HE3 MET 12 2HE MET 12 15.013 -1.583 4.530 65 H TYR 13 H TYR 13 12.877 1.911 2.374 66 HA TYR 13 HA TYR 13 10.859 4.016 2.714 67 HB2 TYR 13 1HB TYR 13 10.799 2.336 0.180 68 HB3 TYR 13 2HB TYR 13 9.557 3.432 0.758 69 HD1 TYR 13 2HD TYR 13 10.177 5.975 1.013 70 HD2 TYR 13 1HD TYR 13 12.086 3.137 -1.609 71 HE1 TYR 13 2HE TYR 13 10.931 7.819 -0.470 72 HE2 TYR 13 1HE TYR 13 12.939 5.007 -3.008 73 HH TYR 13 HH TYR 13 12.070 8.382 -2.551 74 H GLU 14 H GLU 14 8.980 3.227 3.546 75 HA GLU 14 HA GLU 14 8.283 0.394 3.518 76 HB2 GLU 14 1HB GLU 14 9.496 0.562 5.601 77 HB3 GLU 14 2HB GLU 14 8.778 2.140 5.958 78 HG2 GLU 14 1HG GLU 14 6.538 1.040 6.187 79 HG3 GLU 14 2HG GLU 14 7.320 -0.529 5.981 80 H VAL 15 H VAL 15 6.065 0.280 3.402 81 HA VAL 15 HA VAL 15 4.479 2.759 3.797 82 HB VAL 15 HB VAL 15 4.733 2.195 1.403 83 HG11 VAL 15 1HG1 VAL 15 4.278 -0.516 2.242 84 HG12 VAL 15 2HG1 VAL 15 2.976 -0.076 1.164 85 HG13 VAL 15 3HG1 VAL 15 4.667 0.112 0.636 86 HG21 VAL 15 3HG2 VAL 15 1.865 1.789 2.299 87 HG22 VAL 15 1HG2 VAL 15 2.687 3.347 2.099 88 HG23 VAL 15 2HG2 VAL 15 2.434 2.300 0.699 89 H THR 16 H THR 16 2.360 2.467 4.649 90 HA THR 16 HA THR 16 1.687 -0.193 5.686 91 HB THR 16 HB THR 16 0.743 1.741 7.567 92 HG1 THR 16 1HG THR 16 3.264 2.063 8.152 93 HG21 THR 16 3HG2 THR 16 2.188 0.512 9.128 94 HG22 THR 16 1HG2 THR 16 3.084 -0.184 7.752 95 HG23 THR 16 2HG2 THR 16 1.374 -0.603 8.021 96 H ILE 17 H ILE 17 -0.547 -0.542 5.801 97 HA ILE 17 HA ILE 17 -2.259 1.542 4.609 98 HB ILE 17 HB ILE 17 -1.778 0.108 2.816 99 HG12 ILE 17 1HG1 ILE 17 -3.977 -0.986 2.311 100 HG13 ILE 17 2HG1 ILE 17 -4.447 -0.818 3.992 101 HG21 ILE 17 1HG2 ILE 17 -1.971 -2.275 2.679 102 HG22 ILE 17 2HG2 ILE 17 -0.800 -1.846 3.914 103 HG23 ILE 17 3HG2 ILE 17 -2.434 -2.385 4.383 104 HD11 ILE 17 3HD1 ILE 17 -4.214 1.709 3.710 105 HD12 ILE 17 1HD1 ILE 17 -3.932 1.395 1.989 106 HD13 ILE 17 2HD1 ILE 17 -5.482 0.953 2.725 107 H GLU 18 H GLU 18 -3.658 2.043 6.154 108 HA GLU 18 HA GLU 18 -4.560 0.021 8.136 109 HB2 GLU 18 1HB GLU 18 -3.814 2.894 8.147 110 HB3 GLU 18 2HB GLU 18 -5.401 2.647 8.839 111 HG2 GLU 18 1HG GLU 18 -3.094 0.848 9.666 112 HG3 GLU 18 2HG GLU 18 -3.200 2.475 10.292 113 H GLN 19 H GLN 19 -6.745 -0.512 8.192 114 HA GLN 19 HA GLN 19 -8.543 0.830 6.231 115 HB2 GLN 19 1HB GLN 19 -8.323 -2.152 6.835 116 HB3 GLN 19 2HB GLN 19 -9.538 -1.357 5.841 117 HG2 GLN 19 1HG GLN 19 -7.603 -0.506 4.380 118 HG3 GLN 19 2HG GLN 19 -6.591 -1.658 5.240 119 HE21 GLN 19 1HE2 GLN 19 -7.518 -4.013 5.277 120 HE22 GLN 19 2HE2 GLN 19 -7.994 -4.609 3.737 121 H SER 20 H SER 20 -10.300 1.684 7.236 122 HA SER 20 HA SER 20 -11.253 0.466 9.791 123 HB2 SER 20 1HB SER 20 -12.397 3.077 9.174 124 HB3 SER 20 2HB SER 20 -11.593 2.512 10.644 125 HG SER 20 HG SER 20 -9.604 3.023 9.717 126 H GLY 21 H GLY 21 -13.713 0.549 9.983 127 HA2 GLY 21 1HA GLY 21 -15.801 0.182 9.198 128 HA3 GLY 21 2HA GLY 21 -15.367 1.053 7.736 129 H ASP 22 H ASP 22 -16.520 -0.490 6.347 130 HA ASP 22 HA ASP 22 -16.140 -3.302 6.814 131 HB2 ASP 22 1HB ASP 22 -18.260 -2.208 6.003 132 HB3 ASP 22 2HB ASP 22 -17.526 -2.171 4.376 133 H PHE 23 H PHE 23 -13.804 -3.316 6.596 134 HA PHE 23 HA PHE 23 -12.695 -2.801 4.006 135 HB2 PHE 23 1HB PHE 23 -10.573 -3.357 5.091 136 HB3 PHE 23 2HB PHE 23 -11.588 -2.211 5.972 137 HD1 PHE 23 2HD PHE 23 -11.085 -6.015 5.952 138 HD2 PHE 23 1HD PHE 23 -11.461 -2.385 8.281 139 HE1 PHE 23 2HE PHE 23 -10.915 -7.320 7.999 140 HE2 PHE 23 1HE PHE 23 -11.183 -3.711 10.349 141 HZ PHE 23 HZ PHE 23 -10.919 -6.184 10.229 142 H ARG 24 H ARG 24 -14.662 -5.209 4.164 143 HA ARG 24 HA ARG 24 -12.816 -7.191 2.902 144 HB2 ARG 24 1HB ARG 24 -13.742 -9.000 4.237 145 HB3 ARG 24 2HB ARG 24 -12.863 -7.845 5.219 146 HG2 ARG 24 1HG ARG 24 -14.687 -7.195 6.407 147 HG3 ARG 24 2HG ARG 24 -15.788 -7.271 5.033 148 HD2 ARG 24 1HD ARG 24 -15.999 -9.649 5.166 149 HD3 ARG 24 2HD ARG 24 -14.705 -9.788 6.342 150 HE ARG 24 HE ARG 24 -17.474 -9.237 6.833 151 HH11 ARG 24 1HH1 ARG 24 -14.248 -8.868 8.253 152 HH12 ARG 24 2HH1 ARG 24 -14.797 -8.116 9.717 153 HH21 ARG 24 1HH2 ARG 24 -18.204 -8.799 8.896 154 HH22 ARG 24 2HH2 ARG 24 -17.136 -8.365 10.209 155 H SER 25 H SER 25 -14.959 -5.356 1.817 156 HA SER 25 HA SER 25 -16.775 -7.444 0.707 157 HB2 SER 25 1HB SER 25 -17.278 -4.609 1.698 158 HB3 SER 25 2HB SER 25 -18.450 -5.516 0.741 159 HG SER 25 HG SER 25 -17.709 -5.796 3.371 160 H PHE 26 H PHE 26 -14.168 -6.305 -0.593 161 HA PHE 26 HA PHE 26 -15.456 -5.047 -2.936 162 HB2 PHE 26 1HB PHE 26 -13.123 -3.824 -1.409 163 HB3 PHE 26 2HB PHE 26 -13.830 -3.199 -2.908 164 HD1 PHE 26 2HD PHE 26 -16.524 -3.076 -2.830 165 HD2 PHE 26 1HD PHE 26 -13.907 -2.699 0.615 166 HE1 PHE 26 2HE PHE 26 -18.377 -2.108 -1.530 167 HE2 PHE 26 1HE PHE 26 -15.766 -1.696 1.853 168 HZ PHE 26 HZ PHE 26 -17.984 -1.476 0.831 169 H ILE 27 H ILE 27 -13.401 -4.386 -4.448 170 HA ILE 27 HA ILE 27 -11.501 -6.685 -4.522 171 HB ILE 27 HB ILE 27 -12.294 -4.870 -6.838 172 HG12 ILE 27 1HG1 ILE 27 -14.255 -6.045 -6.707 173 HG13 ILE 27 2HG1 ILE 27 -13.340 -6.851 -7.943 174 HG21 ILE 27 1HG2 ILE 27 -10.680 -7.470 -6.783 175 HG22 ILE 27 2HG2 ILE 27 -11.066 -6.535 -8.239 176 HG23 ILE 27 3HG2 ILE 27 -10.015 -5.851 -7.004 177 HD11 ILE 27 3HD1 ILE 27 -12.633 -8.518 -6.046 178 HD12 ILE 27 1HD1 ILE 27 -14.022 -7.822 -5.186 179 HD13 ILE 27 2HD1 ILE 27 -14.267 -8.614 -6.743 180 H LYS 28 H LYS 28 -10.111 -5.594 -2.955 181 HA LYS 28 HA LYS 28 -8.977 -3.001 -3.894 182 HB2 LYS 28 1HB LYS 28 -7.550 -3.005 -1.914 183 HB3 LYS 28 2HB LYS 28 -9.255 -3.038 -1.541 184 HG2 LYS 28 1HG LYS 28 -8.706 -5.697 -1.498 185 HG3 LYS 28 2HG LYS 28 -7.150 -5.046 -1.038 186 HD2 LYS 28 1HD LYS 28 -8.536 -5.581 0.939 187 HD3 LYS 28 2HD LYS 28 -8.263 -3.827 0.820 188 HE2 LYS 28 1HE LYS 28 -10.589 -3.907 -0.497 189 HE3 LYS 28 2HE LYS 28 -10.773 -5.462 0.304 190 HZ1 LYS 28 3HZ LYS 28 -10.001 -3.096 1.883 191 HZ2 LYS 28 1HZ LYS 28 -10.791 -4.444 2.344 192 HZ3 LYS 28 2HZ LYS 28 -11.590 -3.310 1.464 193 H SER 29 H SER 29 -6.636 -2.765 -4.145 194 HA SER 29 HA SER 29 -5.073 -5.173 -4.542 195 HB2 SER 29 1HB SER 29 -4.920 -3.146 -6.774 196 HB3 SER 29 2HB SER 29 -4.458 -4.852 -6.751 197 HG SER 29 HG SER 29 -7.054 -3.687 -6.991 198 H VAL 30 H VAL 30 -2.790 -4.622 -4.430 199 HA VAL 30 HA VAL 30 -2.053 -1.765 -4.241 200 HB VAL 30 HB VAL 30 -0.962 -3.851 -2.327 201 HG11 VAL 30 1HG1 VAL 30 -0.799 -0.810 -2.242 202 HG12 VAL 30 2HG1 VAL 30 0.066 -1.967 -1.205 203 HG13 VAL 30 3HG1 VAL 30 0.475 -1.836 -2.924 204 HG21 VAL 30 3HG2 VAL 30 -2.193 -2.581 -0.538 205 HG22 VAL 30 1HG2 VAL 30 -3.063 -1.691 -1.807 206 HG23 VAL 30 2HG2 VAL 30 -3.285 -3.447 -1.641 207 H VAL 31 H VAL 31 -0.960 -1.639 -6.106 208 HA VAL 31 HA VAL 31 1.015 -3.583 -7.060 209 HB VAL 31 HB VAL 31 0.471 -0.642 -7.684 210 HG11 VAL 31 1HG1 VAL 31 2.751 -1.180 -8.333 211 HG12 VAL 31 2HG1 VAL 31 2.202 -2.611 -9.224 212 HG13 VAL 31 3HG1 VAL 31 1.760 -0.979 -9.772 213 HG21 VAL 31 3HG2 VAL 31 -1.293 -2.603 -8.335 214 HG22 VAL 31 1HG2 VAL 31 -1.039 -1.168 -9.290 215 HG23 VAL 31 2HG2 VAL 31 -0.236 -2.675 -9.749 216 H VAL 32 H VAL 32 3.177 -3.610 -6.354 217 HA VAL 32 HA VAL 32 4.225 -1.241 -4.908 218 HB VAL 32 HB VAL 32 4.804 -4.075 -3.995 219 HG11 VAL 32 1HG1 VAL 32 5.547 -2.995 -1.956 220 HG12 VAL 32 2HG1 VAL 32 6.384 -2.284 -3.339 221 HG13 VAL 32 3HG1 VAL 32 5.049 -1.408 -2.573 222 HG21 VAL 32 3HG2 VAL 32 3.283 -3.753 -2.060 223 HG22 VAL 32 1HG2 VAL 32 2.625 -2.315 -2.866 224 HG23 VAL 32 2HG2 VAL 32 2.422 -3.916 -3.593 225 H VAL 33 H VAL 33 6.355 -0.785 -5.580 226 HA VAL 33 HA VAL 33 7.825 -2.891 -7.089 227 HB VAL 33 HB VAL 33 7.548 0.026 -7.946 228 HG11 VAL 33 1HG1 VAL 33 8.658 -0.813 -10.050 229 HG12 VAL 33 2HG1 VAL 33 9.706 -0.866 -8.646 230 HG13 VAL 33 3HG1 VAL 33 8.942 -2.360 -9.233 231 HG21 VAL 33 3HG2 VAL 33 6.335 -0.920 -9.953 232 HG22 VAL 33 1HG2 VAL 33 6.226 -2.476 -9.107 233 HG23 VAL 33 2HG2 VAL 33 5.426 -1.027 -8.455 234 H ALA 34 H ALA 34 10.128 -2.713 -6.879 235 HA ALA 34 HA ALA 34 11.244 -0.546 -5.205 236 HB1 ALA 34 1HB ALA 34 11.813 -3.517 -4.848 237 HB2 ALA 34 2HB ALA 34 12.771 -2.200 -4.145 238 HB3 ALA 34 3HB ALA 34 11.083 -2.406 -3.665 239 H ASN 35 H ASN 35 13.165 0.128 -5.893 240 HA ASN 35 HA ASN 35 14.412 -0.859 -8.405 241 HB2 ASN 35 1HB ASN 35 13.288 1.387 -8.590 242 HB3 ASN 35 2HB ASN 35 14.323 1.972 -7.263 243 HD21 ASN 35 1HD2 ASN 35 14.344 3.263 -9.764 244 HD22 ASN 35 2HD2 ASN 35 15.935 3.001 -10.463 245 H GLY 36 H GLY 36 16.018 -2.026 -7.506 246 HA2 GLY 36 1HA GLY 36 18.412 -1.827 -7.110 247 HA3 GLY 36 2HA GLY 36 18.074 -0.571 -5.914 248 H THR 37 H THR 37 15.773 -3.068 -5.496 249 HA THR 37 HA THR 37 17.261 -4.846 -3.868 250 HB THR 37 HB THR 37 17.452 -2.792 -2.485 251 HG1 THR 37 1HG THR 37 17.237 -4.942 -1.608 252 HG21 THR 37 3HG2 THR 37 14.421 -2.964 -2.261 253 HG22 THR 37 1HG2 THR 37 15.316 -1.751 -3.195 254 HG23 THR 37 2HG2 THR 37 15.495 -1.819 -1.440 255 H GLN 38 H GLN 38 15.265 -5.697 -2.160 256 HA GLN 38 HA GLN 38 13.028 -6.461 -3.970 257 HB2 GLN 38 1HB GLN 38 14.539 -8.112 -1.915 258 HB3 GLN 38 2HB GLN 38 12.998 -8.588 -2.578 259 HG2 GLN 38 1HG GLN 38 13.855 -9.254 -4.538 260 HG3 GLN 38 2HG GLN 38 14.868 -7.842 -4.675 261 HE21 GLN 38 1HE2 GLN 38 16.004 -9.792 -5.691 262 HE22 GLN 38 2HE2 GLN 38 17.213 -10.648 -4.741 263 H LEU 39 H LEU 39 11.428 -7.603 -2.176 264 HA LEU 39 HA LEU 39 10.644 -5.393 -0.330 265 HB2 LEU 39 1HB LEU 39 8.857 -7.008 -2.188 266 HB3 LEU 39 2HB LEU 39 8.260 -5.952 -0.915 267 HG LEU 39 HG LEU 39 9.926 -5.004 -3.284 268 HD11 LEU 39 1HD1 LEU 39 6.943 -4.796 -2.727 269 HD12 LEU 39 2HD1 LEU 39 7.699 -5.841 -3.928 270 HD13 LEU 39 3HD1 LEU 39 7.798 -4.077 -4.118 271 HD21 LEU 39 3HD2 LEU 39 8.463 -3.480 -1.094 272 HD22 LEU 39 1HD2 LEU 39 9.099 -2.748 -2.580 273 HD23 LEU 39 2HD2 LEU 39 10.214 -3.492 -1.421 274 H LYS 40 H LYS 40 9.100 -6.134 1.327 275 HA LYS 40 HA LYS 40 9.683 -8.914 2.223 276 HB2 LYS 40 1HB LYS 40 11.301 -7.274 3.072 277 HB3 LYS 40 2HB LYS 40 9.986 -6.305 3.754 278 HG2 LYS 40 1HG LYS 40 9.393 -8.219 5.241 279 HG3 LYS 40 2HG LYS 40 10.751 -9.154 4.559 280 HD2 LYS 40 1HD LYS 40 12.351 -7.474 5.338 281 HD3 LYS 40 2HD LYS 40 11.033 -6.397 5.822 282 HE2 LYS 40 1HE LYS 40 10.501 -8.814 7.164 283 HE3 LYS 40 2HE LYS 40 12.261 -8.646 7.254 284 HZ1 LYS 40 3HZ LYS 40 11.694 -6.253 7.997 285 HZ2 LYS 40 1HZ LYS 40 11.403 -7.455 9.088 286 HZ3 LYS 40 2HZ LYS 40 10.178 -6.786 8.189 287 H ASP 41 H ASP 41 7.890 -9.939 2.894 288 HA ASP 41 HA ASP 41 5.294 -8.615 2.944 289 HB2 ASP 41 1HB ASP 41 5.694 -11.022 2.239 290 HB3 ASP 41 2HB ASP 41 5.917 -11.407 3.943 291 H GLY 42 H GLY 42 4.081 -7.948 4.772 292 HA2 GLY 42 1HA GLY 42 5.623 -7.573 7.241 293 HA3 GLY 42 2HA GLY 42 4.061 -6.867 6.827 294 H ALA 43 H ALA 43 3.600 -10.138 6.251 295 HA ALA 43 HA ALA 43 2.159 -10.488 8.749 296 HB1 ALA 43 1HB ALA 43 2.806 -12.467 6.510 297 HB2 ALA 43 2HB ALA 43 1.687 -12.741 7.846 298 HB3 ALA 43 3HB ALA 43 1.333 -11.491 6.640 299 H THR 44 H THR 44 5.023 -11.998 7.187 300 HA THR 44 HA THR 44 5.903 -13.067 9.811 301 HB THR 44 HB THR 44 6.883 -14.821 8.005 302 HG1 THR 44 1HG THR 44 5.214 -15.119 6.403 303 HG21 THR 44 3HG2 THR 44 5.414 -15.352 9.931 304 HG22 THR 44 1HG2 THR 44 4.928 -16.226 8.481 305 HG23 THR 44 2HG2 THR 44 4.005 -14.797 9.001 306 H GLY 45 H GLY 45 6.867 -11.138 7.022 307 HA2 GLY 45 1HA GLY 45 8.796 -9.954 6.870 308 HA3 GLY 45 2HA GLY 45 9.644 -11.032 7.999 309 H GLU 46 H GLU 46 7.688 -12.434 5.345 310 HA GLU 46 HA GLU 46 9.840 -13.977 4.367 311 HB2 GLU 46 1HB GLU 46 7.267 -13.160 2.933 312 HB3 GLU 46 2HB GLU 46 8.402 -14.395 2.412 313 HG2 GLU 46 1HG GLU 46 7.870 -15.238 4.977 314 HG3 GLU 46 2HG GLU 46 6.354 -14.481 4.533 315 H SER 47 H SER 47 11.238 -13.687 2.736 316 HA SER 47 HA SER 47 11.704 -11.068 1.555 317 HB2 SER 47 1HB SER 47 13.322 -12.798 0.223 318 HB3 SER 47 2HB SER 47 13.744 -12.037 1.754 319 HG SER 47 HG SER 47 13.646 -14.586 1.295 320 H LEU 48 H LEU 48 11.098 -10.475 -0.441 321 HA LEU 48 HA LEU 48 9.581 -12.381 -2.170 322 HB2 LEU 48 1HB LEU 48 9.038 -9.424 -1.824 323 HB3 LEU 48 2HB LEU 48 8.053 -10.615 -2.682 324 HG LEU 48 HG LEU 48 8.405 -10.566 0.341 325 HD11 LEU 48 1HD1 LEU 48 6.132 -9.635 0.361 326 HD12 LEU 48 2HD1 LEU 48 6.135 -9.557 -1.411 327 HD13 LEU 48 3HD1 LEU 48 7.270 -8.561 -0.468 328 HD21 LEU 48 3HD2 LEU 48 6.511 -12.114 -1.489 329 HD22 LEU 48 1HD2 LEU 48 6.447 -12.106 0.287 330 HD23 LEU 48 2HD2 LEU 48 7.833 -12.808 -0.540 331 H ALA 49 H ALA 49 9.226 -10.850 -4.331 332 HA ALA 49 HA ALA 49 11.726 -9.591 -5.205 333 HB1 ALA 49 1HB ALA 49 10.389 -11.934 -6.643 334 HB2 ALA 49 2HB ALA 49 11.708 -10.931 -7.295 335 HB3 ALA 49 3HB ALA 49 11.983 -11.967 -5.873 336 H SER 50 H SER 50 10.925 -7.560 -5.936 337 HA SER 50 HA SER 50 8.164 -7.378 -6.710 338 HB2 SER 50 1HB SER 50 8.402 -5.304 -6.065 339 HB3 SER 50 2HB SER 50 9.901 -5.795 -5.332 340 HG SER 50 HG SER 50 11.014 -4.996 -7.107 341 HA PRO 51 HA PRO 51 7.549 -5.047 -8.072 342 HB2 PRO 51 1HB PRO 51 5.838 -4.797 -10.150 343 HB3 PRO 51 2HB PRO 51 7.449 -4.035 -10.156 344 HG2 PRO 51 1HG PRO 51 6.628 -6.582 -11.478 345 HG3 PRO 51 2HG PRO 51 7.591 -5.266 -12.177 346 HD2 PRO 51 1HD PRO 51 8.721 -7.547 -11.096 347 HD3 PRO 51 2HD PRO 51 9.538 -5.956 -11.047 348 H VAL 52 H VAL 52 5.234 -5.415 -7.346 349 HA VAL 52 HA VAL 52 4.260 -8.183 -7.672 350 HB VAL 52 HB VAL 52 5.959 -8.110 -5.883 351 HG11 VAL 52 1HG1 VAL 52 5.484 -7.021 -3.747 352 HG12 VAL 52 2HG1 VAL 52 5.599 -5.862 -5.070 353 HG13 VAL 52 3HG1 VAL 52 4.015 -6.325 -4.430 354 HG21 VAL 52 3HG2 VAL 52 3.118 -8.779 -5.002 355 HG22 VAL 52 1HG2 VAL 52 4.365 -9.849 -5.731 356 HG23 VAL 52 2HG2 VAL 52 4.601 -9.207 -4.086 357 H ILE 53 H ILE 53 2.105 -8.434 -7.225 358 HA ILE 53 HA ILE 53 0.533 -5.970 -6.669 359 HB ILE 53 HB ILE 53 -0.312 -8.297 -8.375 360 HG12 ILE 53 1HG1 ILE 53 1.316 -7.383 -9.769 361 HG13 ILE 53 2HG1 ILE 53 -0.221 -6.771 -10.328 362 HG21 ILE 53 1HG2 ILE 53 -2.158 -6.701 -9.044 363 HG22 ILE 53 2HG2 ILE 53 -2.158 -7.062 -7.320 364 HG23 ILE 53 3HG2 ILE 53 -1.508 -5.510 -7.864 365 HD11 ILE 53 3HD1 ILE 53 2.032 -5.244 -9.112 366 HD12 ILE 53 1HD1 ILE 53 1.087 -4.915 -10.541 367 HD13 ILE 53 2HD1 ILE 53 0.377 -4.646 -8.921 368 H LEU 54 H LEU 54 -0.269 -6.188 -4.660 369 HA LEU 54 HA LEU 54 -0.925 -8.910 -3.563 370 HB2 LEU 54 1HB LEU 54 -0.840 -6.131 -2.290 371 HB3 LEU 54 2HB LEU 54 -1.504 -7.562 -1.529 372 HG LEU 54 HG LEU 54 0.685 -7.069 -0.664 373 HD11 LEU 54 1HD1 LEU 54 0.013 -9.424 -0.682 374 HD12 LEU 54 2HD1 LEU 54 1.757 -9.267 -0.898 375 HD13 LEU 54 3HD1 LEU 54 0.732 -9.647 -2.298 376 HD21 LEU 54 3HD2 LEU 54 1.657 -6.058 -2.734 377 HD22 LEU 54 1HD2 LEU 54 1.843 -7.712 -3.384 378 HD23 LEU 54 2HD2 LEU 54 2.721 -7.237 -1.911 379 H SER 55 H SER 55 -2.968 -9.554 -3.640 380 HA SER 55 HA SER 55 -4.961 -7.880 -4.999 381 HB2 SER 55 1HB SER 55 -5.003 -10.855 -4.391 382 HB3 SER 55 2HB SER 55 -5.954 -9.984 -5.605 383 HG SER 55 HG SER 55 -4.109 -9.661 -6.828 384 H ASP 56 H ASP 56 -7.344 -8.905 -4.223 385 HA ASP 56 HA ASP 56 -7.817 -7.405 -1.943 386 HB2 ASP 56 1HB ASP 56 -9.474 -7.815 -3.742 387 HB3 ASP 56 2HB ASP 56 -9.596 -9.498 -3.245 388 H GLU 57 H GLU 57 -7.374 -10.853 -2.290 389 HA GLU 57 HA GLU 57 -8.299 -11.632 0.318 390 HB2 GLU 57 1HB GLU 57 -6.470 -12.889 -1.772 391 HB3 GLU 57 2HB GLU 57 -6.851 -13.704 -0.261 392 HG2 GLU 57 1HG GLU 57 -9.309 -12.687 -1.610 393 HG3 GLU 57 2HG GLU 57 -8.366 -13.781 -2.634 394 H GLU 58 H GLU 58 -5.177 -10.518 -0.915 395 HA GLU 58 HA GLU 58 -3.624 -11.345 1.350 396 HB2 GLU 58 1HB GLU 58 -2.969 -8.981 -0.441 397 HB3 GLU 58 2HB GLU 58 -1.865 -10.078 0.352 398 HG2 GLU 58 1HG GLU 58 -3.591 -10.614 -2.115 399 HG3 GLU 58 2HG GLU 58 -1.850 -10.402 -2.065 400 H LEU 59 H LEU 59 -5.436 -8.491 0.420 401 HA LEU 59 HA LEU 59 -4.587 -6.851 2.692 402 HB2 LEU 59 1HB LEU 59 -6.093 -6.565 0.093 403 HB3 LEU 59 2HB LEU 59 -6.323 -5.333 1.317 404 HG LEU 59 HG LEU 59 -4.766 -4.675 -0.331 405 HD11 LEU 59 1HD1 LEU 59 -3.257 -4.945 2.278 406 HD12 LEU 59 2HD1 LEU 59 -4.681 -3.925 2.152 407 HD13 LEU 59 3HD1 LEU 59 -3.251 -3.591 1.153 408 HD21 LEU 59 3HD2 LEU 59 -2.814 -6.758 0.689 409 HD22 LEU 59 1HD2 LEU 59 -2.532 -5.501 -0.563 410 HD23 LEU 59 2HD2 LEU 59 -3.680 -6.791 -0.861 411 H ALA 60 H ALA 60 -6.765 -9.275 2.701 412 HA ALA 60 HA ALA 60 -9.211 -8.035 3.439 413 HB1 ALA 60 1HB ALA 60 -9.928 -10.292 3.953 414 HB2 ALA 60 2HB ALA 60 -8.963 -10.304 2.468 415 HB3 ALA 60 3HB ALA 60 -8.242 -10.856 4.004 416 H VAL 61 H VAL 61 -7.082 -6.957 5.142 417 HA VAL 61 HA VAL 61 -7.897 -7.877 7.863 418 HB VAL 61 HB VAL 61 -5.553 -7.669 8.566 419 HG11 VAL 61 1HG1 VAL 61 -6.413 -9.891 7.723 420 HG12 VAL 61 2HG1 VAL 61 -5.625 -9.541 6.169 421 HG13 VAL 61 3HG1 VAL 61 -4.647 -9.640 7.654 422 HG21 VAL 61 3HG2 VAL 61 -4.834 -7.367 5.613 423 HG22 VAL 61 1HG2 VAL 61 -4.775 -6.055 6.804 424 HG23 VAL 61 2HG2 VAL 61 -3.734 -7.475 6.999 425 H GLU 62 H GLU 62 -7.260 -6.350 9.572 426 HA GLU 62 HA GLU 62 -8.164 -3.710 9.210 427 HB2 GLU 62 1HB GLU 62 -7.493 -3.409 11.507 428 HB3 GLU 62 2HB GLU 62 -8.195 -5.015 11.291 429 HG2 GLU 62 1HG GLU 62 -5.755 -5.858 10.998 430 HG3 GLU 62 2HG GLU 62 -5.284 -4.257 11.541 431 H LYS 63 H LYS 63 -4.787 -4.978 8.928 432 HA LYS 63 HA LYS 63 -3.986 -2.443 7.803 433 HB2 LYS 63 1HB LYS 63 -3.757 -1.877 10.157 434 HB3 LYS 63 2HB LYS 63 -2.932 -3.412 10.479 435 HG2 LYS 63 1HG LYS 63 -1.005 -2.674 9.107 436 HG3 LYS 63 2HG LYS 63 -1.804 -1.120 8.788 437 HD2 LYS 63 1HD LYS 63 -1.648 -0.489 11.087 438 HD3 LYS 63 2HD LYS 63 -1.327 -2.151 11.584 439 HE2 LYS 63 1HE LYS 63 0.782 -1.853 9.918 440 HE3 LYS 63 2HE LYS 63 0.520 -0.144 10.292 441 HZ1 LYS 63 3HZ LYS 63 2.077 -1.094 11.806 442 HZ2 LYS 63 1HZ LYS 63 1.021 -2.314 12.230 443 HZ3 LYS 63 2HZ LYS 63 0.699 -0.738 12.631 444 H VAL 64 H VAL 64 -2.028 -2.688 6.523 445 HA VAL 64 HA VAL 64 -0.534 -5.150 7.067 446 HB VAL 64 HB VAL 64 -0.761 -4.288 4.173 447 HG11 VAL 64 1HG1 VAL 64 1.046 -5.931 4.901 448 HG12 VAL 64 2HG1 VAL 64 -0.239 -7.001 5.447 449 HG13 VAL 64 3HG1 VAL 64 -0.093 -6.589 3.736 450 HG21 VAL 64 3HG2 VAL 64 -3.102 -4.816 4.752 451 HG22 VAL 64 1HG2 VAL 64 -2.398 -6.184 3.852 452 HG23 VAL 64 2HG2 VAL 64 -2.541 -6.282 5.598 453 H THR 65 H THR 65 1.738 -4.885 6.274 454 HA THR 65 HA THR 65 2.855 -2.134 6.285 455 HB THR 65 HB THR 65 3.653 -4.543 7.980 456 HG1 THR 65 1HG THR 65 2.333 -3.922 9.351 457 HG21 THR 65 3HG2 THR 65 4.703 -1.686 8.099 458 HG22 THR 65 1HG2 THR 65 5.581 -3.098 7.483 459 HG23 THR 65 2HG2 THR 65 5.127 -3.026 9.188 460 H LEU 66 H LEU 66 4.117 -2.086 4.310 461 HA LEU 66 HA LEU 66 5.578 -4.618 3.616 462 HB2 LEU 66 1HB LEU 66 4.059 -2.872 1.675 463 HB3 LEU 66 2HB LEU 66 5.372 -3.934 1.216 464 HG LEU 66 HG LEU 66 3.383 -5.009 0.647 465 HD11 LEU 66 1HD1 LEU 66 4.429 -6.439 3.112 466 HD12 LEU 66 2HD1 LEU 66 5.327 -6.337 1.579 467 HD13 LEU 66 3HD1 LEU 66 3.756 -7.145 1.637 468 HD21 LEU 66 3HD2 LEU 66 1.694 -5.760 2.209 469 HD22 LEU 66 1HD2 LEU 66 1.798 -3.982 2.226 470 HD23 LEU 66 2HD2 LEU 66 2.503 -4.949 3.542 471 H SER 67 H SER 67 7.648 -4.379 3.236 472 HA SER 67 HA SER 67 8.760 -1.616 3.117 473 HB2 SER 67 1HB SER 67 10.172 -3.483 4.922 474 HB3 SER 67 2HB SER 67 9.829 -1.745 5.042 475 HG SER 67 HG SER 67 8.011 -3.870 5.632 476 H THR 68 H THR 68 11.405 -1.898 3.015 477 HA THR 68 HA THR 68 11.824 -3.584 0.595 478 HB THR 68 HB THR 68 13.869 -1.952 0.442 479 HG1 THR 68 1HG THR 68 11.991 -0.331 1.884 480 HG21 THR 68 3HG2 THR 68 12.444 -0.363 -0.907 481 HG22 THR 68 1HG2 THR 68 11.016 -1.152 -0.201 482 HG23 THR 68 2HG2 THR 68 12.125 -2.074 -1.243 483 H THR 69 H THR 69 13.734 -4.922 0.482 484 HA THR 69 HA THR 69 14.759 -5.646 3.125 485 HB THR 69 HB THR 69 15.957 -7.415 1.759 486 HG1 THR 69 1HG THR 69 15.143 -7.682 -0.325 487 HG21 THR 69 3HG2 THR 69 13.976 -8.749 1.387 488 HG22 THR 69 1HG2 THR 69 12.945 -7.312 1.314 489 HG23 THR 69 2HG2 THR 69 13.719 -7.787 2.845 490 H GLY 70 H GLY 70 15.625 -3.181 1.037 491 HA2 GLY 70 1HA GLY 70 18.290 -2.877 2.113 492 HA3 GLY 70 2HA GLY 70 18.235 -3.436 0.428 493 H LYS 71 H LYS 71 19.345 -1.253 0.299 494 HA LYS 71 HA LYS 71 17.738 1.137 0.552 495 HB2 LYS 71 1HB LYS 71 20.313 0.920 0.589 496 HB3 LYS 71 2HB LYS 71 20.218 0.730 -1.162 497 HG2 LYS 71 1HG LYS 71 18.842 3.016 -1.028 498 HG3 LYS 71 2HG LYS 71 19.597 3.138 0.570 499 HD2 LYS 71 1HD LYS 71 21.224 4.188 -0.639 500 HD3 LYS 71 2HD LYS 71 21.795 2.513 -0.807 501 HE2 LYS 71 1HE LYS 71 20.107 2.548 -2.900 502 HE3 LYS 71 2HE LYS 71 20.303 4.307 -2.708 503 HZ1 LYS 71 3HZ LYS 71 21.989 3.533 -4.242 504 HZ2 LYS 71 1HZ LYS 71 22.336 2.231 -3.326 505 HZ3 LYS 71 2HZ LYS 71 22.806 3.676 -2.780 506 H ALA 72 H ALA 72 16.306 2.021 -0.943 507 HA ALA 72 HA ALA 72 16.452 0.982 -3.699 508 HB1 ALA 72 1HB ALA 72 14.279 0.371 -3.768 509 HB2 ALA 72 2HB ALA 72 14.454 0.184 -2.013 510 HB3 ALA 72 3HB ALA 72 13.739 1.663 -2.674 511 H ILE 73 H ILE 73 15.273 2.409 -5.230 512 HA ILE 73 HA ILE 73 15.714 5.286 -4.453 513 HB ILE 73 HB ILE 73 15.822 4.499 -7.320 514 HG12 ILE 73 1HG1 ILE 73 17.176 2.697 -6.383 515 HG13 ILE 73 2HG1 ILE 73 18.113 3.827 -7.298 516 HG21 ILE 73 1HG2 ILE 73 17.610 6.201 -7.386 517 HG22 ILE 73 2HG2 ILE 73 16.161 6.865 -6.632 518 HG23 ILE 73 3HG2 ILE 73 17.523 6.394 -5.619 519 HD11 ILE 73 3HD1 ILE 73 18.932 2.931 -4.915 520 HD12 ILE 73 1HD1 ILE 73 19.327 4.571 -5.481 521 HD13 ILE 73 2HD1 ILE 73 18.014 4.312 -4.337 522 H GLU 74 H GLU 74 13.043 3.255 -5.111 523 HA GLU 74 HA GLU 74 11.444 5.631 -5.873 524 HB2 GLU 74 1HB GLU 74 11.876 2.987 -7.312 525 HB3 GLU 74 2HB GLU 74 10.293 3.737 -7.320 526 HG2 GLU 74 1HG GLU 74 11.973 5.839 -7.957 527 HG3 GLU 74 2HG GLU 74 12.855 4.489 -8.656 528 H PHE 75 H PHE 75 8.975 4.914 -5.681 529 HA PHE 75 HA PHE 75 8.395 2.575 -4.320 530 HB2 PHE 75 1HB PHE 75 9.282 4.376 -2.388 531 HB3 PHE 75 2HB PHE 75 7.576 4.614 -2.293 532 HD1 PHE 75 2HD PHE 75 9.569 1.467 -3.006 533 HD2 PHE 75 1HD PHE 75 6.917 3.488 -0.212 534 HE1 PHE 75 2HE PHE 75 9.534 -0.500 -1.597 535 HE2 PHE 75 1HE PHE 75 6.992 1.529 1.212 536 HZ PHE 75 HZ PHE 75 8.375 -0.440 0.618 537 H ALA 76 H ALA 76 6.996 2.429 -6.036 538 HA ALA 76 HA ALA 76 4.790 4.304 -6.245 539 HB1 ALA 76 1HB ALA 76 5.757 3.266 -8.253 540 HB2 ALA 76 2HB ALA 76 5.220 1.666 -7.674 541 HB3 ALA 76 3HB ALA 76 4.032 2.930 -8.081 542 H VAL 77 H VAL 77 2.642 3.923 -5.849 543 HA VAL 77 HA VAL 77 1.771 1.318 -4.899 544 HB VAL 77 HB VAL 77 0.566 3.694 -3.502 545 HG11 VAL 77 1HG1 VAL 77 -0.093 2.057 -1.885 546 HG12 VAL 77 2HG1 VAL 77 -0.471 1.411 -3.501 547 HG13 VAL 77 3HG1 VAL 77 0.941 0.819 -2.638 548 HG21 VAL 77 3HG2 VAL 77 1.990 3.399 -1.530 549 HG22 VAL 77 1HG2 VAL 77 2.962 2.206 -2.412 550 HG23 VAL 77 2HG2 VAL 77 2.955 3.898 -2.920 551 H SER 78 H SER 78 0.068 0.798 -6.267 552 HA SER 78 HA SER 78 -1.763 2.934 -7.110 553 HB2 SER 78 1HB SER 78 -0.834 0.977 -9.194 554 HB3 SER 78 2HB SER 78 -1.639 2.540 -9.389 555 HG SER 78 HG SER 78 0.710 2.336 -9.907 556 H GLY 79 H GLY 79 -3.909 2.038 -7.734 557 HA2 GLY 79 1HA GLY 79 -5.035 -0.380 -7.779 558 HA3 GLY 79 2HA GLY 79 -4.452 -0.310 -6.103 559 H GLY 80 H GLY 80 -6.679 -0.249 -5.366 560 HA2 GLY 80 1HA GLY 80 -7.805 2.020 -4.442 561 HA3 GLY 80 2HA GLY 80 -8.428 1.938 -6.106 562 H VAL 81 H VAL 81 -10.469 1.706 -4.684 563 HA VAL 81 HA VAL 81 -11.105 -1.171 -4.832 564 HB VAL 81 HB VAL 81 -12.965 -0.388 -2.992 565 HG11 VAL 81 1HG1 VAL 81 -10.174 -1.384 -2.447 566 HG12 VAL 81 2HG1 VAL 81 -11.581 -1.614 -1.375 567 HG13 VAL 81 3HG1 VAL 81 -11.538 -2.396 -2.966 568 HG21 VAL 81 3HG2 VAL 81 -11.688 1.846 -2.586 569 HG22 VAL 81 1HG2 VAL 81 -12.036 0.820 -1.174 570 HG23 VAL 81 2HG2 VAL 81 -10.407 0.856 -1.883 571 H VAL 82 H VAL 82 -13.716 -1.171 -4.835 572 HA VAL 82 HA VAL 82 -14.958 0.847 -6.473 573 HB VAL 82 HB VAL 82 -16.042 -0.871 -7.896 574 HG11 VAL 82 1HG1 VAL 82 -14.210 -1.801 -9.283 575 HG12 VAL 82 2HG1 VAL 82 -14.069 -0.082 -8.996 576 HG13 VAL 82 3HG1 VAL 82 -13.034 -1.209 -8.093 577 HG21 VAL 82 3HG2 VAL 82 -14.299 -2.899 -6.433 578 HG22 VAL 82 1HG2 VAL 82 -16.068 -2.747 -6.395 579 HG23 VAL 82 2HG2 VAL 82 -15.251 -3.273 -7.873 580 H ASP 83 H ASP 83 -17.453 0.415 -6.363 581 HA ASP 83 HA ASP 83 -18.323 -1.473 -4.435 582 HB2 ASP 83 1HB ASP 83 -17.762 0.459 -3.015 583 HB3 ASP 83 2HB ASP 83 -18.683 1.526 -4.032 584 H GLY 84 H GLY 84 -19.567 -2.337 -6.037 585 HA2 GLY 84 1HA GLY 84 -21.424 -0.588 -7.555 586 HA3 GLY 84 2HA GLY 84 -20.271 -1.573 -8.479 587 H GLU 85 H GLU 85 -22.090 -2.104 -5.469 588 HA GLU 85 HA GLU 85 -23.236 -4.585 -6.673 589 HB2 GLU 85 1HB GLU 85 -23.118 -5.609 -4.482 590 HB3 GLU 85 2HB GLU 85 -21.560 -5.179 -5.168 591 HG2 GLU 85 1HG GLU 85 -21.780 -3.036 -3.630 592 HG3 GLU 85 2HG GLU 85 -22.988 -4.006 -2.765 593 H ASP 86 H ASP 86 -25.262 -5.034 -6.551 594 HA ASP 86 HA ASP 86 -27.144 -2.992 -5.442 595 HB2 ASP 86 1HB ASP 86 -27.134 -4.577 -8.025 596 HB3 ASP 86 2HB ASP 86 -28.620 -3.932 -7.336 597 H GLY 87 H GLY 87 -27.288 -4.105 -3.508 598 HA2 GLY 87 1HA GLY 87 -29.223 -5.563 -2.691 599 HA3 GLY 87 2HA GLY 87 -28.393 -6.888 -3.521 600 H VAL 88 H VAL 88 -25.660 -5.961 -2.809 601 HA VAL 88 HA VAL 88 -25.569 -7.123 -0.123 602 HB VAL 88 HB VAL 88 -23.232 -6.243 -1.854 603 HG11 VAL 88 1HG1 VAL 88 -23.522 -8.391 0.298 604 HG12 VAL 88 2HG1 VAL 88 -22.027 -7.983 -0.575 605 HG13 VAL 88 3HG1 VAL 88 -22.747 -6.813 0.535 606 HG21 VAL 88 3HG2 VAL 88 -24.651 -8.902 -1.909 607 HG22 VAL 88 1HG2 VAL 88 -24.510 -7.758 -3.266 608 HG23 VAL 88 2HG2 VAL 88 -23.068 -8.566 -2.654 609 H VAL 89 H VAL 89 -26.783 -5.104 0.644 610 HA VAL 89 HA VAL 89 -25.333 -2.610 0.722 611 HB VAL 89 HB VAL 89 -27.713 -2.577 0.866 612 HG11 VAL 89 1HG1 VAL 89 -29.021 -3.296 2.777 613 HG12 VAL 89 2HG1 VAL 89 -28.181 -4.679 2.068 614 HG13 VAL 89 3HG1 VAL 89 -27.576 -3.951 3.572 615 HG21 VAL 89 3HG2 VAL 89 -26.437 -0.757 1.920 616 HG22 VAL 89 1HG2 VAL 89 -27.986 -1.026 2.732 617 HG23 VAL 89 2HG2 VAL 89 -26.480 -1.623 3.473 618 H ASN 90 H ASN 90 -23.548 -2.228 1.818 619 HA ASN 90 HA ASN 90 -22.890 -3.781 4.238 620 HB2 ASN 90 1HB ASN 90 -20.509 -3.669 3.569 621 HB3 ASN 90 2HB ASN 90 -21.511 -4.705 2.570 622 HD21 ASN 90 1HD2 ASN 90 -22.043 -4.038 0.464 623 HD22 ASN 90 2HD2 ASN 90 -20.829 -3.150 -0.438 624 H GLU 91 H GLU 91 -21.086 -2.533 5.476 625 HA GLU 91 HA GLU 91 -21.951 0.263 5.784 626 HB2 GLU 91 1HB GLU 91 -20.212 -1.659 7.317 627 HB3 GLU 91 2HB GLU 91 -19.638 -0.009 7.284 628 HG2 GLU 91 1HG GLU 91 -22.129 0.611 7.908 629 HG3 GLU 91 2HG GLU 91 -22.203 -1.085 8.423 630 HA PRO 92 HA PRO 92 -18.650 1.851 3.341 631 HB2 PRO 92 1HB PRO 92 -18.178 4.383 4.365 632 HB3 PRO 92 2HB PRO 92 -19.675 3.946 3.487 633 HG2 PRO 92 1HG PRO 92 -19.253 3.981 6.491 634 HG3 PRO 92 2HG PRO 92 -20.585 4.732 5.552 635 HD2 PRO 92 1HD PRO 92 -20.831 2.279 6.733 636 HD3 PRO 92 2HD PRO 92 -21.612 2.642 5.164 637 H MET 93 H MET 93 -16.296 2.790 3.561 638 HA MET 93 HA MET 93 -14.930 1.803 5.945 639 HB2 MET 93 1HB MET 93 -13.550 0.308 4.849 640 HB3 MET 93 2HB MET 93 -15.118 -0.146 4.331 641 HG2 MET 93 1HG MET 93 -14.740 0.631 2.121 642 HG3 MET 93 2HG MET 93 -13.391 1.647 2.608 643 HE1 MET 93 3HE MET 93 -11.618 -0.480 4.508 644 HE2 MET 93 1HE MET 93 -10.458 -0.722 3.199 645 HE3 MET 93 2HE MET 93 -11.176 0.876 3.455 646 H GLN 94 H GLN 94 -12.457 2.221 5.636 647 HA GLN 94 HA GLN 94 -11.966 4.781 4.224 648 HB2 GLN 94 1HB GLN 94 -12.121 4.341 7.207 649 HB3 GLN 94 2HB GLN 94 -10.847 5.403 6.608 650 HG2 GLN 94 1HG GLN 94 -12.334 6.928 5.668 651 HG3 GLN 94 2HG GLN 94 -13.719 5.815 5.696 652 HE21 GLN 94 1HE2 GLN 94 -14.789 5.344 7.776 653 HE22 GLN 94 2HE2 GLN 94 -14.605 6.521 9.057 654 H TRP 95 H TRP 95 -9.749 5.252 3.990 655 HA TRP 95 HA TRP 95 -7.825 3.076 4.598 656 HB2 TRP 95 1HB TRP 95 -8.370 4.513 1.977 657 HB3 TRP 95 2HB TRP 95 -6.728 4.040 2.386 658 HD1 TRP 95 HD TRP 95 -8.754 1.284 3.620 659 HE1 TRP 95 1HE TRP 95 -8.635 -0.690 2.005 660 HE3 TRP 95 3HE TRP 95 -6.800 3.670 -0.460 661 HZ2 TRP 95 2HZ TRP 95 -8.075 -1.117 -0.769 662 HZ3 TRP 95 3HZ TRP 95 -6.451 2.428 -2.583 663 HH2 TRP 95 HH TRP 95 -7.081 0.014 -2.749 664 H VAL 96 H VAL 96 -5.929 3.767 5.386 665 HA VAL 96 HA VAL 96 -5.038 6.530 4.881 666 HB VAL 96 HB VAL 96 -4.906 5.096 7.577 667 HG11 VAL 96 1HG1 VAL 96 -3.749 7.135 8.374 668 HG12 VAL 96 2HG1 VAL 96 -2.810 6.299 7.138 669 HG13 VAL 96 3HG1 VAL 96 -3.702 7.768 6.707 670 HG21 VAL 96 3HG2 VAL 96 -7.095 6.124 7.282 671 HG22 VAL 96 1HG2 VAL 96 -6.160 7.115 8.396 672 HG23 VAL 96 2HG2 VAL 96 -6.380 7.629 6.714 673 H VAL 97 H VAL 97 -3.300 6.152 3.517 674 HA VAL 97 HA VAL 97 -1.597 3.817 4.125 675 HB VAL 97 HB VAL 97 -0.493 4.389 2.014 676 HG11 VAL 97 1HG1 VAL 97 -3.397 3.644 1.700 677 HG12 VAL 97 2HG1 VAL 97 -2.071 3.289 0.564 678 HG13 VAL 97 3HG1 VAL 97 -2.053 2.565 2.172 679 HG21 VAL 97 3HG2 VAL 97 -1.333 6.740 1.707 680 HG22 VAL 97 1HG2 VAL 97 -1.530 5.717 0.275 681 HG23 VAL 97 2HG2 VAL 97 -2.928 6.070 1.311 682 H THR 98 H THR 98 0.446 4.231 4.796 683 HA THR 98 HA THR 98 1.222 7.056 5.251 684 HB THR 98 HB THR 98 1.677 4.781 7.218 685 HG1 THR 98 1HG THR 98 -0.084 5.384 8.277 686 HG21 THR 98 3HG2 THR 98 2.097 6.647 8.804 687 HG22 THR 98 1HG2 THR 98 1.784 7.823 7.516 688 HG23 THR 98 2HG2 THR 98 3.197 6.748 7.418 689 H VAL 99 H VAL 99 3.432 7.402 4.806 690 HA VAL 99 HA VAL 99 4.981 5.067 3.783 691 HB VAL 99 HB VAL 99 5.084 7.901 2.725 692 HG11 VAL 99 1HG1 VAL 99 6.400 6.846 0.907 693 HG12 VAL 99 2HG1 VAL 99 7.176 6.581 2.472 694 HG13 VAL 99 3HG1 VAL 99 6.255 5.270 1.708 695 HG21 VAL 99 3HG2 VAL 99 3.983 6.983 0.691 696 HG22 VAL 99 1HG2 VAL 99 3.693 5.461 1.550 697 HG23 VAL 99 2HG2 VAL 99 2.910 6.964 2.090 698 H TYR 100 H TYR 100 6.847 4.792 4.880 699 HA TYR 100 HA TYR 100 7.895 7.019 6.554 700 HB2 TYR 100 1HB TYR 100 8.067 4.024 7.068 701 HB3 TYR 100 2HB TYR 100 8.958 5.267 7.938 702 HD1 TYR 100 2HD TYR 100 5.411 4.214 7.119 703 HD2 TYR 100 1HD TYR 100 8.074 6.113 9.960 704 HE1 TYR 100 2HE TYR 100 3.581 4.352 8.751 705 HE2 TYR 100 1HE TYR 100 6.222 6.236 11.592 706 HH TYR 100 HH TYR 100 2.879 5.150 10.890 707 H LYS 101 H LYS 101 9.768 7.744 5.781 708 HA LYS 101 HA LYS 101 11.172 6.219 3.647 709 HB2 LYS 101 1HB LYS 101 10.648 8.728 3.582 710 HB3 LYS 101 2HB LYS 101 12.071 8.928 4.618 711 HG2 LYS 101 1HG LYS 101 13.504 7.964 2.902 712 HG3 LYS 101 2HG LYS 101 12.140 7.187 2.110 713 HD2 LYS 101 1HD LYS 101 12.788 8.812 0.708 714 HD3 LYS 101 2HD LYS 101 11.290 9.379 1.400 715 HE2 LYS 101 1HE LYS 101 13.269 10.424 3.119 716 HE3 LYS 101 2HE LYS 101 14.003 10.496 1.522 717 HZ1 LYS 101 3HZ LYS 101 11.863 11.677 0.830 718 HZ2 LYS 101 1HZ LYS 101 12.908 12.506 1.819 719 HZ3 LYS 101 2HZ LYS 101 11.520 11.848 2.401 720 H ASN 102 H ASN 102 13.775 7.233 4.404 721 HA ASN 102 HA ASN 102 14.646 5.435 6.523 722 HB2 ASN 102 1HB ASN 102 16.830 6.372 6.212 723 HB3 ASN 102 2HB ASN 102 16.155 5.841 4.679 724 HD21 ASN 102 1HD2 ASN 102 15.503 7.591 3.079 725 HD22 ASN 102 2HD2 ASN 102 16.319 9.131 3.239 726 H GLY 103 H GLY 103 13.157 6.156 8.081 727 HA2 GLY 103 1HA GLY 103 14.196 6.830 10.215 728 HA3 GLY 103 2HA GLY 103 14.226 8.483 9.620 729 H LYS 104 H LYS 104 11.524 8.709 8.564 730 HA LYS 104 HA LYS 104 9.757 7.909 10.697 731 HB2 LYS 104 1HB LYS 104 9.057 10.068 11.356 732 HB3 LYS 104 2HB LYS 104 10.791 9.893 11.549 733 HG2 LYS 104 1HG LYS 104 10.226 11.008 8.901 734 HG3 LYS 104 2HG LYS 104 9.317 11.906 10.122 735 HD2 LYS 104 1HD LYS 104 12.204 11.147 10.450 736 HD3 LYS 104 2HD LYS 104 11.742 12.622 9.565 737 HE2 LYS 104 1HE LYS 104 10.575 13.496 11.551 738 HE3 LYS 104 2HE LYS 104 10.933 12.022 12.446 739 HZ1 LYS 104 3HZ LYS 104 13.219 12.510 12.351 740 HZ2 LYS 104 1HZ LYS 104 12.441 13.830 12.973 741 HZ3 LYS 104 2HZ LYS 104 12.995 13.869 11.423 742 H GLU 105 H GLU 105 7.625 9.324 10.189 743 HA GLU 105 HA GLU 105 6.445 8.416 7.735 744 HB2 GLU 105 1HB GLU 105 5.126 9.037 9.763 745 HB3 GLU 105 2HB GLU 105 5.634 10.717 9.550 746 HG2 GLU 105 1HG GLU 105 4.508 10.619 7.231 747 HG3 GLU 105 2HG GLU 105 3.849 9.077 7.721 748 H ILE 106 H ILE 106 6.294 9.467 5.745 749 HA ILE 106 HA ILE 106 7.193 12.283 5.567 750 HB ILE 106 HB ILE 106 8.022 11.793 3.297 751 HG12 ILE 106 1HG1 ILE 106 8.184 8.855 4.005 752 HG13 ILE 106 2HG1 ILE 106 6.714 9.470 3.271 753 HG21 ILE 106 1HG2 ILE 106 9.486 10.272 5.496 754 HG22 ILE 106 2HG2 ILE 106 10.197 10.984 4.024 755 HG23 ILE 106 3HG2 ILE 106 9.518 12.035 5.265 756 HD11 ILE 106 3HD1 ILE 106 8.383 8.592 1.617 757 HD12 ILE 106 1HD1 ILE 106 7.811 10.255 1.351 758 HD13 ILE 106 2HD1 ILE 106 9.402 9.990 2.053 759 H GLU 107 H GLU 107 4.708 9.852 4.665 760 HA GLU 107 HA GLU 107 3.059 12.020 3.677 761 HB2 GLU 107 1HB GLU 107 4.299 11.355 1.732 762 HB3 GLU 107 2HB GLU 107 3.861 9.667 1.925 763 HG2 GLU 107 1HG GLU 107 1.671 10.003 1.158 764 HG3 GLU 107 2HG GLU 107 1.662 11.691 1.627 765 H LYS 108 H LYS 108 0.850 11.467 3.805 766 HA LYS 108 HA LYS 108 0.087 8.915 5.129 767 HB2 LYS 108 1HB LYS 108 0.924 10.261 6.883 768 HB3 LYS 108 2HB LYS 108 0.130 11.697 6.291 769 HG2 LYS 108 1HG LYS 108 -1.852 9.607 6.979 770 HG3 LYS 108 2HG LYS 108 -0.720 9.902 8.309 771 HD2 LYS 108 1HD LYS 108 -1.082 12.384 7.918 772 HD3 LYS 108 2HD LYS 108 -2.472 11.976 6.907 773 HE2 LYS 108 1HE LYS 108 -3.549 10.893 8.857 774 HE3 LYS 108 2HE LYS 108 -2.077 11.209 9.817 775 HZ1 LYS 108 3HZ LYS 108 -3.950 13.225 8.751 776 HZ2 LYS 108 1HZ LYS 108 -2.446 13.587 9.315 777 HZ3 LYS 108 2HZ LYS 108 -3.564 12.923 10.318 778 H LYS 109 H LYS 109 -0.618 9.176 2.690 779 HA LYS 109 HA LYS 109 -2.796 10.962 2.043 780 HB2 LYS 109 1HB LYS 109 -1.218 8.882 0.710 781 HB3 LYS 109 2HB LYS 109 -2.917 8.663 0.357 782 HG2 LYS 109 1HG LYS 109 -1.930 11.489 0.149 783 HG3 LYS 109 2HG LYS 109 -1.175 10.386 -0.954 784 HD2 LYS 109 1HD LYS 109 -4.172 10.822 -0.743 785 HD3 LYS 109 2HD LYS 109 -3.076 11.496 -1.971 786 HE2 LYS 109 1HE LYS 109 -2.444 9.141 -2.626 787 HE3 LYS 109 2HE LYS 109 -3.715 8.555 -1.539 788 HZ1 LYS 109 3HZ LYS 109 -5.301 9.945 -2.926 789 HZ2 LYS 109 1HZ LYS 109 -4.685 8.640 -3.656 790 HZ3 LYS 109 2HZ LYS 109 -4.109 10.140 -3.997 791 H SER 110 H SER 110 -4.735 10.904 3.023 792 HA SER 110 HA SER 110 -5.798 8.330 4.003 793 HB2 SER 110 1HB SER 110 -6.670 10.168 5.763 794 HB3 SER 110 2HB SER 110 -5.150 9.261 5.936 795 HG SER 110 HG SER 110 -4.009 11.031 5.147 796 H LEU 111 H LEU 111 -7.934 7.913 3.506 797 HA LEU 111 HA LEU 111 -9.356 10.000 2.013 798 HB2 LEU 111 1HB LEU 111 -9.535 7.124 1.249 799 HB3 LEU 111 2HB LEU 111 -9.994 8.569 0.356 800 HG LEU 111 HG LEU 111 -7.549 9.080 0.012 801 HD11 LEU 111 1HD1 LEU 111 -6.256 6.702 0.326 802 HD12 LEU 111 2HD1 LEU 111 -7.434 6.607 1.661 803 HD13 LEU 111 3HD1 LEU 111 -6.306 7.960 1.565 804 HD21 LEU 111 3HD2 LEU 111 -9.002 7.879 -1.630 805 HD22 LEU 111 1HD2 LEU 111 -8.504 6.346 -0.876 806 HD23 LEU 111 2HD2 LEU 111 -7.308 7.396 -1.704 807 H VAL 112 H VAL 112 -11.484 8.508 1.434 808 HA VAL 112 HA VAL 112 -12.892 7.471 3.757 809 HB VAL 112 HB VAL 112 -13.719 10.147 2.568 810 HG11 VAL 112 1HG1 VAL 112 -15.253 8.329 4.463 811 HG12 VAL 112 2HG1 VAL 112 -15.669 10.033 4.146 812 HG13 VAL 112 3HG1 VAL 112 -15.748 8.853 2.843 813 HG21 VAL 112 3HG2 VAL 112 -12.978 9.398 5.426 814 HG22 VAL 112 1HG2 VAL 112 -12.051 10.454 4.329 815 HG23 VAL 112 2HG2 VAL 112 -13.630 10.964 4.895 816 H PHE 113 H PHE 113 -13.822 5.694 2.817 817 HA PHE 113 HA PHE 113 -14.676 5.788 0.004 818 HB2 PHE 113 1HB PHE 113 -13.467 3.792 1.414 819 HB3 PHE 113 2HB PHE 113 -15.141 3.445 1.824 820 HD1 PHE 113 2HD PHE 113 -13.180 4.419 -1.243 821 HD2 PHE 113 1HD PHE 113 -16.064 1.718 0.530 822 HE1 PHE 113 2HE PHE 113 -13.407 3.207 -3.396 823 HE2 PHE 113 1HE PHE 113 -16.158 0.450 -1.562 824 HZ PHE 113 HZ PHE 113 -14.874 1.237 -3.560 825 H ARG 114 H ARG 114 -17.106 4.757 -0.219 826 HA ARG 114 HA ARG 114 -18.745 5.323 2.049 827 HB2 ARG 114 1HB ARG 114 -19.928 6.533 -0.350 828 HB3 ARG 114 2HB ARG 114 -19.924 6.975 1.330 829 HG2 ARG 114 1HG ARG 114 -19.080 8.808 0.205 830 HG3 ARG 114 2HG ARG 114 -17.714 8.121 1.077 831 HD2 ARG 114 1HD ARG 114 -16.658 7.412 -0.883 832 HD3 ARG 114 2HD ARG 114 -18.194 7.154 -1.738 833 HE ARG 114 HE ARG 114 -17.852 9.903 -1.148 834 HH11 ARG 114 1HH1 ARG 114 -16.365 7.526 -3.364 835 HH12 ARG 114 2HH1 ARG 114 -16.106 8.707 -4.608 836 HH21 ARG 114 1HH2 ARG 114 -17.641 11.341 -2.811 837 HH22 ARG 114 2HH2 ARG 114 -16.968 10.910 -4.363 838 H ASP 115 H ASP 115 -21.042 4.753 1.398 839 HA ASP 115 HA ASP 115 -21.088 2.179 0.166 840 HB2 ASP 115 1HB ASP 115 -23.324 2.097 0.987 841 HB3 ASP 115 2HB ASP 115 -22.248 2.770 2.223 842 H GLY 116 H GLY 116 -21.557 1.688 -1.840 843 HA2 GLY 116 1HA GLY 116 -22.660 1.651 -3.857 844 HA3 GLY 116 2HA GLY 116 -23.631 3.029 -3.316 845 H LYS 117 H LYS 117 -20.090 2.647 -4.075 846 HA LYS 117 HA LYS 117 -20.528 4.734 -6.097 847 HB2 LYS 117 1HB LYS 117 -19.185 5.263 -3.552 848 HB3 LYS 117 2HB LYS 117 -18.109 5.605 -4.923 849 HG2 LYS 117 1HG LYS 117 -20.957 6.553 -4.748 850 HG3 LYS 117 2HG LYS 117 -19.574 7.528 -4.200 851 HD2 LYS 117 1HD LYS 117 -18.603 7.474 -6.467 852 HD3 LYS 117 2HD LYS 117 -19.941 6.524 -7.078 853 HE2 LYS 117 1HE LYS 117 -20.316 9.236 -5.752 854 HE3 LYS 117 2HE LYS 117 -20.122 9.017 -7.493 855 HZ1 LYS 117 3HZ LYS 117 -22.437 9.087 -6.821 856 HZ2 LYS 117 1HZ LYS 117 -22.271 7.763 -5.914 857 HZ3 LYS 117 2HZ LYS 117 -22.072 7.635 -7.548 858 H GLU 118 H GLU 118 -20.061 3.795 -7.836 859 HA GLU 118 HA GLU 118 -17.781 1.966 -7.960 860 HB2 GLU 118 1HB GLU 118 -18.442 1.525 -10.259 861 HB3 GLU 118 2HB GLU 118 -19.693 1.171 -9.086 862 HG2 GLU 118 1HG GLU 118 -20.957 3.134 -9.689 863 HG3 GLU 118 2HG GLU 118 -19.675 3.736 -10.734 864 H ILE 119 H ILE 119 -15.997 2.969 -7.733 865 HA ILE 119 HA ILE 119 -15.080 4.931 -9.727 866 HB ILE 119 HB ILE 119 -13.753 6.028 -8.041 867 HG12 ILE 119 1HG1 ILE 119 -14.620 5.425 -5.565 868 HG13 ILE 119 2HG1 ILE 119 -14.816 3.831 -6.261 869 HG21 ILE 119 1HG2 ILE 119 -15.479 7.255 -6.886 870 HG22 ILE 119 2HG2 ILE 119 -16.060 6.858 -8.510 871 HG23 ILE 119 3HG2 ILE 119 -16.647 5.941 -7.106 872 HD11 ILE 119 3HD1 ILE 119 -12.421 3.856 -6.939 873 HD12 ILE 119 1HD1 ILE 119 -12.236 5.446 -6.171 874 HD13 ILE 119 2HD1 ILE 119 -12.646 3.998 -5.215 875 H SER 120 H SER 120 -12.778 4.658 -9.998 876 HA SER 120 HA SER 120 -11.348 2.619 -8.591 877 HB2 SER 120 1HB SER 120 -12.592 1.242 -10.364 878 HB3 SER 120 2HB SER 120 -11.634 2.081 -11.589 879 HG SER 120 HG SER 120 -9.798 1.183 -10.718 880 H THR 121 H THR 121 -11.361 5.451 -9.688 881 HA THR 121 HA THR 121 -8.569 5.644 -10.726 882 HB THR 121 HB THR 121 -9.413 7.201 -12.410 883 HG1 THR 121 1HG THR 121 -12.083 6.465 -11.909 884 HG21 THR 121 3HG2 THR 121 -9.323 4.864 -13.152 885 HG22 THR 121 1HG2 THR 121 -10.668 5.734 -13.904 886 HG23 THR 121 2HG2 THR 121 -10.985 4.596 -12.592 887 H ASP 122 H ASP 122 -9.732 6.111 -8.055 888 HA ASP 122 HA ASP 122 -9.003 8.920 -7.777 889 HB2 ASP 122 1HB ASP 122 -11.488 8.612 -8.454 890 HB3 ASP 122 2HB ASP 122 -11.737 7.883 -6.877 891 H ASP 123 H ASP 123 -7.852 6.412 -6.802 892 HA ASP 123 HA ASP 123 -8.141 6.824 -3.849 893 HB2 ASP 123 1HB ASP 123 -8.103 4.166 -5.297 894 HB3 ASP 123 2HB ASP 123 -7.636 4.353 -3.588 895 H LEU 124 H LEU 124 -6.117 4.558 -5.804 896 HA LEU 124 HA LEU 124 -3.983 5.255 -3.902 897 HB2 LEU 124 1HB LEU 124 -5.169 2.887 -4.317 898 HB3 LEU 124 2HB LEU 124 -3.962 2.831 -5.574 899 HG LEU 124 HG LEU 124 -2.144 2.921 -4.026 900 HD11 LEU 124 1HD1 LEU 124 -4.227 3.091 -1.796 901 HD12 LEU 124 2HD1 LEU 124 -2.983 4.290 -2.177 902 HD13 LEU 124 3HD1 LEU 124 -2.506 2.716 -1.569 903 HD21 LEU 124 3HD2 LEU 124 -2.593 0.759 -2.806 904 HD22 LEU 124 1HD2 LEU 124 -3.149 0.699 -4.473 905 HD23 LEU 124 2HD2 LEU 124 -4.314 0.929 -3.165 906 H ASN 125 H ASN 125 -2.606 6.585 -4.679 907 HA ASN 125 HA ASN 125 -1.547 6.459 -7.438 908 HB2 ASN 125 1HB ASN 125 -3.776 7.706 -7.474 909 HB3 ASN 125 2HB ASN 125 -3.065 8.933 -6.438 910 HD21 ASN 125 1HD2 ASN 125 -0.748 9.668 -7.414 911 HD22 ASN 125 2HD2 ASN 125 -0.683 9.823 -9.184 912 H LEU 126 H LEU 126 0.210 5.871 -5.771 913 HA LEU 126 HA LEU 126 1.559 8.327 -4.720 914 HB2 LEU 126 1HB LEU 126 0.807 5.818 -3.359 915 HB3 LEU 126 2HB LEU 126 2.556 6.100 -3.330 916 HG LEU 126 HG LEU 126 2.324 8.158 -2.193 917 HD11 LEU 126 1HD1 LEU 126 -0.519 8.110 -1.504 918 HD12 LEU 126 2HD1 LEU 126 -0.216 8.504 -3.212 919 HD13 LEU 126 3HD1 LEU 126 0.564 9.435 -1.950 920 HD21 LEU 126 3HD2 LEU 126 0.609 6.001 -0.910 921 HD22 LEU 126 1HD2 LEU 126 1.445 7.340 -0.070 922 HD23 LEU 126 2HD2 LEU 126 2.379 6.088 -0.902 923 H TYR 127 H TYR 127 3.750 8.448 -5.204 924 HA TYR 127 HA TYR 127 5.203 6.253 -6.414 925 HB2 TYR 127 1HB TYR 127 3.935 6.773 -8.401 926 HB3 TYR 127 2HB TYR 127 4.225 8.480 -8.209 927 HD1 TYR 127 2HD TYR 127 6.409 9.486 -8.855 928 HD2 TYR 127 1HD TYR 127 5.647 5.268 -9.328 929 HE1 TYR 127 2HE TYR 127 8.425 9.269 -10.294 930 HE2 TYR 127 1HE TYR 127 7.661 5.054 -10.742 931 HH TYR 127 HH TYR 127 9.924 6.375 -11.147 932 H TYR 128 H TYR 128 6.992 6.531 -5.272 933 HA TYR 128 HA TYR 128 8.227 9.232 -5.073 934 HB2 TYR 128 1HB TYR 128 8.540 6.628 -3.564 935 HB3 TYR 128 2HB TYR 128 9.826 7.810 -3.540 936 HD1 TYR 128 1HD TYR 128 9.251 10.243 -2.953 937 HD2 TYR 128 2HD TYR 128 6.540 6.969 -2.227 938 HE1 TYR 128 1HE TYR 128 7.904 11.699 -1.473 939 HE2 TYR 128 2HE TYR 128 5.181 8.401 -0.749 940 HH TYR 128 HH TYR 128 6.282 11.670 0.209 941 H ASN 129 H ASN 129 10.315 9.599 -5.855 942 HA ASN 129 HA ASN 129 11.956 7.646 -6.953 943 HB2 ASN 129 1HB ASN 129 12.099 8.218 -9.236 944 HB3 ASN 129 2HB ASN 129 10.413 7.943 -8.963 945 HD21 ASN 129 1HD2 ASN 129 10.611 10.876 -7.595 946 HD22 ASN 129 2HD2 ASN 129 10.366 11.896 -9.017 Start of MODEL 19 1 H1 GLY 1 H GLY 1 43.900 -6.468 3.990 2 HA2 GLY 1 1HA GLY 1 44.693 -3.919 2.677 3 HA3 GLY 1 2HA GLY 1 43.829 -5.259 1.867 4 H ASP 2 H ASP 2 41.659 -5.360 2.050 5 HA ASP 2 HA ASP 2 39.714 -5.541 2.980 6 HB2 ASP 2 1HB ASP 2 40.856 -5.300 5.731 7 HB3 ASP 2 2HB ASP 2 39.792 -6.514 5.049 8 H ASP 3 H ASP 3 39.393 -3.408 1.930 9 HA ASP 3 HA ASP 3 38.963 -1.065 3.674 10 HB2 ASP 3 1HB ASP 3 41.354 -1.423 3.095 11 HB3 ASP 3 2HB ASP 3 40.958 -1.505 1.398 12 H ASP 4 H ASP 4 36.662 -1.454 2.976 13 HA ASP 4 HA ASP 4 35.982 -0.651 0.236 14 HB2 ASP 4 1HB ASP 4 36.586 -2.987 -0.093 15 HB3 ASP 4 2HB ASP 4 35.591 -3.486 1.280 16 H GLU 5 H GLU 5 34.121 0.457 0.349 17 HA GLU 5 HA GLU 5 31.834 -0.785 1.377 18 HB2 GLU 5 1HB GLU 5 32.183 0.216 3.496 19 HB3 GLU 5 2HB GLU 5 32.467 1.810 2.794 20 HG2 GLU 5 1HG GLU 5 30.238 2.240 2.520 21 HG3 GLU 5 2HG GLU 5 29.891 0.630 1.991 22 HA PRO 6 HA PRO 6 31.471 1.767 -2.438 23 HB2 PRO 6 1HB PRO 6 30.197 -0.039 -4.042 24 HB3 PRO 6 2HB PRO 6 31.951 -0.136 -3.681 25 HG2 PRO 6 1HG PRO 6 29.691 -1.645 -2.311 26 HG3 PRO 6 2HG PRO 6 31.216 -2.313 -2.986 27 HD2 PRO 6 1HD PRO 6 30.966 -1.711 -0.347 28 HD3 PRO 6 2HD PRO 6 32.485 -1.415 -1.227 29 H GLY 7 H GLY 7 29.557 2.787 -3.477 30 HA2 GLY 7 1HA GLY 7 27.319 2.840 -1.592 31 HA3 GLY 7 2HA GLY 7 27.864 4.111 -2.690 32 H GLY 8 H GLY 8 26.129 4.514 -3.822 33 HA2 GLY 8 1HA GLY 8 24.504 4.414 -5.354 34 HA3 GLY 8 2HA GLY 8 24.857 2.703 -5.704 35 H LYS 9 H LYS 9 24.324 3.677 -2.428 36 HA LYS 9 HA LYS 9 21.792 2.190 -2.405 37 HB2 LYS 9 1HB LYS 9 23.386 3.186 -0.053 38 HB3 LYS 9 2HB LYS 9 21.865 2.293 0.029 39 HG2 LYS 9 1HG LYS 9 22.957 0.467 -1.380 40 HG3 LYS 9 2HG LYS 9 24.494 1.295 -1.127 41 HD2 LYS 9 1HD LYS 9 24.219 0.947 1.344 42 HD3 LYS 9 2HD LYS 9 22.729 0.028 1.025 43 HE2 LYS 9 1HE LYS 9 23.927 -1.535 -0.403 44 HE3 LYS 9 2HE LYS 9 25.409 -0.591 -0.305 45 HZ1 LYS 9 3HZ LYS 9 25.458 -2.550 0.979 46 HZ2 LYS 9 1HZ LYS 9 24.238 -2.107 1.956 47 HZ3 LYS 9 2HZ LYS 9 25.671 -1.260 1.960 48 H GLY 10 H GLY 10 20.217 3.397 -3.092 49 HA2 GLY 10 1HA GLY 10 20.036 6.280 -2.868 50 HA3 GLY 10 2HA GLY 10 18.781 5.191 -3.490 51 H ALA 11 H ALA 11 17.336 4.072 -1.921 52 HA ALA 11 HA ALA 11 17.459 5.164 0.839 53 HB1 ALA 11 1HB ALA 11 15.156 5.545 -1.108 54 HB2 ALA 11 2HB ALA 11 15.066 5.935 0.619 55 HB3 ALA 11 3HB ALA 11 16.180 6.831 -0.448 56 H MET 12 H MET 12 16.248 4.097 2.346 57 HA MET 12 HA MET 12 14.969 1.501 1.701 58 HB2 MET 12 1HB MET 12 15.321 3.101 4.293 59 HB3 MET 12 2HB MET 12 14.501 1.557 4.165 60 HG2 MET 12 1HG MET 12 16.992 1.112 2.921 61 HG3 MET 12 2HG MET 12 17.370 2.175 4.261 62 HE1 MET 12 3HE MET 12 15.640 -1.200 3.168 63 HE2 MET 12 1HE MET 12 15.460 -2.052 4.710 64 HE3 MET 12 2HE MET 12 14.412 -0.678 4.336 65 H TYR 13 H TYR 13 12.728 1.252 2.116 66 HA TYR 13 HA TYR 13 11.131 3.613 2.823 67 HB2 TYR 13 1HB TYR 13 10.297 1.745 0.594 68 HB3 TYR 13 2HB TYR 13 9.445 3.174 1.148 69 HD1 TYR 13 1HD TYR 13 10.915 5.443 0.979 70 HD2 TYR 13 2HD TYR 13 11.463 1.896 -1.399 71 HE1 TYR 13 1HE TYR 13 12.150 6.769 -0.731 72 HE2 TYR 13 2HE TYR 13 12.707 3.214 -3.084 73 HH TYR 13 HH TYR 13 13.528 6.641 -2.591 74 H GLU 14 H GLU 14 9.187 3.045 3.862 75 HA GLU 14 HA GLU 14 8.369 0.281 4.088 76 HB2 GLU 14 1HB GLU 14 9.655 0.375 6.108 77 HB3 GLU 14 2HB GLU 14 9.091 2.000 6.487 78 HG2 GLU 14 1HG GLU 14 6.772 1.074 6.831 79 HG3 GLU 14 2HG GLU 14 7.426 -0.547 6.547 80 H VAL 15 H VAL 15 6.075 0.298 3.912 81 HA VAL 15 HA VAL 15 4.692 2.883 4.053 82 HB VAL 15 HB VAL 15 3.703 2.314 1.722 83 HG11 VAL 15 1HG1 VAL 15 6.549 2.903 1.768 84 HG12 VAL 15 2HG1 VAL 15 5.192 3.465 0.686 85 HG13 VAL 15 3HG1 VAL 15 5.209 3.918 2.358 86 HG21 VAL 15 3HG2 VAL 15 5.494 -0.048 1.794 87 HG22 VAL 15 1HG2 VAL 15 3.774 0.066 1.490 88 HG23 VAL 15 2HG2 VAL 15 4.887 0.730 0.304 89 H THR 16 H THR 16 2.495 2.732 4.444 90 HA THR 16 HA THR 16 1.692 0.094 5.513 91 HB THR 16 HB THR 16 0.481 1.559 7.293 92 HG1 THR 16 1HG THR 16 2.537 3.353 6.549 93 HG21 THR 16 3HG2 THR 16 3.529 1.423 7.377 94 HG22 THR 16 1HG2 THR 16 2.384 0.175 7.917 95 HG23 THR 16 2HG2 THR 16 2.456 1.719 8.769 96 H ILE 17 H ILE 17 -0.456 -0.405 5.379 97 HA ILE 17 HA ILE 17 -2.268 1.619 4.203 98 HB ILE 17 HB ILE 17 -1.603 0.227 2.433 99 HG12 ILE 17 1HG1 ILE 17 -3.706 -0.782 1.668 100 HG13 ILE 17 2HG1 ILE 17 -4.294 -0.898 3.329 101 HG21 ILE 17 1HG2 ILE 17 -2.300 -2.296 3.880 102 HG22 ILE 17 2HG2 ILE 17 -1.809 -2.131 2.193 103 HG23 ILE 17 3HG2 ILE 17 -0.659 -1.711 3.460 104 HD11 ILE 17 3HD1 ILE 17 -4.336 1.603 3.456 105 HD12 ILE 17 1HD1 ILE 17 -3.808 1.664 1.753 106 HD13 ILE 17 2HD1 ILE 17 -5.359 0.919 2.211 107 H GLU 18 H GLU 18 -3.222 2.046 6.152 108 HA GLU 18 HA GLU 18 -4.305 -0.043 7.935 109 HB2 GLU 18 1HB GLU 18 -4.589 2.957 7.729 110 HB3 GLU 18 2HB GLU 18 -5.433 2.017 8.944 111 HG2 GLU 18 1HG GLU 18 -3.512 1.584 10.177 112 HG3 GLU 18 2HG GLU 18 -2.434 1.740 8.819 113 H GLN 19 H GLN 19 -6.446 -0.748 7.760 114 HA GLN 19 HA GLN 19 -8.215 0.534 5.757 115 HB2 GLN 19 1HB GLN 19 -7.845 -2.451 6.338 116 HB3 GLN 19 2HB GLN 19 -9.094 -1.763 5.320 117 HG2 GLN 19 1HG GLN 19 -7.184 -0.681 3.946 118 HG3 GLN 19 2HG GLN 19 -6.104 -1.765 4.819 119 HE21 GLN 19 1HE2 GLN 19 -6.963 -4.226 4.745 120 HE22 GLN 19 2HE2 GLN 19 -7.275 -4.802 3.147 121 H SER 20 H SER 20 -10.068 1.231 6.744 122 HA SER 20 HA SER 20 -10.877 0.038 9.305 123 HB2 SER 20 1HB SER 20 -10.969 3.055 8.947 124 HB3 SER 20 2HB SER 20 -11.052 2.150 10.458 125 HG SER 20 HG SER 20 -9.073 3.423 9.575 126 H GLY 21 H GLY 21 -13.092 1.215 10.019 127 HA2 GLY 21 1HA GLY 21 -15.247 1.790 9.491 128 HA3 GLY 21 2HA GLY 21 -14.864 1.795 7.763 129 H ASP 22 H ASP 22 -14.627 -0.311 6.664 130 HA ASP 22 HA ASP 22 -15.255 -2.776 8.078 131 HB2 ASP 22 1HB ASP 22 -17.469 -1.873 7.379 132 HB3 ASP 22 2HB ASP 22 -16.931 -1.804 5.695 133 H PHE 23 H PHE 23 -14.533 -4.603 6.525 134 HA PHE 23 HA PHE 23 -13.741 -3.764 3.893 135 HB2 PHE 23 1HB PHE 23 -11.461 -4.637 3.869 136 HB3 PHE 23 2HB PHE 23 -11.650 -3.237 4.886 137 HD1 PHE 23 1HD PHE 23 -11.470 -3.374 7.347 138 HD2 PHE 23 2HD PHE 23 -10.898 -6.866 4.867 139 HE1 PHE 23 1HE PHE 23 -10.551 -4.596 9.283 140 HE2 PHE 23 2HE PHE 23 -10.072 -8.105 6.835 141 HZ PHE 23 HZ PHE 23 -9.850 -6.977 9.047 142 H ARG 24 H ARG 24 -15.870 -5.221 4.180 143 HA ARG 24 HA ARG 24 -14.859 -7.906 3.364 144 HB2 ARG 24 1HB ARG 24 -17.443 -7.027 4.775 145 HB3 ARG 24 2HB ARG 24 -17.060 -8.699 4.279 146 HG2 ARG 24 1HG ARG 24 -15.008 -8.660 5.648 147 HG3 ARG 24 2HG ARG 24 -15.374 -7.021 6.221 148 HD2 ARG 24 1HD ARG 24 -17.367 -7.757 7.334 149 HD3 ARG 24 2HD ARG 24 -17.198 -9.378 6.647 150 HE ARG 24 HE ARG 24 -15.773 -8.197 8.906 151 HH11 ARG 24 1HH1 ARG 24 -15.577 -10.819 6.551 152 HH12 ARG 24 2HH1 ARG 24 -14.320 -11.663 7.405 153 HH21 ARG 24 1HH2 ARG 24 -14.037 -9.116 9.874 154 HH22 ARG 24 2HH2 ARG 24 -13.232 -10.524 9.252 155 H SER 25 H SER 25 -16.085 -5.184 1.841 156 HA SER 25 HA SER 25 -17.117 -6.797 -0.394 157 HB2 SER 25 1HB SER 25 -18.955 -6.332 1.330 158 HB3 SER 25 2HB SER 25 -18.799 -4.619 0.923 159 HG SER 25 HG SER 25 -20.381 -5.356 -0.275 160 H PHE 26 H PHE 26 -14.720 -5.532 -0.621 161 HA PHE 26 HA PHE 26 -15.305 -3.195 -2.312 162 HB2 PHE 26 1HB PHE 26 -13.459 -3.028 0.114 163 HB3 PHE 26 2HB PHE 26 -13.553 -1.859 -1.186 164 HD1 PHE 26 2HD PHE 26 -15.564 -0.513 -1.573 165 HD2 PHE 26 1HD PHE 26 -15.082 -3.003 1.901 166 HE1 PHE 26 2HE PHE 26 -17.672 0.424 -0.597 167 HE2 PHE 26 1HE PHE 26 -17.115 -2.009 2.918 168 HZ PHE 26 HZ PHE 26 -18.448 -0.366 1.644 169 H ILE 27 H ILE 27 -14.235 -3.827 -4.186 170 HA ILE 27 HA ILE 27 -12.274 -5.786 -4.402 171 HB ILE 27 HB ILE 27 -12.848 -3.407 -6.207 172 HG12 ILE 27 1HG1 ILE 27 -13.622 -6.293 -6.773 173 HG13 ILE 27 2HG1 ILE 27 -14.633 -5.312 -5.734 174 HG21 ILE 27 1HG2 ILE 27 -11.736 -4.754 -8.029 175 HG22 ILE 27 2HG2 ILE 27 -10.610 -4.231 -6.788 176 HG23 ILE 27 3HG2 ILE 27 -11.189 -5.906 -6.800 177 HD11 ILE 27 3HD1 ILE 27 -14.864 -3.603 -7.521 178 HD12 ILE 27 1HD1 ILE 27 -13.938 -4.657 -8.616 179 HD13 ILE 27 2HD1 ILE 27 -15.506 -5.188 -7.973 180 H LYS 28 H LYS 28 -10.568 -5.696 -3.015 181 HA LYS 28 HA LYS 28 -8.798 -3.331 -2.917 182 HB2 LYS 28 1HB LYS 28 -8.863 -6.068 -1.640 183 HB3 LYS 28 2HB LYS 28 -7.361 -5.147 -1.676 184 HG2 LYS 28 1HG LYS 28 -8.104 -3.531 -0.260 185 HG3 LYS 28 2HG LYS 28 -9.800 -3.699 -0.706 186 HD2 LYS 28 1HD LYS 28 -8.345 -5.925 0.760 187 HD3 LYS 28 2HD LYS 28 -9.000 -4.552 1.655 188 HE2 LYS 28 1HE LYS 28 -10.539 -6.531 -0.068 189 HE3 LYS 28 2HE LYS 28 -10.486 -6.457 1.707 190 HZ1 LYS 28 3HZ LYS 28 -11.378 -4.115 1.394 191 HZ2 LYS 28 1HZ LYS 28 -12.409 -5.376 1.015 192 HZ3 LYS 28 2HZ LYS 28 -11.676 -4.588 -0.175 193 H SER 29 H SER 29 -7.055 -3.070 -4.178 194 HA SER 29 HA SER 29 -5.756 -5.324 -5.554 195 HB2 SER 29 1HB SER 29 -7.334 -3.984 -7.097 196 HB3 SER 29 2HB SER 29 -6.344 -2.570 -6.702 197 HG SER 29 HG SER 29 -4.711 -3.314 -7.821 198 H VAL 30 H VAL 30 -3.496 -4.956 -5.520 199 HA VAL 30 HA VAL 30 -2.575 -2.260 -4.849 200 HB VAL 30 HB VAL 30 -1.828 -4.754 -3.281 201 HG11 VAL 30 1HG1 VAL 30 -0.195 -3.362 -2.066 202 HG12 VAL 30 2HG1 VAL 30 0.276 -3.580 -3.736 203 HG13 VAL 30 3HG1 VAL 30 -0.462 -2.036 -3.226 204 HG21 VAL 30 3HG2 VAL 30 -3.790 -3.510 -2.409 205 HG22 VAL 30 1HG2 VAL 30 -2.403 -3.157 -1.372 206 HG23 VAL 30 2HG2 VAL 30 -2.941 -1.975 -2.558 207 H VAL 31 H VAL 31 -0.441 -1.894 -5.652 208 HA VAL 31 HA VAL 31 0.843 -4.021 -7.212 209 HB VAL 31 HB VAL 31 0.120 -2.525 -8.913 210 HG11 VAL 31 1HG1 VAL 31 1.261 -0.201 -7.340 211 HG12 VAL 31 2HG1 VAL 31 0.674 -0.131 -9.011 212 HG13 VAL 31 3HG1 VAL 31 -0.455 -0.535 -7.715 213 HG21 VAL 31 3HG2 VAL 31 2.195 -1.837 -9.923 214 HG22 VAL 31 1HG2 VAL 31 3.007 -1.743 -8.350 215 HG23 VAL 31 2HG2 VAL 31 2.526 -3.317 -9.011 216 H VAL 32 H VAL 32 3.125 -4.071 -6.557 217 HA VAL 32 HA VAL 32 4.143 -1.870 -4.965 218 HB VAL 32 HB VAL 32 2.966 -3.344 -3.326 219 HG11 VAL 32 1HG1 VAL 32 3.517 -5.482 -4.345 220 HG12 VAL 32 2HG1 VAL 32 5.215 -5.274 -3.869 221 HG13 VAL 32 3HG1 VAL 32 3.951 -5.412 -2.614 222 HG21 VAL 32 3HG2 VAL 32 4.815 -3.311 -1.685 223 HG22 VAL 32 1HG2 VAL 32 5.949 -2.927 -2.991 224 HG23 VAL 32 2HG2 VAL 32 4.660 -1.793 -2.585 225 H VAL 33 H VAL 33 6.200 -1.493 -5.532 226 HA VAL 33 HA VAL 33 7.710 -3.667 -6.886 227 HB VAL 33 HB VAL 33 7.555 -0.784 -7.797 228 HG11 VAL 33 1HG1 VAL 33 8.584 -1.742 -9.908 229 HG12 VAL 33 2HG1 VAL 33 9.654 -1.798 -8.524 230 HG13 VAL 33 3HG1 VAL 33 8.825 -3.283 -9.045 231 HG21 VAL 33 3HG2 VAL 33 6.006 -3.209 -8.717 232 HG22 VAL 33 1HG2 VAL 33 5.417 -1.602 -8.286 233 HG23 VAL 33 2HG2 VAL 33 6.306 -1.839 -9.791 234 H ALA 34 H ALA 34 10.149 -3.146 -6.911 235 HA ALA 34 HA ALA 34 11.042 -1.100 -5.091 236 HB1 ALA 34 1HB ALA 34 11.027 -2.755 -3.391 237 HB2 ALA 34 2HB ALA 34 11.560 -4.051 -4.504 238 HB3 ALA 34 3HB ALA 34 12.686 -2.782 -3.993 239 H ASN 35 H ASN 35 12.113 -0.134 -6.776 240 HA ASN 35 HA ASN 35 13.717 -1.497 -8.738 241 HB2 ASN 35 1HB ASN 35 13.077 0.982 -8.902 242 HB3 ASN 35 2HB ASN 35 14.372 1.256 -7.727 243 HD21 ASN 35 1HD2 ASN 35 13.792 1.636 -10.856 244 HD22 ASN 35 2HD2 ASN 35 15.279 1.084 -11.598 245 H GLY 36 H GLY 36 14.777 -3.056 -7.481 246 HA2 GLY 36 1HA GLY 36 17.369 -3.237 -7.651 247 HA3 GLY 36 2HA GLY 36 17.291 -2.174 -6.221 248 H THR 37 H THR 37 16.000 -2.980 -4.397 249 HA THR 37 HA THR 37 16.717 -5.742 -3.836 250 HB THR 37 HB THR 37 17.133 -3.641 -2.443 251 HG1 THR 37 1HG THR 37 17.259 -5.956 -1.747 252 HG21 THR 37 3HG2 THR 37 14.673 -2.944 -2.474 253 HG22 THR 37 1HG2 THR 37 15.506 -2.899 -0.903 254 HG23 THR 37 2HG2 THR 37 14.409 -4.219 -1.277 255 H GLN 38 H GLN 38 14.767 -6.464 -1.923 256 HA GLN 38 HA GLN 38 12.376 -6.959 -3.577 257 HB2 GLN 38 1HB GLN 38 13.932 -8.586 -1.526 258 HB3 GLN 38 2HB GLN 38 12.240 -8.895 -1.816 259 HG2 GLN 38 1HG GLN 38 13.283 -10.366 -3.279 260 HG3 GLN 38 2HG GLN 38 12.790 -9.013 -4.289 261 HE21 GLN 38 1HE2 GLN 38 14.361 -10.211 -5.715 262 HE22 GLN 38 2HE2 GLN 38 16.009 -9.623 -5.687 263 H LEU 39 H LEU 39 10.483 -7.290 -2.392 264 HA LEU 39 HA LEU 39 9.984 -5.407 -0.168 265 HB2 LEU 39 1HB LEU 39 8.351 -6.816 -2.238 266 HB3 LEU 39 2HB LEU 39 7.597 -6.740 -0.674 267 HG LEU 39 HG LEU 39 7.019 -4.906 -2.289 268 HD11 LEU 39 1HD1 LEU 39 6.595 -4.768 0.141 269 HD12 LEU 39 2HD1 LEU 39 6.909 -3.177 -0.580 270 HD13 LEU 39 3HD1 LEU 39 8.166 -3.972 0.362 271 HD21 LEU 39 3HD2 LEU 39 9.321 -4.420 -3.118 272 HD22 LEU 39 1HD2 LEU 39 9.715 -3.717 -1.522 273 HD23 LEU 39 2HD2 LEU 39 8.455 -2.991 -2.529 274 H LYS 40 H LYS 40 9.005 -6.073 1.658 275 HA LYS 40 HA LYS 40 9.232 -8.912 2.511 276 HB2 LYS 40 1HB LYS 40 11.071 -7.584 3.411 277 HB3 LYS 40 2HB LYS 40 9.934 -6.367 4.015 278 HG2 LYS 40 1HG LYS 40 8.897 -8.128 5.484 279 HG3 LYS 40 2HG LYS 40 10.120 -9.287 4.913 280 HD2 LYS 40 1HD LYS 40 11.917 -7.891 5.810 281 HD3 LYS 40 2HD LYS 40 10.750 -6.593 6.172 282 HE2 LYS 40 1HE LYS 40 9.549 -8.163 7.713 283 HE3 LYS 40 2HE LYS 40 10.857 -9.330 7.479 284 HZ1 LYS 40 3HZ LYS 40 11.213 -7.924 9.438 285 HZ2 LYS 40 1HZ LYS 40 11.211 -6.570 8.496 286 HZ3 LYS 40 2HZ LYS 40 12.408 -7.689 8.349 287 H ASP 41 H ASP 41 7.285 -9.612 2.854 288 HA ASP 41 HA ASP 41 4.930 -7.974 2.988 289 HB2 ASP 41 1HB ASP 41 5.513 -10.476 2.062 290 HB3 ASP 41 2HB ASP 41 4.832 -10.893 3.633 291 H GLY 42 H GLY 42 4.029 -7.141 4.862 292 HA2 GLY 42 1HA GLY 42 5.156 -7.668 7.495 293 HA3 GLY 42 2HA GLY 42 3.815 -6.608 7.092 294 H ALA 43 H ALA 43 2.840 -9.301 5.583 295 HA ALA 43 HA ALA 43 0.968 -10.293 7.434 296 HB1 ALA 43 1HB ALA 43 0.877 -12.266 5.918 297 HB2 ALA 43 2HB ALA 43 0.888 -10.753 5.011 298 HB3 ALA 43 3HB ALA 43 2.357 -11.735 5.119 299 H THR 44 H THR 44 4.128 -11.584 6.498 300 HA THR 44 HA THR 44 4.448 -13.170 8.975 301 HB THR 44 HB THR 44 4.946 -15.091 7.222 302 HG1 THR 44 1HG THR 44 3.753 -14.896 5.373 303 HG21 THR 44 3HG2 THR 44 2.981 -14.956 8.850 304 HG22 THR 44 1HG2 THR 44 2.661 -15.847 7.353 305 HG23 THR 44 2HG2 THR 44 2.049 -14.211 7.538 306 H GLY 45 H GLY 45 5.971 -10.869 7.197 307 HA2 GLY 45 1HA GLY 45 8.117 -10.213 7.117 308 HA3 GLY 45 2HA GLY 45 8.632 -11.681 7.957 309 H GLU 46 H GLU 46 6.620 -12.137 5.139 310 HA GLU 46 HA GLU 46 8.538 -13.879 4.002 311 HB2 GLU 46 1HB GLU 46 5.787 -12.931 3.292 312 HB3 GLU 46 2HB GLU 46 6.749 -13.729 2.043 313 HG2 GLU 46 1HG GLU 46 6.575 -15.046 4.758 314 HG3 GLU 46 2HG GLU 46 5.183 -15.121 3.699 315 H SER 47 H SER 47 10.200 -13.500 2.662 316 HA SER 47 HA SER 47 10.530 -10.919 1.338 317 HB2 SER 47 1HB SER 47 12.030 -13.432 0.603 318 HB3 SER 47 2HB SER 47 12.603 -11.758 0.636 319 HG SER 47 HG SER 47 13.141 -13.514 2.329 320 H LEU 48 H LEU 48 9.691 -10.404 -0.638 321 HA LEU 48 HA LEU 48 8.654 -12.599 -2.388 322 HB2 LEU 48 1HB LEU 48 7.619 -9.772 -2.039 323 HB3 LEU 48 2HB LEU 48 6.923 -11.017 -3.084 324 HG LEU 48 HG LEU 48 7.049 -11.088 -0.034 325 HD11 LEU 48 1HD1 LEU 48 5.493 -9.461 -0.881 326 HD12 LEU 48 2HD1 LEU 48 4.642 -10.854 -0.199 327 HD13 LEU 48 3HD1 LEU 48 4.756 -10.673 -1.975 328 HD21 LEU 48 3HD2 LEU 48 5.817 -13.084 -1.984 329 HD22 LEU 48 1HD2 LEU 48 5.567 -13.065 -0.223 330 HD23 LEU 48 2HD2 LEU 48 7.169 -13.383 -0.865 331 H ALA 49 H ALA 49 8.345 -11.530 -4.784 332 HA ALA 49 HA ALA 49 10.937 -10.256 -5.496 333 HB1 ALA 49 1HB ALA 49 9.581 -12.744 -6.566 334 HB2 ALA 49 2HB ALA 49 10.818 -11.835 -7.475 335 HB3 ALA 49 3HB ALA 49 11.218 -12.552 -5.905 336 H SER 50 H SER 50 10.340 -8.275 -6.164 337 HA SER 50 HA SER 50 7.824 -7.625 -7.165 338 HB2 SER 50 1HB SER 50 8.760 -5.437 -7.131 339 HB3 SER 50 2HB SER 50 9.425 -6.272 -5.760 340 HG SER 50 HG SER 50 11.382 -6.505 -6.931 341 HA PRO 51 HA PRO 51 7.145 -5.549 -8.443 342 HB2 PRO 51 1HB PRO 51 5.605 -5.050 -10.620 343 HB3 PRO 51 2HB PRO 51 7.186 -4.264 -10.380 344 HG2 PRO 51 1HG PRO 51 6.572 -6.625 -12.124 345 HG3 PRO 51 2HG PRO 51 7.553 -5.188 -12.506 346 HD2 PRO 51 1HD PRO 51 8.671 -7.555 -11.677 347 HD3 PRO 51 2HD PRO 51 9.380 -5.971 -11.280 348 H VAL 52 H VAL 52 5.005 -6.109 -7.619 349 HA VAL 52 HA VAL 52 3.820 -8.609 -8.663 350 HB VAL 52 HB VAL 52 5.397 -9.190 -6.831 351 HG11 VAL 52 1HG1 VAL 52 5.190 -7.152 -5.461 352 HG12 VAL 52 2HG1 VAL 52 3.525 -7.616 -5.050 353 HG13 VAL 52 3HG1 VAL 52 4.864 -8.625 -4.509 354 HG21 VAL 52 3HG2 VAL 52 2.476 -9.675 -6.114 355 HG22 VAL 52 1HG2 VAL 52 3.482 -10.642 -7.212 356 HG23 VAL 52 2HG2 VAL 52 3.877 -10.572 -5.496 357 H ILE 53 H ILE 53 1.646 -8.826 -8.398 358 HA ILE 53 HA ILE 53 0.099 -6.505 -7.395 359 HB ILE 53 HB ILE 53 -0.537 -8.541 -9.559 360 HG12 ILE 53 1HG1 ILE 53 0.918 -7.165 -10.684 361 HG13 ILE 53 2HG1 ILE 53 -0.654 -6.447 -11.029 362 HG21 ILE 53 1HG2 ILE 53 -2.187 -6.189 -8.576 363 HG22 ILE 53 2HG2 ILE 53 -2.557 -7.188 -9.988 364 HG23 ILE 53 3HG2 ILE 53 -2.578 -7.908 -8.388 365 HD11 ILE 53 3HD1 ILE 53 1.467 -5.366 -9.206 366 HD12 ILE 53 1HD1 ILE 53 0.784 -4.647 -10.664 367 HD13 ILE 53 2HD1 ILE 53 -0.223 -4.771 -9.200 368 H LEU 54 H LEU 54 -1.180 -6.963 -5.722 369 HA LEU 54 HA LEU 54 -1.741 -9.824 -4.968 370 HB2 LEU 54 1HB LEU 54 -1.566 -7.322 -3.265 371 HB3 LEU 54 2HB LEU 54 -2.350 -8.793 -2.758 372 HG LEU 54 HG LEU 54 -0.295 -8.888 -1.713 373 HD11 LEU 54 1HD1 LEU 54 -0.605 -11.080 -2.576 374 HD12 LEU 54 2HD1 LEU 54 1.079 -10.685 -2.824 375 HD13 LEU 54 3HD1 LEU 54 0.016 -10.628 -4.206 376 HD21 LEU 54 3HD2 LEU 54 1.850 -8.449 -2.682 377 HD22 LEU 54 1HD2 LEU 54 0.763 -7.082 -2.938 378 HD23 LEU 54 2HD2 LEU 54 1.127 -8.226 -4.291 379 H SER 55 H SER 55 -3.679 -10.521 -4.798 380 HA SER 55 HA SER 55 -5.816 -9.050 -6.031 381 HB2 SER 55 1HB SER 55 -6.058 -11.698 -4.603 382 HB3 SER 55 2HB SER 55 -6.973 -11.106 -5.988 383 HG SER 55 HG SER 55 -4.897 -12.667 -6.078 384 H ASP 56 H ASP 56 -7.920 -9.200 -5.049 385 HA ASP 56 HA ASP 56 -8.323 -7.770 -2.687 386 HB2 ASP 56 1HB ASP 56 -9.920 -7.846 -4.561 387 HB3 ASP 56 2HB ASP 56 -10.151 -9.584 -4.301 388 H GLU 57 H GLU 57 -7.991 -11.221 -3.158 389 HA GLU 57 HA GLU 57 -9.077 -11.979 -0.568 390 HB2 GLU 57 1HB GLU 57 -7.334 -13.350 -2.647 391 HB3 GLU 57 2HB GLU 57 -7.627 -14.072 -1.050 392 HG2 GLU 57 1HG GLU 57 -10.002 -14.156 -1.397 393 HG3 GLU 57 2HG GLU 57 -9.884 -13.258 -2.916 394 H GLU 58 H GLU 58 -5.821 -10.983 -1.803 395 HA GLU 58 HA GLU 58 -4.455 -12.059 0.508 396 HB2 GLU 58 1HB GLU 58 -3.380 -9.987 -1.371 397 HB3 GLU 58 2HB GLU 58 -2.500 -11.237 -0.509 398 HG2 GLU 58 1HG GLU 58 -4.298 -11.590 -2.949 399 HG3 GLU 58 2HG GLU 58 -2.583 -11.659 -2.935 400 H LEU 59 H LEU 59 -5.531 -8.841 -0.627 401 HA LEU 59 HA LEU 59 -4.514 -7.415 1.646 402 HB2 LEU 59 1HB LEU 59 -6.101 -6.893 -0.845 403 HB3 LEU 59 2HB LEU 59 -6.294 -5.733 0.432 404 HG LEU 59 HG LEU 59 -4.686 -5.020 -1.102 405 HD11 LEU 59 1HD1 LEU 59 -3.123 -5.602 1.428 406 HD12 LEU 59 2HD1 LEU 59 -4.585 -4.606 1.489 407 HD13 LEU 59 3HD1 LEU 59 -3.249 -4.083 0.484 408 HD21 LEU 59 3HD2 LEU 59 -3.721 -7.116 -1.855 409 HD22 LEU 59 1HD2 LEU 59 -2.931 -7.367 -0.281 410 HD23 LEU 59 2HD2 LEU 59 -2.451 -6.001 -1.306 411 H ALA 60 H ALA 60 -6.784 -9.578 1.952 412 HA ALA 60 HA ALA 60 -9.113 -8.209 2.966 413 HB1 ALA 60 1HB ALA 60 -9.895 -10.475 3.437 414 HB2 ALA 60 2HB ALA 60 -9.134 -10.426 1.835 415 HB3 ALA 60 3HB ALA 60 -8.253 -11.113 3.219 416 H VAL 61 H VAL 61 -6.912 -7.247 4.403 417 HA VAL 61 HA VAL 61 -7.277 -8.324 7.167 418 HB VAL 61 HB VAL 61 -4.753 -7.680 7.377 419 HG11 VAL 61 1HG1 VAL 61 -4.015 -9.875 6.721 420 HG12 VAL 61 2HG1 VAL 61 -5.575 -9.983 7.554 421 HG13 VAL 61 3HG1 VAL 61 -5.499 -10.160 5.783 422 HG21 VAL 61 3HG2 VAL 61 -4.794 -8.233 4.372 423 HG22 VAL 61 1HG2 VAL 61 -4.592 -6.621 5.102 424 HG23 VAL 61 2HG2 VAL 61 -3.409 -7.925 5.401 425 H GLU 62 H GLU 62 -6.692 -6.852 8.854 426 HA GLU 62 HA GLU 62 -7.951 -4.322 8.592 427 HB2 GLU 62 1HB GLU 62 -7.437 -4.101 10.961 428 HB3 GLU 62 2HB GLU 62 -7.974 -5.744 10.583 429 HG2 GLU 62 1HG GLU 62 -5.479 -6.387 10.416 430 HG3 GLU 62 2HG GLU 62 -5.155 -4.777 11.037 431 H LYS 63 H LYS 63 -4.579 -5.196 8.269 432 HA LYS 63 HA LYS 63 -3.749 -2.435 7.719 433 HB2 LYS 63 1HB LYS 63 -3.659 -2.653 10.218 434 HB3 LYS 63 2HB LYS 63 -2.688 -4.092 10.073 435 HG2 LYS 63 1HG LYS 63 -1.385 -2.172 10.761 436 HG3 LYS 63 2HG LYS 63 -0.785 -2.802 9.224 437 HD2 LYS 63 1HD LYS 63 -1.725 -0.957 8.039 438 HD3 LYS 63 2HD LYS 63 -2.643 -0.445 9.464 439 HE2 LYS 63 1HE LYS 63 0.405 -0.503 9.317 440 HE3 LYS 63 2HE LYS 63 -0.575 0.925 8.965 441 HZ1 LYS 63 3HZ LYS 63 0.109 1.125 11.158 442 HZ2 LYS 63 1HZ LYS 63 -0.270 -0.402 11.569 443 HZ3 LYS 63 2HZ LYS 63 -1.463 0.709 11.307 444 H VAL 64 H VAL 64 -2.031 -2.645 6.081 445 HA VAL 64 HA VAL 64 -0.387 -5.059 6.542 446 HB VAL 64 HB VAL 64 -0.660 -3.949 3.746 447 HG11 VAL 64 1HG1 VAL 64 0.161 -6.187 3.163 448 HG12 VAL 64 2HG1 VAL 64 1.287 -5.350 4.229 449 HG13 VAL 64 3HG1 VAL 64 0.212 -6.601 4.888 450 HG21 VAL 64 3HG2 VAL 64 -2.937 -4.688 4.217 451 HG22 VAL 64 1HG2 VAL 64 -2.134 -6.003 3.327 452 HG23 VAL 64 2HG2 VAL 64 -2.300 -6.113 5.077 453 H THR 65 H THR 65 1.820 -4.673 6.297 454 HA THR 65 HA THR 65 2.695 -1.896 5.916 455 HB THR 65 HB THR 65 3.679 -3.701 8.174 456 HG1 THR 65 1HG THR 65 2.562 -2.360 9.515 457 HG21 THR 65 3HG2 THR 65 4.714 -1.426 8.825 458 HG22 THR 65 1HG2 THR 65 4.371 -0.900 7.183 459 HG23 THR 65 2HG2 THR 65 5.451 -2.277 7.455 460 H LEU 66 H LEU 66 4.510 -1.847 4.635 461 HA LEU 66 HA LEU 66 5.689 -4.431 3.726 462 HB2 LEU 66 1HB LEU 66 4.398 -2.158 2.190 463 HB3 LEU 66 2HB LEU 66 5.514 -3.263 1.418 464 HG LEU 66 HG LEU 66 3.035 -4.273 2.880 465 HD11 LEU 66 1HD1 LEU 66 3.368 -3.281 0.048 466 HD12 LEU 66 2HD1 LEU 66 2.234 -2.693 1.297 467 HD13 LEU 66 3HD1 LEU 66 2.016 -4.305 0.576 468 HD21 LEU 66 3HD2 LEU 66 4.519 -5.533 0.534 469 HD22 LEU 66 1HD2 LEU 66 3.301 -6.268 1.583 470 HD23 LEU 66 2HD2 LEU 66 4.904 -5.908 2.227 471 H SER 67 H SER 67 7.818 -4.139 2.904 472 HA SER 67 HA SER 67 9.120 -1.551 3.173 473 HB2 SER 67 1HB SER 67 8.838 -2.266 5.578 474 HB3 SER 67 2HB SER 67 9.819 -3.691 5.230 475 HG SER 67 HG SER 67 10.609 -0.958 5.050 476 H THR 68 H THR 68 11.552 -1.884 3.012 477 HA THR 68 HA THR 68 12.012 -3.685 0.694 478 HB THR 68 HB THR 68 14.162 -2.097 0.686 479 HG1 THR 68 1HG THR 68 12.192 -0.572 2.051 480 HG21 THR 68 3HG2 THR 68 11.431 -1.123 -0.208 481 HG22 THR 68 1HG2 THR 68 12.459 -2.250 -1.121 482 HG23 THR 68 2HG2 THR 68 12.990 -0.574 -0.848 483 H THR 69 H THR 69 13.626 -5.312 0.793 484 HA THR 69 HA THR 69 14.776 -5.831 3.388 485 HB THR 69 HB THR 69 15.787 -7.781 2.193 486 HG1 THR 69 1HG THR 69 15.199 -8.148 0.097 487 HG21 THR 69 3HG2 THR 69 13.518 -7.935 3.212 488 HG22 THR 69 1HG2 THR 69 13.697 -8.972 1.793 489 HG23 THR 69 2HG2 THR 69 12.800 -7.447 1.654 490 H GLY 70 H GLY 70 15.724 -3.603 1.106 491 HA2 GLY 70 1HA GLY 70 18.498 -3.468 2.123 492 HA3 GLY 70 2HA GLY 70 18.277 -3.843 0.423 493 H LYS 71 H LYS 71 17.891 -2.182 -0.965 494 HA LYS 71 HA LYS 71 16.780 0.357 -0.039 495 HB2 LYS 71 1HB LYS 71 18.227 1.599 -1.571 496 HB3 LYS 71 2HB LYS 71 19.158 0.823 -0.287 497 HG2 LYS 71 1HG LYS 71 20.499 -0.031 -1.811 498 HG3 LYS 71 2HG LYS 71 19.205 -1.008 -2.447 499 HD2 LYS 71 1HD LYS 71 20.004 1.759 -3.440 500 HD3 LYS 71 2HD LYS 71 20.404 0.233 -4.188 501 HE2 LYS 71 1HE LYS 71 17.608 0.231 -3.991 502 HE3 LYS 71 2HE LYS 71 17.974 1.914 -4.424 503 HZ1 LYS 71 3HZ LYS 71 19.098 -0.447 -5.907 504 HZ2 LYS 71 1HZ LYS 71 18.992 1.068 -6.428 505 HZ3 LYS 71 2HZ LYS 71 17.624 0.194 -6.271 506 H ALA 72 H ALA 72 15.534 1.377 -1.693 507 HA ALA 72 HA ALA 72 15.538 0.062 -4.313 508 HB1 ALA 72 1HB ALA 72 12.989 0.908 -2.891 509 HB2 ALA 72 2HB ALA 72 13.110 0.417 -4.591 510 HB3 ALA 72 3HB ALA 72 13.491 -0.743 -3.307 511 H ILE 73 H ILE 73 14.438 1.699 -5.842 512 HA ILE 73 HA ILE 73 15.474 4.456 -5.178 513 HB ILE 73 HB ILE 73 14.846 3.363 -7.938 514 HG12 ILE 73 1HG1 ILE 73 16.650 1.925 -6.896 515 HG13 ILE 73 2HG1 ILE 73 17.072 2.734 -8.359 516 HG21 ILE 73 1HG2 ILE 73 16.445 5.095 -8.675 517 HG22 ILE 73 2HG2 ILE 73 15.009 5.747 -7.849 518 HG23 ILE 73 3HG2 ILE 73 16.568 5.640 -6.983 519 HD11 ILE 73 3HD1 ILE 73 18.913 2.785 -6.719 520 HD12 ILE 73 1HD1 ILE 73 18.397 4.388 -7.144 521 HD13 ILE 73 2HD1 ILE 73 17.888 3.688 -5.576 522 H GLU 74 H GLU 74 12.594 2.627 -5.381 523 HA GLU 74 HA GLU 74 10.848 4.825 -6.029 524 HB2 GLU 74 1HB GLU 74 10.068 3.734 -8.108 525 HB3 GLU 74 2HB GLU 74 11.801 3.773 -8.169 526 HG2 GLU 74 1HG GLU 74 11.159 1.783 -9.031 527 HG3 GLU 74 2HG GLU 74 11.754 1.476 -7.382 528 H PHE 75 H PHE 75 8.598 3.998 -5.751 529 HA PHE 75 HA PHE 75 7.982 1.506 -4.614 530 HB2 PHE 75 1HB PHE 75 8.452 3.665 -2.675 531 HB3 PHE 75 2HB PHE 75 6.745 3.293 -2.696 532 HD1 PHE 75 2HD PHE 75 9.388 0.713 -3.253 533 HD2 PHE 75 1HD PHE 75 6.508 2.359 -0.413 534 HE1 PHE 75 2HE PHE 75 9.826 -1.131 -1.747 535 HE2 PHE 75 1HE PHE 75 7.336 0.690 1.227 536 HZ PHE 75 HZ PHE 75 8.843 -1.135 0.560 537 H ALA 76 H ALA 76 6.681 1.359 -6.385 538 HA ALA 76 HA ALA 76 4.709 3.472 -6.936 539 HB1 ALA 76 1HB ALA 76 5.292 0.868 -8.377 540 HB2 ALA 76 2HB ALA 76 4.211 2.175 -8.933 541 HB3 ALA 76 3HB ALA 76 5.950 2.475 -8.781 542 H VAL 77 H VAL 77 2.815 3.497 -5.793 543 HA VAL 77 HA VAL 77 1.549 0.902 -5.096 544 HB VAL 77 HB VAL 77 1.778 3.409 -3.376 545 HG11 VAL 77 1HG1 VAL 77 -0.348 2.272 -2.966 546 HG12 VAL 77 2HG1 VAL 77 0.467 0.701 -2.848 547 HG13 VAL 77 3HG1 VAL 77 0.744 1.954 -1.618 548 HG21 VAL 77 3HG2 VAL 77 3.102 1.818 -1.865 549 HG22 VAL 77 1HG2 VAL 77 3.197 0.719 -3.256 550 HG23 VAL 77 2HG2 VAL 77 3.919 2.329 -3.338 551 H SER 78 H SER 78 -0.340 0.718 -6.122 552 HA SER 78 HA SER 78 -2.236 2.922 -6.331 553 HB2 SER 78 1HB SER 78 -1.003 3.042 -8.444 554 HB3 SER 78 2HB SER 78 -1.281 1.314 -8.720 555 HG SER 78 HG SER 78 -2.812 2.246 -9.842 556 H GLY 79 H GLY 79 -4.365 1.914 -7.112 557 HA2 GLY 79 1HA GLY 79 -5.384 -0.572 -6.515 558 HA3 GLY 79 2HA GLY 79 -5.032 0.172 -4.944 559 H GLY 80 H GLY 80 -7.480 0.226 -4.704 560 HA2 GLY 80 1HA GLY 80 -8.619 2.616 -4.439 561 HA3 GLY 80 2HA GLY 80 -8.830 2.451 -6.175 562 H VAL 81 H VAL 81 -10.580 2.206 -3.476 563 HA VAL 81 HA VAL 81 -11.856 -0.407 -4.123 564 HB VAL 81 HB VAL 81 -12.813 0.077 -1.700 565 HG11 VAL 81 1HG1 VAL 81 -10.052 -1.045 -2.316 566 HG12 VAL 81 2HG1 VAL 81 -10.957 -1.310 -0.792 567 HG13 VAL 81 3HG1 VAL 81 -11.596 -1.916 -2.322 568 HG21 VAL 81 3HG2 VAL 81 -10.093 1.411 -1.499 569 HG22 VAL 81 1HG2 VAL 81 -11.692 2.225 -1.440 570 HG23 VAL 81 2HG2 VAL 81 -11.238 1.074 -0.191 571 H VAL 82 H VAL 82 -13.468 -0.106 -5.466 572 HA VAL 82 HA VAL 82 -15.259 2.200 -5.202 573 HB VAL 82 HB VAL 82 -14.564 1.490 -7.421 574 HG11 VAL 82 1HG1 VAL 82 -15.756 -1.248 -6.796 575 HG12 VAL 82 2HG1 VAL 82 -15.275 -0.689 -8.402 576 HG13 VAL 82 3HG1 VAL 82 -14.053 -0.876 -7.145 577 HG21 VAL 82 3HG2 VAL 82 -16.884 2.346 -7.092 578 HG22 VAL 82 1HG2 VAL 82 -16.667 1.332 -8.542 579 HG23 VAL 82 2HG2 VAL 82 -17.468 0.671 -7.097 580 H ASP 83 H ASP 83 -17.404 2.140 -4.539 581 HA ASP 83 HA ASP 83 -18.264 -0.018 -2.880 582 HB2 ASP 83 1HB ASP 83 -20.098 1.591 -2.512 583 HB3 ASP 83 2HB ASP 83 -18.475 2.161 -2.113 584 H GLY 84 H GLY 84 -18.686 -1.707 -4.084 585 HA2 GLY 84 1HA GLY 84 -20.420 -1.712 -6.466 586 HA3 GLY 84 2HA GLY 84 -19.655 -3.094 -5.668 587 H GLU 85 H GLU 85 -21.678 -0.419 -4.465 588 HA GLU 85 HA GLU 85 -23.522 -2.027 -2.967 589 HB2 GLU 85 1HB GLU 85 -24.632 -0.145 -2.372 590 HB3 GLU 85 2HB GLU 85 -22.939 0.229 -2.364 591 HG2 GLU 85 1HG GLU 85 -23.284 1.948 -3.695 592 HG3 GLU 85 2HG GLU 85 -23.743 0.895 -5.014 593 H ASP 86 H ASP 86 -26.058 -0.738 -4.008 594 HA ASP 86 HA ASP 86 -27.758 -1.429 -5.346 595 HB2 ASP 86 1HB ASP 86 -26.325 -0.108 -6.902 596 HB3 ASP 86 2HB ASP 86 -25.626 -1.612 -7.494 597 H GLY 87 H GLY 87 -26.516 -3.346 -3.748 598 HA2 GLY 87 1HA GLY 87 -27.807 -5.729 -4.542 599 HA3 GLY 87 2HA GLY 87 -26.115 -5.892 -4.985 600 H VAL 88 H VAL 88 -25.615 -4.057 -2.291 601 HA VAL 88 HA VAL 88 -25.794 -6.378 -0.463 602 HB VAL 88 HB VAL 88 -23.389 -5.328 0.178 603 HG11 VAL 88 1HG1 VAL 88 -23.822 -7.646 -0.174 604 HG12 VAL 88 2HG1 VAL 88 -23.998 -7.416 -1.932 605 HG13 VAL 88 3HG1 VAL 88 -22.413 -7.199 -1.146 606 HG21 VAL 88 3HG2 VAL 88 -22.048 -4.924 -1.828 607 HG22 VAL 88 1HG2 VAL 88 -23.461 -5.057 -2.866 608 HG23 VAL 88 2HG2 VAL 88 -23.335 -3.717 -1.693 609 H VAL 89 H VAL 89 -25.792 -6.042 1.682 610 HA VAL 89 HA VAL 89 -26.111 -3.261 2.659 611 HB VAL 89 HB VAL 89 -28.215 -4.306 2.883 612 HG11 VAL 89 1HG1 VAL 89 -27.011 -6.604 4.459 613 HG12 VAL 89 2HG1 VAL 89 -28.721 -6.319 4.093 614 HG13 VAL 89 3HG1 VAL 89 -27.604 -6.703 2.781 615 HG21 VAL 89 3HG2 VAL 89 -26.882 -4.403 5.621 616 HG22 VAL 89 1HG2 VAL 89 -27.357 -2.925 4.773 617 HG23 VAL 89 2HG2 VAL 89 -28.594 -4.090 5.258 618 H ASN 90 H ASN 90 -24.081 -2.821 3.119 619 HA ASN 90 HA ASN 90 -22.635 -4.350 5.168 620 HB2 ASN 90 1HB ASN 90 -21.482 -3.453 2.479 621 HB3 ASN 90 2HB ASN 90 -20.509 -4.020 3.827 622 HD21 ASN 90 1HD2 ASN 90 -22.511 -6.214 4.510 623 HD22 ASN 90 2HD2 ASN 90 -21.965 -7.469 3.436 624 H GLU 91 H GLU 91 -20.446 -2.733 5.389 625 HA GLU 91 HA GLU 91 -21.553 0.005 5.790 626 HB2 GLU 91 1HB GLU 91 -19.621 -1.702 7.381 627 HB3 GLU 91 2HB GLU 91 -19.348 0.038 7.291 628 HG2 GLU 91 1HG GLU 91 -21.865 0.241 7.928 629 HG3 GLU 91 2HG GLU 91 -21.697 -1.432 8.442 630 HA PRO 92 HA PRO 92 -18.287 1.282 3.048 631 HB2 PRO 92 1HB PRO 92 -17.941 3.904 3.691 632 HB3 PRO 92 2HB PRO 92 -19.508 3.326 3.049 633 HG2 PRO 92 1HG PRO 92 -18.696 3.687 5.958 634 HG3 PRO 92 2HG PRO 92 -20.155 4.350 5.140 635 HD2 PRO 92 1HD PRO 92 -20.194 2.004 6.570 636 HD3 PRO 92 2HD PRO 92 -21.185 2.231 5.108 637 H MET 93 H MET 93 -16.031 2.736 3.268 638 HA MET 93 HA MET 93 -14.599 1.717 5.589 639 HB2 MET 93 1HB MET 93 -13.035 0.472 4.440 640 HB3 MET 93 2HB MET 93 -14.575 -0.112 3.830 641 HG2 MET 93 1HG MET 93 -14.229 1.232 1.762 642 HG3 MET 93 2HG MET 93 -12.683 1.788 2.401 643 HE1 MET 93 3HE MET 93 -10.993 -0.209 3.507 644 HE2 MET 93 1HE MET 93 -12.103 -1.556 3.721 645 HE3 MET 93 2HE MET 93 -10.728 -1.744 2.630 646 H GLN 94 H GLN 94 -12.290 2.387 5.479 647 HA GLN 94 HA GLN 94 -11.723 4.926 4.060 648 HB2 GLN 94 1HB GLN 94 -11.594 4.343 7.063 649 HB3 GLN 94 2HB GLN 94 -10.654 5.638 6.301 650 HG2 GLN 94 1HG GLN 94 -12.602 6.798 5.588 651 HG3 GLN 94 2HG GLN 94 -13.689 5.478 6.102 652 HE21 GLN 94 1HE2 GLN 94 -14.555 7.592 7.267 653 HE22 GLN 94 2HE2 GLN 94 -13.886 7.967 8.849 654 H TRP 95 H TRP 95 -9.430 5.156 3.852 655 HA TRP 95 HA TRP 95 -7.777 2.884 4.808 656 HB2 TRP 95 1HB TRP 95 -7.516 4.334 2.153 657 HB3 TRP 95 2HB TRP 95 -6.272 3.338 2.861 658 HD1 TRP 95 HD TRP 95 -9.270 1.412 3.482 659 HE1 TRP 95 1HE TRP 95 -9.618 -0.412 1.751 660 HE3 TRP 95 3HE TRP 95 -5.709 2.795 0.155 661 HZ2 TRP 95 2HZ TRP 95 -8.416 -1.281 -0.689 662 HZ3 TRP 95 3HZ TRP 95 -5.095 1.232 -1.699 663 HH2 TRP 95 HH TRP 95 -6.502 -0.741 -2.191 664 H VAL 96 H VAL 96 -5.722 3.562 5.553 665 HA VAL 96 HA VAL 96 -5.065 6.420 5.339 666 HB VAL 96 HB VAL 96 -4.358 4.977 7.878 667 HG11 VAL 96 1HG1 VAL 96 -4.370 7.924 7.204 668 HG12 VAL 96 2HG1 VAL 96 -3.863 7.164 8.729 669 HG13 VAL 96 3HG1 VAL 96 -2.949 6.862 7.252 670 HG21 VAL 96 3HG2 VAL 96 -6.759 5.058 8.014 671 HG22 VAL 96 1HG2 VAL 96 -6.119 6.353 9.017 672 HG23 VAL 96 2HG2 VAL 96 -6.798 6.730 7.420 673 H VAL 97 H VAL 97 -2.875 6.640 4.610 674 HA VAL 97 HA VAL 97 -1.423 4.117 4.255 675 HB VAL 97 HB VAL 97 -1.939 5.736 1.801 676 HG11 VAL 97 1HG1 VAL 97 -1.587 3.744 0.568 677 HG12 VAL 97 2HG1 VAL 97 -0.325 3.851 1.802 678 HG13 VAL 97 3HG1 VAL 97 -1.686 2.756 2.049 679 HG21 VAL 97 3HG2 VAL 97 -4.236 5.512 2.382 680 HG22 VAL 97 1HG2 VAL 97 -3.866 4.406 1.058 681 HG23 VAL 97 2HG2 VAL 97 -4.018 3.782 2.715 682 H THR 98 H THR 98 0.831 4.682 4.453 683 HA THR 98 HA THR 98 1.452 7.576 4.595 684 HB THR 98 HB THR 98 1.784 5.632 6.920 685 HG1 THR 98 1HG THR 98 -0.359 6.003 6.727 686 HG21 THR 98 3HG2 THR 98 2.204 7.563 8.316 687 HG22 THR 98 1HG2 THR 98 2.009 8.660 6.953 688 HG23 THR 98 2HG2 THR 98 3.378 7.524 6.994 689 H VAL 99 H VAL 99 3.729 7.857 4.506 690 HA VAL 99 HA VAL 99 5.243 5.362 3.874 691 HB VAL 99 HB VAL 99 5.601 7.951 2.343 692 HG11 VAL 99 1HG1 VAL 99 6.971 5.238 2.267 693 HG12 VAL 99 2HG1 VAL 99 6.957 6.279 0.848 694 HG13 VAL 99 3HG1 VAL 99 7.674 6.836 2.357 695 HG21 VAL 99 3HG2 VAL 99 3.560 7.220 1.531 696 HG22 VAL 99 1HG2 VAL 99 4.649 6.376 0.435 697 HG23 VAL 99 2HG2 VAL 99 3.929 5.506 1.775 698 H TYR 100 H TYR 100 7.110 5.041 4.629 699 HA TYR 100 HA TYR 100 8.540 7.079 6.184 700 HB2 TYR 100 1HB TYR 100 8.323 4.078 6.639 701 HB3 TYR 100 2HB TYR 100 9.307 5.184 7.572 702 HD1 TYR 100 2HD TYR 100 8.226 6.812 9.141 703 HD2 TYR 100 1HD TYR 100 5.911 3.915 6.940 704 HE1 TYR 100 2HE TYR 100 6.228 7.391 10.493 705 HE2 TYR 100 1HE TYR 100 3.903 4.490 8.309 706 HH TYR 100 HH TYR 100 3.808 7.360 10.192 707 H LYS 101 H LYS 101 10.811 6.756 6.120 708 HA LYS 101 HA LYS 101 11.844 5.766 3.543 709 HB2 LYS 101 1HB LYS 101 11.377 8.319 4.205 710 HB3 LYS 101 2HB LYS 101 12.839 8.143 5.132 711 HG2 LYS 101 1HG LYS 101 13.918 8.766 3.272 712 HG3 LYS 101 2HG LYS 101 13.618 7.123 2.704 713 HD2 LYS 101 1HD LYS 101 11.769 7.795 1.373 714 HD3 LYS 101 2HD LYS 101 11.607 9.311 2.303 715 HE2 LYS 101 1HE LYS 101 13.678 10.164 1.371 716 HE3 LYS 101 2HE LYS 101 13.839 8.739 0.348 717 HZ1 LYS 101 3HZ LYS 101 12.862 10.737 -0.722 718 HZ2 LYS 101 1HZ LYS 101 11.518 10.599 0.196 719 HZ3 LYS 101 2HZ LYS 101 11.947 9.420 -0.899 720 H ASN 102 H ASN 102 14.443 6.612 4.327 721 HA ASN 102 HA ASN 102 15.664 4.653 5.987 722 HB2 ASN 102 1HB ASN 102 16.631 7.495 5.388 723 HB3 ASN 102 2HB ASN 102 17.596 6.107 5.877 724 HD21 ASN 102 1HD2 ASN 102 16.303 7.881 3.206 725 HD22 ASN 102 2HD2 ASN 102 16.816 6.780 1.957 726 H GLY 103 H GLY 103 13.791 4.945 7.751 727 HA2 GLY 103 1HA GLY 103 13.344 5.432 9.957 728 HA3 GLY 103 2HA GLY 103 14.998 6.051 10.074 729 H LYS 104 H LYS 104 11.920 7.077 8.544 730 HA LYS 104 HA LYS 104 11.103 8.902 10.286 731 HB2 LYS 104 1HB LYS 104 13.156 10.124 8.589 732 HB3 LYS 104 2HB LYS 104 11.589 10.882 8.274 733 HG2 LYS 104 1HG LYS 104 12.753 10.676 11.038 734 HG3 LYS 104 2HG LYS 104 12.888 12.064 9.964 735 HD2 LYS 104 1HD LYS 104 10.223 11.780 9.816 736 HD3 LYS 104 2HD LYS 104 10.444 11.020 11.388 737 HE2 LYS 104 1HE LYS 104 11.377 13.793 10.538 738 HE3 LYS 104 2HE LYS 104 9.901 13.447 11.439 739 HZ1 LYS 104 3HZ LYS 104 11.400 12.466 13.210 740 HZ2 LYS 104 1HZ LYS 104 11.496 14.097 13.006 741 HZ3 LYS 104 2HZ LYS 104 12.671 13.183 12.409 742 H GLU 105 H GLU 105 9.087 9.795 9.564 743 HA GLU 105 HA GLU 105 7.705 8.625 7.316 744 HB2 GLU 105 1HB GLU 105 6.897 9.552 9.633 745 HB3 GLU 105 2HB GLU 105 6.902 11.121 8.833 746 HG2 GLU 105 1HG GLU 105 5.223 10.346 7.231 747 HG3 GLU 105 2HG GLU 105 5.384 8.678 7.804 748 H ILE 106 H ILE 106 7.077 9.734 5.320 749 HA ILE 106 HA ILE 106 8.077 12.489 4.935 750 HB ILE 106 HB ILE 106 8.446 11.876 2.514 751 HG12 ILE 106 1HG1 ILE 106 8.717 8.981 3.414 752 HG13 ILE 106 2HG1 ILE 106 7.184 9.598 2.800 753 HG21 ILE 106 1HG2 ILE 106 10.230 12.164 4.355 754 HG22 ILE 106 2HG2 ILE 106 10.309 10.392 4.343 755 HG23 ILE 106 3HG2 ILE 106 10.708 11.319 2.877 756 HD11 ILE 106 3HD1 ILE 106 9.776 9.733 1.242 757 HD12 ILE 106 1HD1 ILE 106 8.491 8.538 1.010 758 HD13 ILE 106 2HD1 ILE 106 8.188 10.255 0.704 759 H GLU 107 H GLU 107 5.347 10.282 4.695 760 HA GLU 107 HA GLU 107 3.797 12.350 3.258 761 HB2 GLU 107 1HB GLU 107 4.972 10.655 1.669 762 HB3 GLU 107 2HB GLU 107 3.870 9.464 2.323 763 HG2 GLU 107 1HG GLU 107 2.662 10.097 0.492 764 HG3 GLU 107 2HG GLU 107 2.007 11.253 1.645 765 H LYS 108 H LYS 108 1.829 12.438 4.242 766 HA LYS 108 HA LYS 108 0.822 10.075 5.759 767 HB2 LYS 108 1HB LYS 108 2.049 11.593 7.284 768 HB3 LYS 108 2HB LYS 108 1.084 12.966 6.715 769 HG2 LYS 108 1HG LYS 108 -0.981 11.780 7.556 770 HG3 LYS 108 2HG LYS 108 0.072 10.517 8.219 771 HD2 LYS 108 1HD LYS 108 1.168 12.141 9.674 772 HD3 LYS 108 2HD LYS 108 0.261 13.478 8.957 773 HE2 LYS 108 1HE LYS 108 -0.970 11.135 10.466 774 HE3 LYS 108 2HE LYS 108 -0.639 12.722 11.174 775 HZ1 LYS 108 3HZ LYS 108 -2.968 12.390 10.387 776 HZ2 LYS 108 1HZ LYS 108 -2.436 12.360 8.858 777 HZ3 LYS 108 2HZ LYS 108 -2.235 13.719 9.755 778 H LYS 109 H LYS 109 -0.975 9.583 4.523 779 HA LYS 109 HA LYS 109 -3.047 11.670 4.641 780 HB2 LYS 109 1HB LYS 109 -3.788 11.473 2.360 781 HB3 LYS 109 2HB LYS 109 -2.139 12.083 2.406 782 HG2 LYS 109 1HG LYS 109 -1.234 10.145 1.479 783 HG3 LYS 109 2HG LYS 109 -2.585 9.116 1.999 784 HD2 LYS 109 1HD LYS 109 -4.060 10.380 0.386 785 HD3 LYS 109 2HD LYS 109 -2.608 11.172 -0.247 786 HE2 LYS 109 1HE LYS 109 -1.689 9.075 -0.996 787 HE3 LYS 109 2HE LYS 109 -2.882 8.145 -0.079 788 HZ1 LYS 109 3HZ LYS 109 -4.617 9.008 -1.546 789 HZ2 LYS 109 1HZ LYS 109 -3.507 8.275 -2.463 790 HZ3 LYS 109 2HZ LYS 109 -3.566 9.898 -2.379 791 H SER 110 H SER 110 -5.295 10.792 3.977 792 HA SER 110 HA SER 110 -5.618 7.926 4.215 793 HB2 SER 110 1HB SER 110 -7.780 8.908 5.445 794 HB3 SER 110 2HB SER 110 -6.276 8.526 6.315 795 HG SER 110 HG SER 110 -6.651 11.097 5.302 796 H LEU 111 H LEU 111 -8.020 7.458 3.609 797 HA LEU 111 HA LEU 111 -8.996 9.154 1.420 798 HB2 LEU 111 1HB LEU 111 -8.798 6.145 1.183 799 HB3 LEU 111 2HB LEU 111 -9.183 7.310 -0.087 800 HG LEU 111 HG LEU 111 -6.451 6.842 1.206 801 HD11 LEU 111 1HD1 LEU 111 -5.837 5.821 -0.888 802 HD12 LEU 111 2HD1 LEU 111 -7.445 6.131 -1.556 803 HD13 LEU 111 3HD1 LEU 111 -7.248 4.999 -0.199 804 HD21 LEU 111 3HD2 LEU 111 -7.317 9.140 -0.264 805 HD22 LEU 111 1HD2 LEU 111 -6.286 8.214 -1.336 806 HD23 LEU 111 2HD2 LEU 111 -5.679 8.708 0.271 807 H VAL 112 H VAL 112 -11.337 8.691 1.164 808 HA VAL 112 HA VAL 112 -12.534 7.019 3.273 809 HB VAL 112 HB VAL 112 -12.547 9.256 4.161 810 HG11 VAL 112 1HG1 VAL 112 -12.371 10.640 2.136 811 HG12 VAL 112 2HG1 VAL 112 -14.035 10.205 1.685 812 HG13 VAL 112 3HG1 VAL 112 -13.723 11.145 3.158 813 HG21 VAL 112 3HG2 VAL 112 -15.357 8.605 3.165 814 HG22 VAL 112 1HG2 VAL 112 -14.549 7.777 4.501 815 HG23 VAL 112 2HG2 VAL 112 -14.907 9.504 4.628 816 H PHE 113 H PHE 113 -14.308 5.884 2.560 817 HA PHE 113 HA PHE 113 -15.120 6.266 -0.245 818 HB2 PHE 113 1HB PHE 113 -14.554 3.646 1.180 819 HB3 PHE 113 2HB PHE 113 -15.100 3.835 -0.484 820 HD1 PHE 113 2HD PHE 113 -13.552 4.955 -2.178 821 HD2 PHE 113 1HD PHE 113 -12.208 3.871 1.771 822 HE1 PHE 113 2HE PHE 113 -11.199 5.206 -2.899 823 HE2 PHE 113 1HE PHE 113 -9.856 4.035 1.022 824 HZ PHE 113 HZ PHE 113 -9.355 4.731 -1.332 825 H ARG 114 H ARG 114 -17.312 5.115 -0.525 826 HA ARG 114 HA ARG 114 -19.014 5.481 1.856 827 HB2 ARG 114 1HB ARG 114 -18.976 7.186 -0.670 828 HB3 ARG 114 2HB ARG 114 -20.431 7.084 0.318 829 HG2 ARG 114 1HG ARG 114 -17.742 8.087 1.316 830 HG3 ARG 114 2HG ARG 114 -19.137 9.054 0.860 831 HD2 ARG 114 1HD ARG 114 -20.461 7.684 2.627 832 HD3 ARG 114 2HD ARG 114 -18.887 7.145 3.208 833 HE ARG 114 HE ARG 114 -18.273 9.374 3.720 834 HH11 ARG 114 1HH1 ARG 114 -21.811 8.908 3.343 835 HH12 ARG 114 2HH1 ARG 114 -22.160 10.504 3.898 836 HH21 ARG 114 1HH2 ARG 114 -18.825 11.412 4.445 837 HH22 ARG 114 2HH2 ARG 114 -20.458 12.011 4.456 838 H ASP 115 H ASP 115 -21.376 5.574 0.445 839 HA ASP 115 HA ASP 115 -21.602 3.188 -1.257 840 HB2 ASP 115 1HB ASP 115 -22.673 2.384 0.721 841 HB3 ASP 115 2HB ASP 115 -23.219 3.992 1.188 842 H GLY 116 H GLY 116 -22.282 4.063 -3.199 843 HA2 GLY 116 1HA GLY 116 -24.669 5.563 -3.165 844 HA3 GLY 116 2HA GLY 116 -23.361 6.694 -3.505 845 H LYS 117 H LYS 117 -21.853 4.557 -5.270 846 HA LYS 117 HA LYS 117 -23.320 2.917 -6.643 847 HB2 LYS 117 1HB LYS 117 -23.504 5.625 -7.859 848 HB3 LYS 117 2HB LYS 117 -22.824 4.461 -8.933 849 HG2 LYS 117 1HG LYS 117 -25.410 3.915 -7.405 850 HG3 LYS 117 2HG LYS 117 -25.347 4.733 -8.960 851 HD2 LYS 117 1HD LYS 117 -24.287 2.740 -9.989 852 HD3 LYS 117 2HD LYS 117 -24.306 1.910 -8.426 853 HE2 LYS 117 1HE LYS 117 -26.400 1.211 -8.719 854 HE3 LYS 117 2HE LYS 117 -26.971 2.870 -8.912 855 HZ1 LYS 117 3HZ LYS 117 -27.436 1.441 -10.818 856 HZ2 LYS 117 1HZ LYS 117 -25.836 1.217 -11.086 857 HZ3 LYS 117 2HZ LYS 117 -26.490 2.729 -11.252 858 H GLU 118 H GLU 118 -21.950 2.198 -8.703 859 HA GLU 118 HA GLU 118 -19.210 2.018 -8.087 860 HB2 GLU 118 1HB GLU 118 -18.936 1.227 -10.419 861 HB3 GLU 118 2HB GLU 118 -20.257 0.430 -9.578 862 HG2 GLU 118 1HG GLU 118 -21.900 1.876 -10.743 863 HG3 GLU 118 2HG GLU 118 -20.606 2.690 -11.593 864 H ILE 119 H ILE 119 -17.424 3.237 -8.615 865 HA ILE 119 HA ILE 119 -17.643 5.714 -10.167 866 HB ILE 119 HB ILE 119 -16.538 7.019 -8.431 867 HG12 ILE 119 1HG1 ILE 119 -16.839 6.226 -6.048 868 HG13 ILE 119 2HG1 ILE 119 -17.026 4.600 -6.668 869 HG21 ILE 119 1HG2 ILE 119 -19.232 5.901 -7.600 870 HG22 ILE 119 2HG2 ILE 119 -18.531 7.408 -7.059 871 HG23 ILE 119 3HG2 ILE 119 -18.945 7.198 -8.772 872 HD11 ILE 119 3HD1 ILE 119 -14.572 6.319 -7.191 873 HD12 ILE 119 1HD1 ILE 119 -14.715 5.189 -5.825 874 HD13 ILE 119 2HD1 ILE 119 -14.746 4.570 -7.479 875 H SER 120 H SER 120 -15.262 6.713 -10.022 876 HA SER 120 HA SER 120 -13.150 4.701 -10.192 877 HB2 SER 120 1HB SER 120 -12.596 5.341 -12.541 878 HB3 SER 120 2HB SER 120 -14.142 4.489 -12.413 879 HG SER 120 HG SER 120 -13.751 7.291 -12.539 880 H THR 121 H THR 121 -11.723 5.792 -8.806 881 HA THR 121 HA THR 121 -11.057 8.589 -9.503 882 HB THR 121 HB THR 121 -10.677 8.883 -6.971 883 HG1 THR 121 1HG THR 121 -12.340 7.664 -5.789 884 HG21 THR 121 3HG2 THR 121 -12.451 10.003 -8.341 885 HG22 THR 121 1HG2 THR 121 -12.914 9.748 -6.661 886 HG23 THR 121 2HG2 THR 121 -13.556 8.672 -7.932 887 H ASP 122 H ASP 122 -8.884 9.169 -8.974 888 HA ASP 122 HA ASP 122 -7.099 6.982 -9.672 889 HB2 ASP 122 1HB ASP 122 -6.499 9.944 -9.297 890 HB3 ASP 122 2HB ASP 122 -5.422 8.742 -10.001 891 H ASP 123 H ASP 123 -8.212 7.406 -6.864 892 HA ASP 123 HA ASP 123 -7.037 8.789 -5.026 893 HB2 ASP 123 1HB ASP 123 -8.708 6.470 -5.011 894 HB3 ASP 123 2HB ASP 123 -7.376 6.084 -3.951 895 H LEU 124 H LEU 124 -5.763 5.610 -5.881 896 HA LEU 124 HA LEU 124 -3.494 5.971 -3.973 897 HB2 LEU 124 1HB LEU 124 -4.416 3.565 -5.569 898 HB3 LEU 124 2HB LEU 124 -2.954 3.713 -4.618 899 HG LEU 124 HG LEU 124 -4.342 2.412 -3.388 900 HD11 LEU 124 1HD1 LEU 124 -4.392 3.741 -1.263 901 HD12 LEU 124 2HD1 LEU 124 -4.033 5.211 -2.190 902 HD13 LEU 124 3HD1 LEU 124 -2.867 3.879 -2.129 903 HD21 LEU 124 3HD2 LEU 124 -6.406 3.555 -4.451 904 HD22 LEU 124 1HD2 LEU 124 -6.310 4.614 -3.022 905 HD23 LEU 124 2HD2 LEU 124 -6.545 2.877 -2.819 906 H ASN 125 H ASN 125 -2.847 7.699 -5.056 907 HA ASN 125 HA ASN 125 -1.445 7.274 -7.673 908 HB2 ASN 125 1HB ASN 125 -1.694 9.763 -7.948 909 HB3 ASN 125 2HB ASN 125 -3.148 8.824 -8.095 910 HD21 ASN 125 1HD2 ASN 125 -1.315 10.695 -5.589 911 HD22 ASN 125 2HD2 ASN 125 -2.775 11.308 -4.798 912 H LEU 126 H LEU 126 0.143 6.289 -5.958 913 HA LEU 126 HA LEU 126 2.036 8.441 -5.132 914 HB2 LEU 126 1HB LEU 126 1.533 5.892 -3.593 915 HB3 LEU 126 2HB LEU 126 2.652 7.163 -3.186 916 HG LEU 126 HG LEU 126 -0.386 7.342 -3.160 917 HD11 LEU 126 1HD1 LEU 126 1.705 7.325 -0.947 918 HD12 LEU 126 2HD1 LEU 126 0.668 5.953 -1.411 919 HD13 LEU 126 3HD1 LEU 126 -0.065 7.409 -0.716 920 HD21 LEU 126 3HD2 LEU 126 1.085 9.595 -3.561 921 HD22 LEU 126 1HD2 LEU 126 1.064 9.524 -1.793 922 HD23 LEU 126 2HD2 LEU 126 -0.453 9.538 -2.702 923 H TYR 127 H TYR 127 3.595 8.273 -6.553 924 HA TYR 127 HA TYR 127 4.730 5.604 -7.166 925 HB2 TYR 127 1HB TYR 127 3.121 6.690 -8.928 926 HB3 TYR 127 2HB TYR 127 4.499 7.684 -9.323 927 HD1 TYR 127 2HD TYR 127 6.817 5.824 -9.232 928 HD2 TYR 127 1HD TYR 127 2.768 5.207 -10.621 929 HE1 TYR 127 2HE TYR 127 7.611 4.091 -10.801 930 HE2 TYR 127 1HE TYR 127 3.571 3.496 -12.209 931 HH TYR 127 HH TYR 127 6.006 1.844 -12.051 932 H TYR 128 H TYR 128 6.206 6.041 -5.575 933 HA TYR 128 HA TYR 128 8.166 8.212 -5.931 934 HB2 TYR 128 1HB TYR 128 7.947 5.780 -4.117 935 HB3 TYR 128 2HB TYR 128 9.343 6.818 -4.073 936 HD1 TYR 128 2HD TYR 128 7.807 9.528 -4.516 937 HD2 TYR 128 1HD TYR 128 7.088 6.169 -1.866 938 HE1 TYR 128 2HE TYR 128 6.762 11.047 -2.926 939 HE2 TYR 128 1HE TYR 128 5.987 7.798 -0.282 940 HH TYR 128 HH TYR 128 5.221 10.931 -0.807 941 H ASN 129 H ASN 129 9.919 8.047 -7.171 942 HA ASN 129 HA ASN 129 11.318 5.821 -7.877 943 HB2 ASN 129 1HB ASN 129 10.889 5.429 -10.175 944 HB3 ASN 129 2HB ASN 129 9.322 5.301 -9.429 945 HD21 ASN 129 1HD2 ASN 129 10.850 6.459 -12.119 946 HD22 ASN 129 2HD2 ASN 129 10.048 7.975 -12.381 Start of MODEL 20 1 H1 GLY 1 H GLY 1 40.574 -11.307 5.422 2 HA2 GLY 1 1HA GLY 1 40.931 -9.185 4.150 3 HA3 GLY 1 2HA GLY 1 41.153 -10.643 3.138 4 H ASP 2 H ASP 2 39.450 -7.656 3.366 5 HA ASP 2 HA ASP 2 36.881 -8.685 2.436 6 HB2 ASP 2 1HB ASP 2 37.157 -6.966 4.919 7 HB3 ASP 2 2HB ASP 2 35.892 -8.110 4.486 8 H ASP 3 H ASP 3 36.477 -7.239 0.743 9 HA ASP 3 HA ASP 3 37.518 -4.467 0.811 10 HB2 ASP 3 1HB ASP 3 39.378 -5.962 0.159 11 HB3 ASP 3 2HB ASP 3 38.381 -6.677 -1.107 12 H ASP 4 H ASP 4 35.160 -4.000 0.764 13 HA ASP 4 HA ASP 4 34.322 -3.588 -1.905 14 HB2 ASP 4 1HB ASP 4 32.485 -4.908 -2.213 15 HB3 ASP 4 2HB ASP 4 33.527 -6.055 -1.400 16 H GLU 5 H GLU 5 32.856 -1.829 -2.004 17 HA GLU 5 HA GLU 5 31.281 -1.047 0.329 18 HB2 GLU 5 1HB GLU 5 32.194 1.133 0.629 19 HB3 GLU 5 2HB GLU 5 33.447 -0.051 0.836 20 HG2 GLU 5 1HG GLU 5 34.730 1.268 -0.416 21 HG3 GLU 5 2HG GLU 5 33.892 0.584 -1.795 22 HA PRO 6 HA PRO 6 29.906 -0.049 -4.079 23 HB2 PRO 6 1HB PRO 6 27.497 -1.404 -4.218 24 HB3 PRO 6 2HB PRO 6 29.109 -1.996 -4.707 25 HG2 PRO 6 1HG PRO 6 27.633 -2.471 -2.100 26 HG3 PRO 6 2HG PRO 6 28.483 -3.665 -3.120 27 HD2 PRO 6 1HD PRO 6 29.630 -2.525 -0.900 28 HD3 PRO 6 2HD PRO 6 30.599 -2.945 -2.346 29 H GLY 7 H GLY 7 29.231 1.886 -4.137 30 HA2 GLY 7 1HA GLY 7 27.777 3.026 -1.976 31 HA3 GLY 7 2HA GLY 7 28.500 3.878 -3.342 32 H GLY 8 H GLY 8 27.124 4.707 -4.889 33 HA2 GLY 8 1HA GLY 8 25.467 4.665 -6.485 34 HA3 GLY 8 2HA GLY 8 24.723 3.252 -5.708 35 H LYS 9 H LYS 9 22.809 4.962 -6.241 36 HA LYS 9 HA LYS 9 22.495 6.703 -3.903 37 HB2 LYS 9 1HB LYS 9 21.759 7.324 -6.803 38 HB3 LYS 9 2HB LYS 9 21.256 8.233 -5.381 39 HG2 LYS 9 1HG LYS 9 23.072 9.489 -5.915 40 HG3 LYS 9 2HG LYS 9 23.851 8.337 -4.849 41 HD2 LYS 9 1HD LYS 9 24.518 7.006 -6.938 42 HD3 LYS 9 2HD LYS 9 23.866 8.345 -7.907 43 HE2 LYS 9 1HE LYS 9 25.446 9.906 -6.919 44 HE3 LYS 9 2HE LYS 9 25.933 8.719 -5.698 45 HZ1 LYS 9 3HZ LYS 9 26.866 7.364 -7.496 46 HZ2 LYS 9 1HZ LYS 9 27.584 8.789 -7.300 47 HZ3 LYS 9 2HZ LYS 9 26.552 8.567 -8.585 48 H GLY 10 H GLY 10 20.672 6.346 -2.915 49 HA2 GLY 10 1HA GLY 10 18.086 5.896 -3.841 50 HA3 GLY 10 2HA GLY 10 18.776 4.294 -3.520 51 H ALA 11 H ALA 11 17.345 3.999 -1.773 52 HA ALA 11 HA ALA 11 17.683 5.592 0.705 53 HB1 ALA 11 1HB ALA 11 15.972 6.690 -0.781 54 HB2 ALA 11 2HB ALA 11 15.039 5.179 -0.784 55 HB3 ALA 11 3HB ALA 11 15.266 6.092 0.723 56 H MET 12 H MET 12 15.415 4.569 2.027 57 HA MET 12 HA MET 12 15.037 1.785 1.451 58 HB2 MET 12 1HB MET 12 15.158 3.012 4.269 59 HB3 MET 12 2HB MET 12 14.308 1.523 3.878 60 HG2 MET 12 1HG MET 12 16.602 0.927 2.686 61 HG3 MET 12 2HG MET 12 17.205 2.114 3.817 62 HE1 MET 12 3HE MET 12 14.518 -0.592 3.764 63 HE2 MET 12 1HE MET 12 15.906 -1.660 3.490 64 HE3 MET 12 2HE MET 12 14.987 -1.741 5.011 65 H TYR 13 H TYR 13 12.908 1.261 2.149 66 HA TYR 13 HA TYR 13 10.938 3.457 2.248 67 HB2 TYR 13 1HB TYR 13 11.205 1.425 -0.006 68 HB3 TYR 13 2HB TYR 13 9.678 2.189 0.391 69 HD1 TYR 13 2HD TYR 13 9.887 4.870 0.809 70 HD2 TYR 13 1HD TYR 13 12.243 2.464 -1.905 71 HE1 TYR 13 2HE TYR 13 10.358 6.867 -0.559 72 HE2 TYR 13 1HE TYR 13 12.642 4.490 -3.334 73 HH TYR 13 HH TYR 13 12.536 7.480 -2.327 74 H GLU 14 H GLU 14 9.027 2.919 3.190 75 HA GLU 14 HA GLU 14 8.251 0.162 3.659 76 HB2 GLU 14 1HB GLU 14 9.712 0.519 5.523 77 HB3 GLU 14 2HB GLU 14 9.062 2.111 5.848 78 HG2 GLU 14 1HG GLU 14 6.881 1.079 6.517 79 HG3 GLU 14 2HG GLU 14 7.587 -0.523 6.227 80 H VAL 15 H VAL 15 6.030 0.110 3.801 81 HA VAL 15 HA VAL 15 4.386 2.611 4.116 82 HB VAL 15 HB VAL 15 4.623 2.142 1.704 83 HG11 VAL 15 1HG1 VAL 15 5.045 -0.396 1.894 84 HG12 VAL 15 2HG1 VAL 15 3.305 -0.571 2.073 85 HG13 VAL 15 3HG1 VAL 15 3.973 0.152 0.599 86 HG21 VAL 15 3HG2 VAL 15 1.841 1.309 2.586 87 HG22 VAL 15 1HG2 VAL 15 2.442 2.976 2.532 88 HG23 VAL 15 2HG2 VAL 15 2.322 2.040 1.040 89 H THR 16 H THR 16 2.432 2.299 5.214 90 HA THR 16 HA THR 16 1.879 -0.484 6.138 91 HB THR 16 HB THR 16 0.500 0.855 7.935 92 HG1 THR 16 1HG THR 16 1.127 2.944 7.180 93 HG21 THR 16 3HG2 THR 16 2.445 0.721 9.474 94 HG22 THR 16 1HG2 THR 16 3.521 0.476 8.082 95 HG23 THR 16 2HG2 THR 16 2.257 -0.721 8.472 96 H ILE 17 H ILE 17 0.098 -1.319 5.461 97 HA ILE 17 HA ILE 17 -1.990 0.445 4.350 98 HB ILE 17 HB ILE 17 -1.060 -1.338 2.819 99 HG12 ILE 17 1HG1 ILE 17 -3.186 -2.173 1.979 100 HG13 ILE 17 2HG1 ILE 17 -3.959 -1.982 3.546 101 HG21 ILE 17 1HG2 ILE 17 -0.546 -3.177 4.256 102 HG22 ILE 17 2HG2 ILE 17 -2.241 -3.324 4.796 103 HG23 ILE 17 3HG2 ILE 17 -1.817 -3.708 3.147 104 HD11 ILE 17 3HD1 ILE 17 -3.036 0.291 1.741 105 HD12 ILE 17 1HD1 ILE 17 -4.700 -0.306 1.973 106 HD13 ILE 17 2HD1 ILE 17 -3.881 0.480 3.304 107 H GLU 18 H GLU 18 -4.055 0.121 5.292 108 HA GLU 18 HA GLU 18 -4.511 -1.847 7.320 109 HB2 GLU 18 1HB GLU 18 -5.471 0.308 8.602 110 HB3 GLU 18 2HB GLU 18 -3.810 -0.339 8.798 111 HG2 GLU 18 1HG GLU 18 -3.998 1.948 8.671 112 HG3 GLU 18 2HG GLU 18 -3.009 1.426 7.322 113 H GLN 19 H GLN 19 -6.967 -1.129 8.014 114 HA GLN 19 HA GLN 19 -8.406 -0.004 5.779 115 HB2 GLN 19 1HB GLN 19 -8.602 -2.948 6.647 116 HB3 GLN 19 2HB GLN 19 -10.081 -2.148 6.190 117 HG2 GLN 19 1HG GLN 19 -9.669 -2.274 4.005 118 HG3 GLN 19 2HG GLN 19 -8.033 -1.721 4.126 119 HE21 GLN 19 1HE2 GLN 19 -6.288 -3.363 4.597 120 HE22 GLN 19 2HE2 GLN 19 -6.688 -5.040 4.090 121 H SER 20 H SER 20 -10.777 0.298 6.460 122 HA SER 20 HA SER 20 -11.296 0.043 9.284 123 HB2 SER 20 1HB SER 20 -11.929 2.687 7.918 124 HB3 SER 20 2HB SER 20 -11.919 2.348 9.652 125 HG SER 20 HG SER 20 -9.679 2.519 7.898 126 H GLY 21 H GLY 21 -13.622 0.393 9.774 127 HA2 GLY 21 1HA GLY 21 -15.844 0.066 9.342 128 HA3 GLY 21 2HA GLY 21 -15.574 0.762 7.737 129 H ASP 22 H ASP 22 -16.717 -0.776 6.510 130 HA ASP 22 HA ASP 22 -16.362 -3.649 6.989 131 HB2 ASP 22 1HB ASP 22 -18.557 -2.677 6.272 132 HB3 ASP 22 2HB ASP 22 -17.834 -2.370 4.678 133 H PHE 23 H PHE 23 -14.547 -4.547 6.290 134 HA PHE 23 HA PHE 23 -13.468 -3.783 3.625 135 HB2 PHE 23 1HB PHE 23 -11.294 -4.396 4.362 136 HB3 PHE 23 2HB PHE 23 -11.941 -3.084 5.316 137 HD1 PHE 23 1HD PHE 23 -10.968 -6.689 5.431 138 HD2 PHE 23 2HD PHE 23 -12.180 -3.219 7.686 139 HE1 PHE 23 1HE PHE 23 -10.298 -7.814 7.501 140 HE2 PHE 23 2HE PHE 23 -11.626 -4.416 9.803 141 HZ PHE 23 HZ PHE 23 -10.690 -6.688 9.732 142 H ARG 24 H ARG 24 -15.677 -5.464 4.098 143 HA ARG 24 HA ARG 24 -14.621 -8.204 3.627 144 HB2 ARG 24 1HB ARG 24 -16.932 -7.123 5.277 145 HB3 ARG 24 2HB ARG 24 -16.707 -8.826 4.964 146 HG2 ARG 24 1HG ARG 24 -14.654 -8.901 6.217 147 HG3 ARG 24 2HG ARG 24 -14.555 -7.141 6.320 148 HD2 ARG 24 1HD ARG 24 -16.552 -7.034 7.691 149 HD3 ARG 24 2HD ARG 24 -16.753 -8.783 7.614 150 HE ARG 24 HE ARG 24 -14.426 -8.899 8.680 151 HH11 ARG 24 1HH1 ARG 24 -16.523 -6.098 9.359 152 HH12 ARG 24 2HH1 ARG 24 -16.042 -5.976 11.014 153 HH21 ARG 24 1HH2 ARG 24 -13.668 -8.597 10.795 154 HH22 ARG 24 2HH2 ARG 24 -14.150 -7.171 11.695 155 H SER 25 H SER 25 -16.214 -5.631 2.162 156 HA SER 25 HA SER 25 -17.242 -7.386 0.032 157 HB2 SER 25 1HB SER 25 -18.937 -6.492 1.977 158 HB3 SER 25 2HB SER 25 -19.040 -5.147 0.852 159 HG SER 25 HG SER 25 -19.576 -6.689 -0.792 160 H PHE 26 H PHE 26 -14.919 -5.508 0.180 161 HA PHE 26 HA PHE 26 -15.685 -3.809 -2.133 162 HB2 PHE 26 1HB PHE 26 -13.719 -3.021 0.065 163 HB3 PHE 26 2HB PHE 26 -13.866 -2.250 -1.485 164 HD1 PHE 26 1HD PHE 26 -15.917 -3.083 1.564 165 HD2 PHE 26 2HD PHE 26 -15.231 -0.349 -1.708 166 HE1 PHE 26 1HE PHE 26 -17.632 -1.576 2.462 167 HE2 PHE 26 2HE PHE 26 -16.937 1.184 -0.766 168 HZ PHE 26 HZ PHE 26 -18.184 0.545 1.292 169 H ILE 27 H ILE 27 -14.677 -4.678 -3.891 170 HA ILE 27 HA ILE 27 -12.524 -6.601 -3.640 171 HB ILE 27 HB ILE 27 -13.505 -5.072 -6.085 172 HG12 ILE 27 1HG1 ILE 27 -15.355 -6.329 -5.289 173 HG13 ILE 27 2HG1 ILE 27 -14.712 -7.125 -6.712 174 HG21 ILE 27 1HG2 ILE 27 -11.283 -5.916 -6.525 175 HG22 ILE 27 2HG2 ILE 27 -11.695 -7.511 -5.882 176 HG23 ILE 27 3HG2 ILE 27 -12.441 -6.916 -7.393 177 HD11 ILE 27 3HD1 ILE 27 -15.304 -8.797 -5.066 178 HD12 ILE 27 1HD1 ILE 27 -13.537 -8.775 -5.217 179 HD13 ILE 27 2HD1 ILE 27 -14.321 -7.998 -3.827 180 H LYS 28 H LYS 28 -10.413 -6.144 -3.324 181 HA LYS 28 HA LYS 28 -9.469 -3.344 -3.468 182 HB2 LYS 28 1HB LYS 28 -7.745 -5.687 -2.674 183 HB3 LYS 28 2HB LYS 28 -7.634 -4.027 -2.134 184 HG2 LYS 28 1HG LYS 28 -9.758 -6.021 -1.303 185 HG3 LYS 28 2HG LYS 28 -8.280 -5.676 -0.427 186 HD2 LYS 28 1HD LYS 28 -9.237 -3.239 -0.309 187 HD3 LYS 28 2HD LYS 28 -10.779 -4.011 -0.693 188 HE2 LYS 28 1HE LYS 28 -8.864 -4.707 1.580 189 HE3 LYS 28 2HE LYS 28 -10.428 -3.922 1.774 190 HZ1 LYS 28 3HZ LYS 28 -11.511 -5.889 1.420 191 HZ2 LYS 28 1HZ LYS 28 -10.223 -6.375 2.270 192 HZ3 LYS 28 2HZ LYS 28 -10.321 -6.655 0.629 193 H SER 29 H SER 29 -7.413 -2.840 -4.539 194 HA SER 29 HA SER 29 -5.943 -4.891 -5.861 195 HB2 SER 29 1HB SER 29 -7.421 -2.729 -7.383 196 HB3 SER 29 2HB SER 29 -5.785 -3.166 -7.871 197 HG SER 29 HG SER 29 -8.014 -4.441 -8.451 198 H VAL 30 H VAL 30 -3.764 -4.332 -5.579 199 HA VAL 30 HA VAL 30 -3.044 -1.499 -5.328 200 HB VAL 30 HB VAL 30 -2.136 -3.624 -3.329 201 HG11 VAL 30 1HG1 VAL 30 -0.277 -2.132 -3.701 202 HG12 VAL 30 2HG1 VAL 30 -1.316 -0.707 -3.691 203 HG13 VAL 30 3HG1 VAL 30 -1.036 -1.614 -2.197 204 HG21 VAL 30 3HG2 VAL 30 -4.419 -2.762 -2.793 205 HG22 VAL 30 1HG2 VAL 30 -3.212 -2.282 -1.595 206 HG23 VAL 30 2HG2 VAL 30 -3.784 -1.122 -2.798 207 H VAL 31 H VAL 31 -0.982 -1.114 -6.192 208 HA VAL 31 HA VAL 31 0.562 -3.367 -7.345 209 HB VAL 31 HB VAL 31 0.290 -0.456 -8.253 210 HG11 VAL 31 1HG1 VAL 31 1.661 -1.067 -10.176 211 HG12 VAL 31 2HG1 VAL 31 2.540 -1.395 -8.697 212 HG13 VAL 31 3HG1 VAL 31 1.816 -2.733 -9.586 213 HG21 VAL 31 3HG2 VAL 31 -1.765 -1.612 -8.853 214 HG22 VAL 31 1HG2 VAL 31 -0.811 -1.222 -10.281 215 HG23 VAL 31 2HG2 VAL 31 -0.852 -2.882 -9.673 216 H VAL 32 H VAL 32 2.565 -3.522 -6.309 217 HA VAL 32 HA VAL 32 3.704 -1.040 -5.136 218 HB VAL 32 HB VAL 32 3.094 -2.676 -3.405 219 HG11 VAL 32 1HG1 VAL 32 3.500 -4.740 -4.625 220 HG12 VAL 32 2HG1 VAL 32 5.248 -4.396 -4.701 221 HG13 VAL 32 3HG1 VAL 32 4.453 -4.709 -3.147 222 HG21 VAL 32 3HG2 VAL 32 6.112 -2.296 -3.628 223 HG22 VAL 32 1HG2 VAL 32 4.963 -1.042 -3.110 224 HG23 VAL 32 2HG2 VAL 32 5.146 -2.522 -2.158 225 H VAL 33 H VAL 33 5.909 -0.646 -5.596 226 HA VAL 33 HA VAL 33 7.307 -2.497 -7.413 227 HB VAL 33 HB VAL 33 7.216 0.548 -7.672 228 HG11 VAL 33 1HG1 VAL 33 8.575 0.202 -9.704 229 HG12 VAL 33 2HG1 VAL 33 9.431 -0.383 -8.294 230 HG13 VAL 33 3HG1 VAL 33 8.639 -1.545 -9.400 231 HG21 VAL 33 3HG2 VAL 33 6.072 -1.573 -9.560 232 HG22 VAL 33 1HG2 VAL 33 5.130 -0.428 -8.579 233 HG23 VAL 33 2HG2 VAL 33 6.156 0.168 -9.880 234 H ALA 34 H ALA 34 9.606 -2.509 -6.907 235 HA ALA 34 HA ALA 34 10.623 -0.711 -4.880 236 HB1 ALA 34 1HB ALA 34 10.594 -3.712 -4.333 237 HB2 ALA 34 2HB ALA 34 11.450 -2.479 -3.393 238 HB3 ALA 34 3HB ALA 34 9.678 -2.476 -3.438 239 H ASN 35 H ASN 35 11.982 -0.007 -6.524 240 HA ASN 35 HA ASN 35 13.616 -1.788 -8.151 241 HB2 ASN 35 1HB ASN 35 13.120 0.574 -8.786 242 HB3 ASN 35 2HB ASN 35 13.996 1.141 -7.380 243 HD21 ASN 35 1HD2 ASN 35 14.495 1.794 -10.165 244 HD22 ASN 35 2HD2 ASN 35 16.116 1.256 -10.568 245 H GLY 36 H GLY 36 15.328 -2.958 -7.377 246 HA2 GLY 36 1HA GLY 36 17.592 -2.507 -6.928 247 HA3 GLY 36 2HA GLY 36 17.163 -1.418 -5.617 248 H THR 37 H THR 37 15.155 -3.830 -4.878 249 HA THR 37 HA THR 37 16.889 -5.868 -3.840 250 HB THR 37 HB THR 37 17.311 -3.825 -2.409 251 HG1 THR 37 1HG THR 37 16.389 -6.001 -0.874 252 HG21 THR 37 3HG2 THR 37 14.878 -3.145 -2.357 253 HG22 THR 37 1HG2 THR 37 15.738 -3.075 -0.822 254 HG23 THR 37 2HG2 THR 37 14.630 -4.416 -1.151 255 H GLN 38 H GLN 38 15.089 -6.971 -1.963 256 HA GLN 38 HA GLN 38 12.550 -7.207 -3.474 257 HB2 GLN 38 1HB GLN 38 14.083 -8.993 -1.548 258 HB3 GLN 38 2HB GLN 38 12.355 -9.179 -1.781 259 HG2 GLN 38 1HG GLN 38 13.270 -10.641 -3.333 260 HG3 GLN 38 2HG GLN 38 12.752 -9.246 -4.272 261 HE21 GLN 38 1HE2 GLN 38 14.158 -10.205 -5.969 262 HE22 GLN 38 2HE2 GLN 38 15.867 -9.916 -5.894 263 H LEU 39 H LEU 39 10.614 -7.507 -2.175 264 HA LEU 39 HA LEU 39 10.335 -5.431 -0.121 265 HB2 LEU 39 1HB LEU 39 8.615 -6.506 -2.050 266 HB3 LEU 39 2HB LEU 39 8.121 -7.348 -0.600 267 HG LEU 39 HG LEU 39 7.875 -5.157 0.533 268 HD11 LEU 39 1HD1 LEU 39 8.257 -4.045 -2.290 269 HD12 LEU 39 2HD1 LEU 39 9.295 -3.714 -0.881 270 HD13 LEU 39 3HD1 LEU 39 7.626 -3.136 -0.902 271 HD21 LEU 39 3HD2 LEU 39 6.225 -5.702 -1.968 272 HD22 LEU 39 1HD2 LEU 39 5.762 -4.530 -0.723 273 HD23 LEU 39 2HD2 LEU 39 5.885 -6.242 -0.309 274 H LYS 40 H LYS 40 9.260 -6.076 1.907 275 HA LYS 40 HA LYS 40 9.689 -8.887 2.742 276 HB2 LYS 40 1HB LYS 40 11.600 -7.527 3.572 277 HB3 LYS 40 2HB LYS 40 10.466 -6.434 4.386 278 HG2 LYS 40 1HG LYS 40 9.652 -8.236 5.788 279 HG3 LYS 40 2HG LYS 40 10.599 -9.441 4.897 280 HD2 LYS 40 1HD LYS 40 12.672 -8.637 5.777 281 HD3 LYS 40 2HD LYS 40 11.925 -7.133 6.380 282 HE2 LYS 40 1HE LYS 40 10.424 -8.491 7.831 283 HE3 LYS 40 2HE LYS 40 11.265 -9.960 7.286 284 HZ1 LYS 40 3HZ LYS 40 12.592 -7.763 8.738 285 HZ2 LYS 40 1HZ LYS 40 13.205 -9.262 8.389 286 HZ3 LYS 40 2HZ LYS 40 11.951 -9.101 9.453 287 H ASP 41 H ASP 41 7.845 -9.665 3.670 288 HA ASP 41 HA ASP 41 5.596 -7.813 4.042 289 HB2 ASP 41 1HB ASP 41 5.425 -10.213 3.040 290 HB3 ASP 41 2HB ASP 41 5.467 -10.757 4.712 291 H GLY 42 H GLY 42 4.931 -7.021 6.038 292 HA2 GLY 42 1HA GLY 42 6.599 -7.373 8.328 293 HA3 GLY 42 2HA GLY 42 5.026 -6.570 8.267 294 H ALA 43 H ALA 43 3.819 -9.218 7.128 295 HA ALA 43 HA ALA 43 2.674 -10.129 9.510 296 HB1 ALA 43 1HB ALA 43 1.646 -10.432 7.303 297 HB2 ALA 43 2HB ALA 43 2.936 -11.545 6.820 298 HB3 ALA 43 3HB ALA 43 1.821 -11.998 8.119 299 H THR 44 H THR 44 5.069 -11.976 7.509 300 HA THR 44 HA THR 44 6.045 -13.261 10.016 301 HB THR 44 HB THR 44 6.363 -15.321 8.382 302 HG1 THR 44 1HG THR 44 5.158 -15.348 6.680 303 HG21 THR 44 3HG2 THR 44 5.048 -15.298 10.452 304 HG22 THR 44 1HG2 THR 44 4.160 -16.137 9.169 305 HG23 THR 44 2HG2 THR 44 3.706 -14.482 9.621 306 H GLY 45 H GLY 45 6.934 -11.012 7.923 307 HA2 GLY 45 1HA GLY 45 8.944 -10.103 7.606 308 HA3 GLY 45 2HA GLY 45 9.709 -11.404 8.542 309 H GLU 46 H GLU 46 7.633 -12.069 5.741 310 HA GLU 46 HA GLU 46 9.695 -13.804 4.668 311 HB2 GLU 46 1HB GLU 46 6.922 -13.079 3.596 312 HB3 GLU 46 2HB GLU 46 7.980 -14.375 2.993 313 HG2 GLU 46 1HG GLU 46 7.989 -15.317 5.363 314 HG3 GLU 46 2HG GLU 46 6.786 -14.105 5.762 315 H SER 47 H SER 47 11.202 -13.232 3.204 316 HA SER 47 HA SER 47 11.181 -10.685 1.818 317 HB2 SER 47 1HB SER 47 12.674 -13.217 1.083 318 HB3 SER 47 2HB SER 47 13.064 -11.560 0.594 319 HG SER 47 HG SER 47 13.155 -12.689 3.205 320 H LEU 48 H LEU 48 10.136 -10.251 0.028 321 HA LEU 48 HA LEU 48 8.573 -12.348 -1.439 322 HB2 LEU 48 1HB LEU 48 8.094 -9.357 -1.414 323 HB3 LEU 48 2HB LEU 48 7.019 -10.616 -2.015 324 HG LEU 48 HG LEU 48 7.679 -10.041 0.902 325 HD11 LEU 48 1HD1 LEU 48 5.110 -9.836 -0.711 326 HD12 LEU 48 2HD1 LEU 48 6.164 -8.485 -0.258 327 HD13 LEU 48 3HD1 LEU 48 5.339 -9.390 1.001 328 HD21 LEU 48 3HD2 LEU 48 7.440 -12.428 0.782 329 HD22 LEU 48 1HD2 LEU 48 6.155 -12.311 -0.425 330 HD23 LEU 48 2HD2 LEU 48 5.854 -11.841 1.276 331 H ALA 49 H ALA 49 8.046 -10.891 -3.709 332 HA ALA 49 HA ALA 49 10.691 -9.990 -4.760 333 HB1 ALA 49 1HB ALA 49 10.343 -11.321 -6.798 334 HB2 ALA 49 2HB ALA 49 10.663 -12.308 -5.357 335 HB3 ALA 49 3HB ALA 49 9.009 -12.191 -5.988 336 H SER 50 H SER 50 10.182 -7.872 -5.182 337 HA SER 50 HA SER 50 7.533 -7.161 -6.161 338 HB2 SER 50 1HB SER 50 9.970 -5.710 -5.138 339 HB3 SER 50 2HB SER 50 8.782 -4.817 -6.091 340 HG SER 50 HG SER 50 8.005 -6.469 -3.948 341 HA PRO 51 HA PRO 51 7.013 -4.902 -7.308 342 HB2 PRO 51 1HB PRO 51 5.526 -4.589 -9.580 343 HB3 PRO 51 2HB PRO 51 7.002 -3.643 -9.234 344 HG2 PRO 51 1HG PRO 51 6.730 -6.050 -11.004 345 HG3 PRO 51 2HG PRO 51 7.609 -4.528 -11.325 346 HD2 PRO 51 1HD PRO 51 8.877 -6.794 -10.430 347 HD3 PRO 51 2HD PRO 51 9.410 -5.157 -9.957 348 H VAL 52 H VAL 52 4.781 -5.419 -6.755 349 HA VAL 52 HA VAL 52 3.879 -8.145 -7.445 350 HB VAL 52 HB VAL 52 3.690 -7.076 -4.589 351 HG11 VAL 52 1HG1 VAL 52 1.953 -8.729 -5.054 352 HG12 VAL 52 2HG1 VAL 52 3.134 -9.831 -5.792 353 HG13 VAL 52 3HG1 VAL 52 3.166 -9.487 -4.054 354 HG21 VAL 52 3HG2 VAL 52 5.999 -7.510 -4.857 355 HG22 VAL 52 1HG2 VAL 52 5.336 -8.901 -4.007 356 HG23 VAL 52 2HG2 VAL 52 5.654 -9.035 -5.751 357 H ILE 53 H ILE 53 1.675 -8.386 -7.373 358 HA ILE 53 HA ILE 53 0.066 -5.900 -7.069 359 HB ILE 53 HB ILE 53 -0.515 -8.324 -8.822 360 HG12 ILE 53 1HG1 ILE 53 1.217 -7.224 -9.987 361 HG13 ILE 53 2HG1 ILE 53 -0.268 -6.633 -10.696 362 HG21 ILE 53 1HG2 ILE 53 -2.549 -7.280 -7.969 363 HG22 ILE 53 2HG2 ILE 53 -1.991 -5.673 -8.491 364 HG23 ILE 53 3HG2 ILE 53 -2.366 -6.948 -9.673 365 HD11 ILE 53 3HD1 ILE 53 0.088 -4.674 -8.885 366 HD12 ILE 53 1HD1 ILE 53 1.781 -5.160 -9.164 367 HD13 ILE 53 2HD1 ILE 53 0.769 -4.630 -10.507 368 H LEU 54 H LEU 54 -1.496 -5.982 -5.617 369 HA LEU 54 HA LEU 54 -2.134 -8.595 -4.332 370 HB2 LEU 54 1HB LEU 54 -1.545 -5.921 -3.205 371 HB3 LEU 54 2HB LEU 54 -3.099 -6.534 -2.695 372 HG LEU 54 HG LEU 54 -2.261 -8.182 -1.398 373 HD11 LEU 54 1HD1 LEU 54 0.262 -8.306 -3.084 374 HD12 LEU 54 2HD1 LEU 54 -0.986 -9.565 -2.889 375 HD13 LEU 54 3HD1 LEU 54 0.054 -9.161 -1.537 376 HD21 LEU 54 3HD2 LEU 54 -0.438 -7.331 -0.082 377 HD22 LEU 54 1HD2 LEU 54 -1.532 -6.023 -0.562 378 HD23 LEU 54 2HD2 LEU 54 0.015 -6.222 -1.395 379 H SER 55 H SER 55 -4.237 -8.991 -3.869 380 HA SER 55 HA SER 55 -6.349 -7.510 -5.295 381 HB2 SER 55 1HB SER 55 -7.136 -10.117 -5.454 382 HB3 SER 55 2HB SER 55 -6.333 -9.254 -6.732 383 HG SER 55 HG SER 55 -4.409 -10.243 -6.160 384 H ASP 56 H ASP 56 -8.463 -8.848 -4.445 385 HA ASP 56 HA ASP 56 -8.745 -7.722 -1.845 386 HB2 ASP 56 1HB ASP 56 -10.598 -7.978 -3.485 387 HB3 ASP 56 2HB ASP 56 -10.568 -9.721 -3.223 388 H GLU 57 H GLU 57 -8.258 -11.092 -2.816 389 HA GLU 57 HA GLU 57 -8.740 -12.293 -0.241 390 HB2 GLU 57 1HB GLU 57 -7.223 -13.069 -2.765 391 HB3 GLU 57 2HB GLU 57 -7.194 -14.097 -1.333 392 HG2 GLU 57 1HG GLU 57 -9.617 -14.346 -1.365 393 HG3 GLU 57 2HG GLU 57 -9.733 -13.267 -2.776 394 H GLU 58 H GLU 58 -6.009 -10.669 -1.759 395 HA GLU 58 HA GLU 58 -4.099 -11.826 0.099 396 HB2 GLU 58 1HB GLU 58 -3.718 -9.598 -1.913 397 HB3 GLU 58 2HB GLU 58 -2.447 -10.579 -1.153 398 HG2 GLU 58 1HG GLU 58 -4.492 -11.330 -3.237 399 HG3 GLU 58 2HG GLU 58 -2.747 -11.281 -3.439 400 H LEU 59 H LEU 59 -6.214 -9.115 0.052 401 HA LEU 59 HA LEU 59 -4.572 -7.544 1.973 402 HB2 LEU 59 1HB LEU 59 -6.389 -6.899 -0.307 403 HB3 LEU 59 2HB LEU 59 -6.376 -5.752 1.020 404 HG LEU 59 HG LEU 59 -3.822 -6.694 -0.305 405 HD11 LEU 59 1HD1 LEU 59 -5.452 -4.186 -0.897 406 HD12 LEU 59 2HD1 LEU 59 -5.296 -5.606 -1.966 407 HD13 LEU 59 3HD1 LEU 59 -3.871 -4.637 -1.587 408 HD21 LEU 59 3HD2 LEU 59 -4.498 -4.303 1.481 409 HD22 LEU 59 1HD2 LEU 59 -2.935 -4.548 0.673 410 HD23 LEU 59 2HD2 LEU 59 -3.470 -5.681 1.914 411 H ALA 60 H ALA 60 -6.994 -9.626 2.269 412 HA ALA 60 HA ALA 60 -9.039 -8.362 3.742 413 HB1 ALA 60 1HB ALA 60 -9.695 -10.681 4.228 414 HB2 ALA 60 2HB ALA 60 -9.188 -10.518 2.539 415 HB3 ALA 60 3HB ALA 60 -8.092 -11.258 3.728 416 H VAL 61 H VAL 61 -6.604 -7.476 4.886 417 HA VAL 61 HA VAL 61 -6.410 -8.692 7.605 418 HB VAL 61 HB VAL 61 -4.249 -7.446 7.700 419 HG11 VAL 61 1HG1 VAL 61 -4.382 -9.818 6.980 420 HG12 VAL 61 2HG1 VAL 61 -4.434 -9.293 5.289 421 HG13 VAL 61 3HG1 VAL 61 -3.002 -8.953 6.302 422 HG21 VAL 61 3HG2 VAL 61 -4.642 -6.822 4.746 423 HG22 VAL 61 1HG2 VAL 61 -4.788 -5.631 6.057 424 HG23 VAL 61 2HG2 VAL 61 -3.248 -6.429 5.733 425 H GLU 62 H GLU 62 -5.788 -6.827 9.326 426 HA GLU 62 HA GLU 62 -7.563 -4.484 8.817 427 HB2 GLU 62 1HB GLU 62 -7.415 -3.931 11.127 428 HB3 GLU 62 2HB GLU 62 -8.145 -5.516 10.887 429 HG2 GLU 62 1HG GLU 62 -6.250 -6.646 11.721 430 HG3 GLU 62 2HG GLU 62 -5.204 -5.229 11.574 431 H LYS 63 H LYS 63 -4.112 -5.429 9.459 432 HA LYS 63 HA LYS 63 -3.239 -2.909 8.233 433 HB2 LYS 63 1HB LYS 63 -3.519 -2.331 10.580 434 HB3 LYS 63 2HB LYS 63 -2.529 -3.725 11.063 435 HG2 LYS 63 1HG LYS 63 -0.592 -2.798 9.893 436 HG3 LYS 63 2HG LYS 63 -1.569 -1.460 9.243 437 HD2 LYS 63 1HD LYS 63 -1.817 -0.427 11.295 438 HD3 LYS 63 2HD LYS 63 -1.324 -1.899 12.203 439 HE2 LYS 63 1HE LYS 63 0.951 -1.769 11.357 440 HE3 LYS 63 2HE LYS 63 0.515 -0.499 10.205 441 HZ1 LYS 63 3HZ LYS 63 1.752 0.214 12.156 442 HZ2 LYS 63 1HZ LYS 63 0.461 -0.083 13.123 443 HZ3 LYS 63 2HZ LYS 63 0.380 1.064 11.905 444 H VAL 64 H VAL 64 -1.315 -3.343 7.013 445 HA VAL 64 HA VAL 64 0.456 -5.383 8.132 446 HB VAL 64 HB VAL 64 -0.519 -5.353 5.258 447 HG11 VAL 64 1HG1 VAL 64 2.073 -6.629 6.262 448 HG12 VAL 64 2HG1 VAL 64 1.333 -6.922 4.684 449 HG13 VAL 64 3HG1 VAL 64 1.912 -5.324 5.059 450 HG21 VAL 64 3HG2 VAL 64 -0.875 -7.684 5.521 451 HG22 VAL 64 1HG2 VAL 64 0.056 -7.768 7.017 452 HG23 VAL 64 2HG2 VAL 64 -1.533 -6.977 6.992 453 H THR 65 H THR 65 2.483 -4.525 8.336 454 HA THR 65 HA THR 65 3.283 -2.108 6.828 455 HB THR 65 HB THR 65 4.931 -3.954 8.633 456 HG1 THR 65 1HG THR 65 3.662 -3.233 10.076 457 HG21 THR 65 3HG2 THR 65 6.270 -2.455 7.181 458 HG22 THR 65 1HG2 THR 65 6.439 -2.052 8.881 459 HG23 THR 65 2HG2 THR 65 5.404 -1.049 7.837 460 H LEU 66 H LEU 66 4.595 -2.193 5.054 461 HA LEU 66 HA LEU 66 5.776 -4.775 4.241 462 HB2 LEU 66 1HB LEU 66 4.439 -2.703 2.468 463 HB3 LEU 66 2HB LEU 66 5.545 -3.944 1.883 464 HG LEU 66 HG LEU 66 2.863 -4.484 3.227 465 HD11 LEU 66 1HD1 LEU 66 2.261 -5.182 0.923 466 HD12 LEU 66 2HD1 LEU 66 3.822 -4.530 0.362 467 HD13 LEU 66 3HD1 LEU 66 2.621 -3.447 1.118 468 HD21 LEU 66 3HD2 LEU 66 4.188 -6.353 3.708 469 HD22 LEU 66 1HD2 LEU 66 4.974 -6.362 2.100 470 HD23 LEU 66 2HD2 LEU 66 3.263 -6.821 2.290 471 H SER 67 H SER 67 7.890 -4.517 3.735 472 HA SER 67 HA SER 67 8.987 -1.771 3.599 473 HB2 SER 67 1HB SER 67 10.646 -3.313 5.335 474 HB3 SER 67 2HB SER 67 9.787 -1.773 5.621 475 HG SER 67 HG SER 67 9.101 -3.091 7.163 476 H THR 68 H THR 68 11.638 -2.240 3.569 477 HA THR 68 HA THR 68 11.908 -4.081 1.240 478 HB THR 68 HB THR 68 13.964 -2.517 0.891 479 HG1 THR 68 1HG THR 68 12.070 -0.752 2.127 480 HG21 THR 68 3HG2 THR 68 12.498 -1.141 -0.611 481 HG22 THR 68 1HG2 THR 68 11.068 -1.800 0.191 482 HG23 THR 68 2HG2 THR 68 12.150 -2.872 -0.730 483 H THR 69 H THR 69 13.571 -5.411 1.073 484 HA THR 69 HA THR 69 14.802 -6.279 3.519 485 HB THR 69 HB THR 69 16.042 -7.853 1.891 486 HG1 THR 69 1HG THR 69 14.239 -6.770 0.008 487 HG21 THR 69 3HG2 THR 69 13.922 -8.547 2.963 488 HG22 THR 69 1HG2 THR 69 14.063 -9.181 1.318 489 HG23 THR 69 2HG2 THR 69 13.003 -7.797 1.646 490 H GLY 70 H GLY 70 15.768 -4.008 1.065 491 HA2 GLY 70 1HA GLY 70 18.411 -3.614 2.325 492 HA3 GLY 70 2HA GLY 70 18.320 -4.164 0.648 493 H LYS 71 H LYS 71 19.488 -2.115 0.351 494 HA LYS 71 HA LYS 71 18.103 0.408 0.421 495 HB2 LYS 71 1HB LYS 71 20.603 0.095 0.033 496 HB3 LYS 71 2HB LYS 71 20.204 -0.544 -1.567 497 HG2 LYS 71 1HG LYS 71 19.073 1.653 -2.110 498 HG3 LYS 71 2HG LYS 71 19.598 2.231 -0.523 499 HD2 LYS 71 1HD LYS 71 21.994 1.467 -1.385 500 HD3 LYS 71 2HD LYS 71 21.229 1.646 -2.991 501 HE2 LYS 71 1HE LYS 71 20.617 3.885 -2.556 502 HE3 LYS 71 2HE LYS 71 21.029 3.754 -0.859 503 HZ1 LYS 71 3HZ LYS 71 23.134 3.536 -2.933 504 HZ2 LYS 71 1HZ LYS 71 23.298 3.506 -1.304 505 HZ3 LYS 71 2HZ LYS 71 22.796 4.877 -2.012 506 H ALA 72 H ALA 72 16.695 1.330 -1.002 507 HA ALA 72 HA ALA 72 16.076 -0.118 -3.464 508 HB1 ALA 72 1HB ALA 72 13.928 0.717 -1.468 509 HB2 ALA 72 2HB ALA 72 13.675 0.006 -3.082 510 HB3 ALA 72 3HB ALA 72 14.432 -0.958 -1.805 511 H ILE 73 H ILE 73 14.858 1.255 -4.917 512 HA ILE 73 HA ILE 73 15.711 4.104 -4.596 513 HB ILE 73 HB ILE 73 15.652 2.834 -7.295 514 HG12 ILE 73 1HG1 ILE 73 16.747 0.985 -6.127 515 HG13 ILE 73 2HG1 ILE 73 17.780 1.815 -7.240 516 HG21 ILE 73 1HG2 ILE 73 17.664 4.216 -7.617 517 HG22 ILE 73 2HG2 ILE 73 16.311 5.164 -6.978 518 HG23 ILE 73 3HG2 ILE 73 17.633 4.682 -5.898 519 HD11 ILE 73 3HD1 ILE 73 17.943 2.321 -4.260 520 HD12 ILE 73 1HD1 ILE 73 18.863 1.083 -5.117 521 HD13 ILE 73 2HD1 ILE 73 19.083 2.794 -5.518 522 H GLU 74 H GLU 74 12.926 2.171 -5.003 523 HA GLU 74 HA GLU 74 11.463 4.497 -5.943 524 HB2 GLU 74 1HB GLU 74 11.359 1.789 -7.377 525 HB3 GLU 74 2HB GLU 74 10.086 3.017 -7.505 526 HG2 GLU 74 1HG GLU 74 11.722 4.654 -8.343 527 HG3 GLU 74 2HG GLU 74 12.998 3.441 -8.271 528 H PHE 75 H PHE 75 9.309 4.401 -5.190 529 HA PHE 75 HA PHE 75 8.167 1.885 -4.408 530 HB2 PHE 75 1HB PHE 75 8.835 3.781 -2.291 531 HB3 PHE 75 2HB PHE 75 7.107 3.813 -2.513 532 HD1 PHE 75 1HD PHE 75 8.861 0.586 -3.046 533 HD2 PHE 75 2HD PHE 75 6.856 3.021 -0.069 534 HE1 PHE 75 1HE PHE 75 8.746 -1.312 -1.557 535 HE2 PHE 75 2HE PHE 75 6.745 1.102 1.375 536 HZ PHE 75 HZ PHE 75 7.671 -1.098 0.699 537 H ALA 76 H ALA 76 5.738 2.065 -4.622 538 HA ALA 76 HA ALA 76 4.704 4.568 -5.566 539 HB1 ALA 76 1HB ALA 76 5.771 3.896 -7.674 540 HB2 ALA 76 2HB ALA 76 5.019 2.284 -7.577 541 HB3 ALA 76 3HB ALA 76 4.020 3.738 -7.822 542 H VAL 77 H VAL 77 2.405 4.481 -5.751 543 HA VAL 77 HA VAL 77 1.081 1.955 -5.030 544 HB VAL 77 HB VAL 77 0.779 4.476 -3.341 545 HG11 VAL 77 1HG1 VAL 77 -1.374 3.331 -3.610 546 HG12 VAL 77 2HG1 VAL 77 -0.601 1.756 -3.223 547 HG13 VAL 77 3HG1 VAL 77 -0.743 3.026 -1.996 548 HG21 VAL 77 3HG2 VAL 77 2.793 3.216 -2.725 549 HG22 VAL 77 1HG2 VAL 77 1.582 3.053 -1.467 550 HG23 VAL 77 2HG2 VAL 77 1.859 1.713 -2.602 551 H SER 78 H SER 78 -0.093 1.803 -6.811 552 HA SER 78 HA SER 78 -2.277 3.773 -7.059 553 HB2 SER 78 1HB SER 78 -0.959 3.823 -9.163 554 HB3 SER 78 2HB SER 78 -1.087 2.059 -9.297 555 HG SER 78 HG SER 78 -2.748 3.968 -10.123 556 H GLY 79 H GLY 79 -4.261 2.584 -7.809 557 HA2 GLY 79 1HA GLY 79 -5.042 0.016 -7.502 558 HA3 GLY 79 2HA GLY 79 -4.699 0.498 -5.839 559 H GLY 80 H GLY 80 -7.072 0.067 -5.636 560 HA2 GLY 80 1HA GLY 80 -8.471 2.270 -4.978 561 HA3 GLY 80 2HA GLY 80 -9.041 1.953 -6.628 562 H VAL 81 H VAL 81 -10.997 1.630 -4.825 563 HA VAL 81 HA VAL 81 -11.369 -1.274 -4.781 564 HB VAL 81 HB VAL 81 -12.937 -0.855 -2.786 565 HG11 VAL 81 1HG1 VAL 81 -9.982 -0.753 -2.177 566 HG12 VAL 81 2HG1 VAL 81 -11.278 -1.217 -1.056 567 HG13 VAL 81 3HG1 VAL 81 -10.963 -2.213 -2.472 568 HG21 VAL 81 3HG2 VAL 81 -12.425 0.898 -1.228 569 HG22 VAL 81 1HG2 VAL 81 -11.117 1.506 -2.275 570 HG23 VAL 81 2HG2 VAL 81 -12.814 1.585 -2.808 571 H VAL 82 H VAL 82 -13.835 -1.695 -4.653 572 HA VAL 82 HA VAL 82 -15.538 0.508 -5.445 573 HB VAL 82 HB VAL 82 -15.004 -0.431 -7.608 574 HG11 VAL 82 1HG1 VAL 82 -15.779 -3.192 -6.583 575 HG12 VAL 82 2HG1 VAL 82 -15.390 -2.753 -8.255 576 HG13 VAL 82 3HG1 VAL 82 -14.140 -2.652 -7.017 577 HG21 VAL 82 3HG2 VAL 82 -17.433 0.119 -7.092 578 HG22 VAL 82 1HG2 VAL 82 -17.163 -0.986 -8.450 579 HG23 VAL 82 2HG2 VAL 82 -17.707 -1.614 -6.886 580 H ASP 83 H ASP 83 -17.532 0.265 -4.466 581 HA ASP 83 HA ASP 83 -18.014 -1.504 -2.291 582 HB2 ASP 83 1HB ASP 83 -20.057 -0.133 -2.209 583 HB3 ASP 83 2HB ASP 83 -18.590 0.818 -2.226 584 H GLY 84 H GLY 84 -17.624 -2.788 -4.867 585 HA2 GLY 84 1HA GLY 84 -18.459 -4.676 -5.877 586 HA3 GLY 84 2HA GLY 84 -19.868 -4.609 -4.805 587 H GLU 85 H GLU 85 -20.880 -2.125 -5.302 588 HA GLU 85 HA GLU 85 -21.369 -1.359 -7.951 589 HB2 GLU 85 1HB GLU 85 -22.494 -3.937 -7.467 590 HB3 GLU 85 2HB GLU 85 -23.852 -2.842 -7.412 591 HG2 GLU 85 1HG GLU 85 -23.186 -1.890 -9.608 592 HG3 GLU 85 2HG GLU 85 -21.754 -2.933 -9.601 593 H ASP 86 H ASP 86 -23.440 -0.183 -8.252 594 HA ASP 86 HA ASP 86 -23.719 1.716 -6.233 595 HB2 ASP 86 1HB ASP 86 -25.181 2.843 -7.755 596 HB3 ASP 86 2HB ASP 86 -23.897 2.097 -8.695 597 H GLY 87 H GLY 87 -25.296 -1.152 -6.506 598 HA2 GLY 87 1HA GLY 87 -27.676 -0.348 -4.853 599 HA3 GLY 87 2HA GLY 87 -27.652 -1.678 -6.011 600 H VAL 88 H VAL 88 -24.714 -1.543 -4.169 601 HA VAL 88 HA VAL 88 -25.419 -3.992 -2.776 602 HB VAL 88 HB VAL 88 -22.953 -2.243 -2.981 603 HG11 VAL 88 1HG1 VAL 88 -22.667 -3.304 -0.861 604 HG12 VAL 88 2HG1 VAL 88 -23.202 -4.895 -1.505 605 HG13 VAL 88 3HG1 VAL 88 -21.668 -4.160 -2.022 606 HG21 VAL 88 3HG2 VAL 88 -23.615 -3.514 -5.020 607 HG22 VAL 88 1HG2 VAL 88 -22.139 -4.174 -4.337 608 HG23 VAL 88 2HG2 VAL 88 -23.682 -5.017 -4.080 609 H VAL 89 H VAL 89 -24.853 -4.179 -0.352 610 HA VAL 89 HA VAL 89 -25.937 -1.954 1.244 611 HB VAL 89 HB VAL 89 -27.818 -3.148 0.481 612 HG11 VAL 89 1HG1 VAL 89 -26.925 -5.254 -0.362 613 HG12 VAL 89 2HG1 VAL 89 -26.586 -5.812 1.290 614 HG13 VAL 89 3HG1 VAL 89 -28.248 -5.553 0.754 615 HG21 VAL 89 3HG2 VAL 89 -27.291 -4.288 3.234 616 HG22 VAL 89 1HG2 VAL 89 -27.732 -2.594 2.936 617 HG23 VAL 89 2HG2 VAL 89 -28.856 -3.905 2.509 618 H ASN 90 H ASN 90 -23.966 -1.604 2.446 619 HA ASN 90 HA ASN 90 -23.054 -3.850 4.088 620 HB2 ASN 90 1HB ASN 90 -21.472 -2.541 1.877 621 HB3 ASN 90 2HB ASN 90 -20.619 -2.996 3.330 622 HD21 ASN 90 1HD2 ASN 90 -21.912 -4.290 0.442 623 HD22 ASN 90 2HD2 ASN 90 -21.548 -5.961 0.834 624 H GLU 91 H GLU 91 -20.744 -2.284 4.960 625 HA GLU 91 HA GLU 91 -21.753 0.329 5.730 626 HB2 GLU 91 1HB GLU 91 -20.239 -1.788 7.259 627 HB3 GLU 91 2HB GLU 91 -19.649 -0.159 7.460 628 HG2 GLU 91 1HG GLU 91 -22.605 -0.267 7.624 629 HG3 GLU 91 2HG GLU 91 -21.822 -1.421 8.681 630 HA PRO 92 HA PRO 92 -18.448 1.614 3.199 631 HB2 PRO 92 1HB PRO 92 -17.751 4.078 4.180 632 HB3 PRO 92 2HB PRO 92 -19.472 3.740 3.776 633 HG2 PRO 92 1HG PRO 92 -18.115 3.559 6.474 634 HG3 PRO 92 2HG PRO 92 -19.598 4.461 6.033 635 HD2 PRO 92 1HD PRO 92 -19.580 1.905 7.073 636 HD3 PRO 92 2HD PRO 92 -20.873 2.455 5.975 637 H MET 93 H MET 93 -16.038 2.799 3.308 638 HA MET 93 HA MET 93 -14.571 1.815 5.646 639 HB2 MET 93 1HB MET 93 -12.840 0.744 4.383 640 HB3 MET 93 2HB MET 93 -14.373 -0.077 4.176 641 HG2 MET 93 1HG MET 93 -14.443 0.386 1.921 642 HG3 MET 93 2HG MET 93 -13.551 1.903 2.070 643 HE1 MET 93 3HE MET 93 -13.129 -1.845 2.925 644 HE2 MET 93 1HE MET 93 -11.411 -2.170 2.646 645 HE3 MET 93 2HE MET 93 -11.913 -1.156 4.030 646 H GLN 94 H GLN 94 -12.337 2.515 5.715 647 HA GLN 94 HA GLN 94 -11.600 4.863 4.113 648 HB2 GLN 94 1HB GLN 94 -11.909 4.817 7.142 649 HB3 GLN 94 2HB GLN 94 -10.755 5.904 6.353 650 HG2 GLN 94 1HG GLN 94 -12.459 6.965 5.078 651 HG3 GLN 94 2HG GLN 94 -13.706 5.832 5.647 652 HE21 GLN 94 1HE2 GLN 94 -12.506 8.955 6.178 653 HE22 GLN 94 2HE2 GLN 94 -13.047 9.100 7.853 654 H TRP 95 H TRP 95 -9.345 5.192 4.091 655 HA TRP 95 HA TRP 95 -7.627 2.966 5.136 656 HB2 TRP 95 1HB TRP 95 -7.736 4.200 2.357 657 HB3 TRP 95 2HB TRP 95 -6.262 3.501 3.000 658 HD1 TRP 95 HD TRP 95 -9.292 1.463 3.885 659 HE1 TRP 95 1HE TRP 95 -9.308 -0.672 2.521 660 HE3 TRP 95 3HE TRP 95 -5.657 2.641 0.486 661 HZ2 TRP 95 2HZ TRP 95 -7.656 -1.917 0.494 662 HZ3 TRP 95 3HZ TRP 95 -4.940 0.935 -1.182 663 HH2 TRP 95 HH TRP 95 -5.870 -1.353 -1.128 664 H VAL 96 H VAL 96 -5.623 3.606 5.742 665 HA VAL 96 HA VAL 96 -4.703 6.401 5.296 666 HB VAL 96 HB VAL 96 -5.687 6.502 7.484 667 HG11 VAL 96 1HG1 VAL 96 -5.346 4.157 8.378 668 HG12 VAL 96 2HG1 VAL 96 -3.652 4.539 8.548 669 HG13 VAL 96 3HG1 VAL 96 -4.862 5.449 9.469 670 HG21 VAL 96 3HG2 VAL 96 -3.849 7.554 8.641 671 HG22 VAL 96 1HG2 VAL 96 -2.667 6.682 7.649 672 HG23 VAL 96 2HG2 VAL 96 -3.734 7.894 6.908 673 H VAL 97 H VAL 97 -3.483 5.515 3.645 674 HA VAL 97 HA VAL 97 -1.511 3.453 4.311 675 HB VAL 97 HB VAL 97 -2.620 3.008 2.348 676 HG11 VAL 97 1HG1 VAL 97 -2.775 4.476 0.371 677 HG12 VAL 97 2HG1 VAL 97 -3.691 5.074 1.747 678 HG13 VAL 97 3HG1 VAL 97 -2.138 5.826 1.345 679 HG21 VAL 97 3HG2 VAL 97 0.068 4.184 1.550 680 HG22 VAL 97 1HG2 VAL 97 -0.228 2.601 2.295 681 HG23 VAL 97 2HG2 VAL 97 -0.849 2.934 0.678 682 H THR 98 H THR 98 -0.105 4.449 5.743 683 HA THR 98 HA THR 98 1.041 7.083 5.085 684 HB THR 98 HB THR 98 2.491 5.973 7.194 685 HG1 THR 98 1HG THR 98 0.856 5.418 8.707 686 HG21 THR 98 3HG2 THR 98 1.733 8.304 7.060 687 HG22 THR 98 1HG2 THR 98 1.331 7.617 8.618 688 HG23 THR 98 2HG2 THR 98 0.057 7.799 7.389 689 H VAL 99 H VAL 99 3.253 7.331 4.514 690 HA VAL 99 HA VAL 99 4.668 4.821 3.749 691 HB VAL 99 HB VAL 99 4.846 7.365 2.118 692 HG11 VAL 99 1HG1 VAL 99 5.499 4.428 1.562 693 HG12 VAL 99 2HG1 VAL 99 5.747 5.783 0.429 694 HG13 VAL 99 3HG1 VAL 99 6.687 5.687 1.908 695 HG21 VAL 99 3HG2 VAL 99 2.503 6.692 1.935 696 HG22 VAL 99 1HG2 VAL 99 3.350 6.257 0.446 697 HG23 VAL 99 2HG2 VAL 99 2.973 5.005 1.636 698 H TYR 100 H TYR 100 6.839 4.818 4.136 699 HA TYR 100 HA TYR 100 8.000 6.942 5.820 700 HB2 TYR 100 1HB TYR 100 7.976 3.921 6.163 701 HB3 TYR 100 2HB TYR 100 9.021 4.996 7.073 702 HD1 TYR 100 1HD TYR 100 5.414 4.093 6.428 703 HD2 TYR 100 2HD TYR 100 8.252 5.901 9.108 704 HE1 TYR 100 1HE TYR 100 3.631 4.389 8.103 705 HE2 TYR 100 2HE TYR 100 6.433 6.351 10.735 706 HH TYR 100 HH TYR 100 3.014 5.541 10.148 707 H LYS 101 H LYS 101 10.176 7.151 5.617 708 HA LYS 101 HA LYS 101 11.547 5.636 3.473 709 HB2 LYS 101 1HB LYS 101 11.040 8.379 3.391 710 HB3 LYS 101 2HB LYS 101 12.636 8.356 4.116 711 HG2 LYS 101 1HG LYS 101 13.599 7.264 2.220 712 HG3 LYS 101 2HG LYS 101 12.047 6.617 1.713 713 HD2 LYS 101 1HD LYS 101 12.340 8.102 0.146 714 HD3 LYS 101 2HD LYS 101 11.328 9.053 1.203 715 HE2 LYS 101 1HE LYS 101 14.275 9.353 1.672 716 HE3 LYS 101 2HE LYS 101 13.757 9.763 0.041 717 HZ1 LYS 101 3HZ LYS 101 13.699 11.685 1.280 718 HZ2 LYS 101 1HZ LYS 101 12.770 11.060 2.487 719 HZ3 LYS 101 2HZ LYS 101 12.140 11.305 0.992 720 H ASN 102 H ASN 102 13.964 6.129 3.979 721 HA ASN 102 HA ASN 102 14.880 4.691 6.143 722 HB2 ASN 102 1HB ASN 102 17.077 5.267 5.546 723 HB3 ASN 102 2HB ASN 102 16.161 5.161 4.066 724 HD21 ASN 102 1HD2 ASN 102 15.435 7.419 3.132 725 HD22 ASN 102 2HD2 ASN 102 16.624 8.689 3.335 726 H GLY 103 H GLY 103 13.417 5.692 7.792 727 HA2 GLY 103 1HA GLY 103 14.525 6.254 10.038 728 HA3 GLY 103 2HA GLY 103 14.824 7.830 9.341 729 H LYS 104 H LYS 104 11.824 7.438 8.058 730 HA LYS 104 HA LYS 104 9.978 7.195 10.019 731 HB2 LYS 104 1HB LYS 104 11.352 9.768 10.320 732 HB3 LYS 104 2HB LYS 104 9.683 10.049 9.938 733 HG2 LYS 104 1HG LYS 104 10.577 8.257 12.215 734 HG3 LYS 104 2HG LYS 104 10.136 9.947 12.369 735 HD2 LYS 104 1HD LYS 104 8.302 7.735 11.355 736 HD3 LYS 104 2HD LYS 104 8.331 8.321 13.004 737 HE2 LYS 104 1HE LYS 104 7.539 9.988 10.559 738 HE3 LYS 104 2HE LYS 104 6.440 9.274 11.756 739 HZ1 LYS 104 3HZ LYS 104 7.915 10.687 13.377 740 HZ2 LYS 104 1HZ LYS 104 6.672 11.378 12.555 741 HZ3 LYS 104 2HZ LYS 104 8.214 11.559 12.019 742 H GLU 105 H GLU 105 7.903 8.541 9.486 743 HA GLU 105 HA GLU 105 6.768 8.051 7.047 744 HB2 GLU 105 1HB GLU 105 5.746 8.737 9.284 745 HB3 GLU 105 2HB GLU 105 6.094 10.401 8.824 746 HG2 GLU 105 1HG GLU 105 4.725 9.606 6.599 747 HG3 GLU 105 2HG GLU 105 4.051 8.473 7.756 748 H ILE 106 H ILE 106 6.472 9.311 5.050 749 HA ILE 106 HA ILE 106 7.359 12.133 5.126 750 HB ILE 106 HB ILE 106 7.841 11.882 2.740 751 HG12 ILE 106 1HG1 ILE 106 6.368 9.575 2.737 752 HG13 ILE 106 2HG1 ILE 106 7.453 10.094 1.506 753 HG21 ILE 106 1HG2 ILE 106 10.021 10.757 3.011 754 HG22 ILE 106 2HG2 ILE 106 9.643 11.829 4.364 755 HG23 ILE 106 3HG2 ILE 106 9.491 10.082 4.578 756 HD11 ILE 106 3HD1 ILE 106 8.248 8.201 3.712 757 HD12 ILE 106 1HD1 ILE 106 7.666 7.711 2.107 758 HD13 ILE 106 2HD1 ILE 106 9.177 8.599 2.239 759 H GLU 107 H GLU 107 4.680 9.842 4.604 760 HA GLU 107 HA GLU 107 3.029 12.064 3.674 761 HB2 GLU 107 1HB GLU 107 4.223 11.006 1.653 762 HB3 GLU 107 2HB GLU 107 3.375 9.509 2.045 763 HG2 GLU 107 1HG GLU 107 2.319 10.879 0.207 764 HG3 GLU 107 2HG GLU 107 1.226 10.519 1.543 765 H LYS 108 H LYS 108 0.829 11.597 3.751 766 HA LYS 108 HA LYS 108 0.043 9.384 5.592 767 HB2 LYS 108 1HB LYS 108 -0.896 11.124 7.074 768 HB3 LYS 108 2HB LYS 108 0.848 11.290 6.873 769 HG2 LYS 108 1HG LYS 108 0.480 13.108 5.190 770 HG3 LYS 108 2HG LYS 108 -1.268 12.973 5.445 771 HD2 LYS 108 1HD LYS 108 -0.973 13.607 7.812 772 HD3 LYS 108 2HD LYS 108 0.789 13.643 7.586 773 HE2 LYS 108 1HE LYS 108 0.552 15.422 5.897 774 HE3 LYS 108 2HE LYS 108 -1.213 15.396 6.077 775 HZ1 LYS 108 3HZ LYS 108 -0.093 17.155 7.391 776 HZ2 LYS 108 1HZ LYS 108 0.653 15.987 8.291 777 HZ3 LYS 108 2HZ LYS 108 -0.964 16.159 8.331 778 H LYS 109 H LYS 109 -0.591 9.916 2.783 779 HA LYS 109 HA LYS 109 -3.171 11.120 2.513 780 HB2 LYS 109 1HB LYS 109 -1.764 10.946 0.608 781 HB3 LYS 109 2HB LYS 109 -1.671 9.178 0.734 782 HG2 LYS 109 1HG LYS 109 -4.060 8.981 0.178 783 HG3 LYS 109 2HG LYS 109 -4.223 10.748 0.257 784 HD2 LYS 109 1HD LYS 109 -4.183 10.476 -1.922 785 HD3 LYS 109 2HD LYS 109 -2.455 10.704 -1.659 786 HE2 LYS 109 1HE LYS 109 -4.016 8.162 -2.278 787 HE3 LYS 109 2HE LYS 109 -2.685 8.882 -3.172 788 HZ1 LYS 109 3HZ LYS 109 -2.453 7.405 -0.642 789 HZ2 LYS 109 1HZ LYS 109 -1.220 8.271 -1.305 790 HZ3 LYS 109 2HZ LYS 109 -1.851 7.009 -2.115 791 H SER 110 H SER 110 -5.234 10.299 2.508 792 HA SER 110 HA SER 110 -5.775 7.597 3.391 793 HB2 SER 110 1HB SER 110 -7.056 9.131 5.194 794 HB3 SER 110 2HB SER 110 -5.386 8.547 5.431 795 HG SER 110 HG SER 110 -4.585 10.468 5.139 796 H LEU 111 H LEU 111 -7.903 6.960 2.952 797 HA LEU 111 HA LEU 111 -9.429 8.822 1.226 798 HB2 LEU 111 1HB LEU 111 -9.117 5.836 0.771 799 HB3 LEU 111 2HB LEU 111 -9.980 6.986 -0.228 800 HG LEU 111 HG LEU 111 -7.876 8.070 -0.906 801 HD11 LEU 111 1HD1 LEU 111 -6.884 5.977 0.948 802 HD12 LEU 111 2HD1 LEU 111 -6.328 7.667 0.680 803 HD13 LEU 111 3HD1 LEU 111 -5.877 6.419 -0.480 804 HD21 LEU 111 3HD2 LEU 111 -8.999 6.185 -2.153 805 HD22 LEU 111 1HD2 LEU 111 -7.991 5.028 -1.231 806 HD23 LEU 111 2HD2 LEU 111 -7.260 6.203 -2.375 807 H VAL 112 H VAL 112 -11.258 7.577 0.710 808 HA VAL 112 HA VAL 112 -12.763 6.101 2.726 809 HB VAL 112 HB VAL 112 -12.883 8.433 3.449 810 HG11 VAL 112 1HG1 VAL 112 -14.613 9.066 1.046 811 HG12 VAL 112 2HG1 VAL 112 -14.240 10.136 2.414 812 HG13 VAL 112 3HG1 VAL 112 -12.956 9.631 1.312 813 HG21 VAL 112 3HG2 VAL 112 -15.728 7.672 2.720 814 HG22 VAL 112 1HG2 VAL 112 -14.779 6.592 3.732 815 HG23 VAL 112 2HG2 VAL 112 -15.059 8.221 4.288 816 H PHE 113 H PHE 113 -14.581 4.996 1.922 817 HA PHE 113 HA PHE 113 -15.677 5.627 -0.715 818 HB2 PHE 113 1HB PHE 113 -14.563 2.897 0.093 819 HB3 PHE 113 2HB PHE 113 -15.731 3.135 -1.193 820 HD1 PHE 113 2HD PHE 113 -12.243 4.051 -0.154 821 HD2 PHE 113 1HD PHE 113 -15.088 3.710 -3.374 822 HE1 PHE 113 2HE PHE 113 -10.446 4.515 -1.801 823 HE2 PHE 113 1HE PHE 113 -13.276 4.154 -5.017 824 HZ PHE 113 HZ PHE 113 -10.967 4.584 -4.231 825 H ARG 114 H ARG 114 -17.922 4.822 -0.797 826 HA ARG 114 HA ARG 114 -18.923 3.623 1.706 827 HB2 ARG 114 1HB ARG 114 -20.249 6.062 0.448 828 HB3 ARG 114 2HB ARG 114 -20.801 5.173 1.865 829 HG2 ARG 114 1HG ARG 114 -18.587 5.863 2.998 830 HG3 ARG 114 2HG ARG 114 -18.371 6.963 1.638 831 HD2 ARG 114 1HD ARG 114 -19.387 8.237 3.338 832 HD3 ARG 114 2HD ARG 114 -20.681 7.903 2.177 833 HE ARG 114 HE ARG 114 -20.987 5.873 3.998 834 HH11 ARG 114 1HH1 ARG 114 -21.149 9.416 4.060 835 HH12 ARG 114 2HH1 ARG 114 -21.849 9.509 5.629 836 HH21 ARG 114 1HH2 ARG 114 -22.032 5.949 5.991 837 HH22 ARG 114 2HH2 ARG 114 -22.474 7.461 6.725 838 H ASP 115 H ASP 115 -21.286 3.167 1.520 839 HA ASP 115 HA ASP 115 -21.776 1.176 -0.333 840 HB2 ASP 115 1HB ASP 115 -23.841 2.816 1.212 841 HB3 ASP 115 2HB ASP 115 -23.963 1.132 0.710 842 H GLY 116 H GLY 116 -22.524 1.303 -2.465 843 HA2 GLY 116 1HA GLY 116 -23.952 1.754 -4.103 844 HA3 GLY 116 2HA GLY 116 -24.907 2.768 -3.004 845 H LYS 117 H LYS 117 -21.545 3.057 -4.307 846 HA LYS 117 HA LYS 117 -22.273 5.860 -5.074 847 HB2 LYS 117 1HB LYS 117 -20.032 4.846 -3.313 848 HB3 LYS 117 2HB LYS 117 -19.785 6.303 -4.247 849 HG2 LYS 117 1HG LYS 117 -21.841 5.875 -2.069 850 HG3 LYS 117 2HG LYS 117 -20.456 6.955 -2.086 851 HD2 LYS 117 1HD LYS 117 -21.746 7.956 -4.250 852 HD3 LYS 117 2HD LYS 117 -23.137 7.238 -3.396 853 HE2 LYS 117 1HE LYS 117 -22.239 8.482 -1.320 854 HE3 LYS 117 2HE LYS 117 -21.165 9.336 -2.441 855 HZ1 LYS 117 3HZ LYS 117 -23.363 9.866 -3.657 856 HZ2 LYS 117 1HZ LYS 117 -22.980 10.695 -2.298 857 HZ3 LYS 117 2HZ LYS 117 -24.088 9.488 -2.219 858 H GLU 118 H GLU 118 -20.703 7.026 -6.332 859 HA GLU 118 HA GLU 118 -19.935 5.527 -8.704 860 HB2 GLU 118 1HB GLU 118 -21.345 7.517 -8.880 861 HB3 GLU 118 2HB GLU 118 -20.232 8.433 -7.851 862 HG2 GLU 118 1HG GLU 118 -18.492 8.255 -9.535 863 HG3 GLU 118 2HG GLU 118 -19.570 7.342 -10.608 864 H ILE 119 H ILE 119 -17.789 5.042 -9.021 865 HA ILE 119 HA ILE 119 -15.684 6.208 -7.319 866 HB ILE 119 HB ILE 119 -14.752 4.077 -6.838 867 HG12 ILE 119 1HG1 ILE 119 -16.348 2.043 -7.130 868 HG13 ILE 119 2HG1 ILE 119 -17.031 2.936 -8.476 869 HG21 ILE 119 1HG2 ILE 119 -16.435 5.062 -5.286 870 HG22 ILE 119 2HG2 ILE 119 -17.686 4.036 -6.029 871 HG23 ILE 119 3HG2 ILE 119 -16.320 3.294 -5.202 872 HD11 ILE 119 3HD1 ILE 119 -15.268 1.285 -9.111 873 HD12 ILE 119 1HD1 ILE 119 -14.860 2.926 -9.615 874 HD13 ILE 119 2HD1 ILE 119 -14.080 2.228 -8.178 875 H SER 120 H SER 120 -13.485 5.402 -8.266 876 HA SER 120 HA SER 120 -13.521 4.810 -11.112 877 HB2 SER 120 1HB SER 120 -12.936 7.516 -9.942 878 HB3 SER 120 2HB SER 120 -11.884 6.953 -11.259 879 HG SER 120 HG SER 120 -14.707 6.744 -11.424 880 H THR 121 H THR 121 -11.474 4.102 -11.828 881 HA THR 121 HA THR 121 -9.855 2.843 -9.749 882 HB THR 121 HB THR 121 -8.834 1.813 -11.878 883 HG1 THR 121 1HG THR 121 -9.611 2.297 -13.732 884 HG21 THR 121 3HG2 THR 121 -10.751 0.332 -12.318 885 HG22 THR 121 1HG2 THR 121 -11.831 1.446 -11.454 886 HG23 THR 121 2HG2 THR 121 -10.529 0.600 -10.587 887 H ASP 122 H ASP 122 -9.510 5.320 -9.227 888 HA ASP 122 HA ASP 122 -6.874 6.048 -10.383 889 HB2 ASP 122 1HB ASP 122 -8.727 7.013 -11.755 890 HB3 ASP 122 2HB ASP 122 -9.337 7.832 -10.318 891 H ASP 123 H ASP 123 -8.958 6.054 -7.634 892 HA ASP 123 HA ASP 123 -8.291 8.319 -6.240 893 HB2 ASP 123 1HB ASP 123 -9.781 5.983 -5.785 894 HB3 ASP 123 2HB ASP 123 -8.611 5.966 -4.487 895 H LEU 124 H LEU 124 -6.069 5.812 -6.895 896 HA LEU 124 HA LEU 124 -4.157 6.853 -4.866 897 HB2 LEU 124 1HB LEU 124 -4.306 4.067 -5.882 898 HB3 LEU 124 2HB LEU 124 -2.958 4.679 -5.005 899 HG LEU 124 HG LEU 124 -4.075 3.370 -3.475 900 HD11 LEU 124 1HD1 LEU 124 -3.333 5.425 -2.473 901 HD12 LEU 124 2HD1 LEU 124 -4.786 4.815 -1.677 902 HD13 LEU 124 3HD1 LEU 124 -4.911 6.189 -2.806 903 HD21 LEU 124 3HD2 LEU 124 -6.696 4.737 -4.059 904 HD22 LEU 124 1HD2 LEU 124 -6.409 3.369 -2.963 905 HD23 LEU 124 2HD2 LEU 124 -6.162 3.187 -4.710 906 H ASN 125 H ASN 125 -2.930 7.936 -5.976 907 HA ASN 125 HA ASN 125 -1.424 6.865 -8.338 908 HB2 ASN 125 1HB ASN 125 -3.434 8.291 -9.020 909 HB3 ASN 125 2HB ASN 125 -2.587 9.684 -8.368 910 HD21 ASN 125 1HD2 ASN 125 -0.686 10.420 -9.536 911 HD22 ASN 125 2HD2 ASN 125 -0.307 9.802 -11.138 912 H LEU 126 H LEU 126 0.199 6.594 -6.526 913 HA LEU 126 HA LEU 126 1.722 9.117 -5.970 914 HB2 LEU 126 1HB LEU 126 0.946 6.886 -4.131 915 HB3 LEU 126 2HB LEU 126 2.610 7.360 -4.058 916 HG LEU 126 HG LEU 126 2.124 9.619 -3.432 917 HD11 LEU 126 1HD1 LEU 126 -0.786 8.889 -3.829 918 HD12 LEU 126 2HD1 LEU 126 0.135 10.237 -4.523 919 HD13 LEU 126 3HD1 LEU 126 -0.276 10.237 -2.795 920 HD21 LEU 126 3HD2 LEU 126 2.212 7.851 -1.720 921 HD22 LEU 126 1HD2 LEU 126 0.494 7.581 -1.878 922 HD23 LEU 126 2HD2 LEU 126 1.104 9.136 -1.234 923 H TYR 127 H TYR 127 3.916 8.966 -6.014 924 HA TYR 127 HA TYR 127 5.327 6.462 -6.792 925 HB2 TYR 127 1HB TYR 127 4.743 7.700 -8.861 926 HB3 TYR 127 2HB TYR 127 5.420 9.165 -8.179 927 HD1 TYR 127 2HD TYR 127 6.295 5.738 -9.386 928 HD2 TYR 127 1HD TYR 127 7.691 9.716 -8.502 929 HE1 TYR 127 2HE TYR 127 8.468 5.223 -10.498 930 HE2 TYR 127 1HE TYR 127 9.877 9.190 -9.548 931 HH TYR 127 HH TYR 127 10.506 6.107 -11.255 932 H TYR 128 H TYR 128 7.547 6.478 -6.053 933 HA TYR 128 HA TYR 128 8.610 8.821 -4.627 934 HB2 TYR 128 1HB TYR 128 8.437 6.004 -3.497 935 HB3 TYR 128 2HB TYR 128 9.358 7.336 -2.829 936 HD1 TYR 128 1HD TYR 128 8.265 9.353 -1.883 937 HD2 TYR 128 2HD TYR 128 6.046 5.825 -3.022 938 HE1 TYR 128 1HE TYR 128 6.359 10.124 -0.526 939 HE2 TYR 128 2HE TYR 128 4.079 6.654 -1.758 940 HH TYR 128 HH TYR 128 4.124 9.809 -0.110 941 H ASN 129 H ASN 129 10.891 8.837 -4.754 942 HA ASN 129 HA ASN 129 12.463 6.687 -5.684 943 HB2 ASN 129 1HB ASN 129 13.453 7.585 -7.578 944 HB3 ASN 129 2HB ASN 129 11.759 7.946 -7.887 945 HD21 ASN 129 1HD2 ASN 129 11.081 10.317 -7.160 946 HD22 ASN 129 2HD2 ASN 129 12.322 11.544 -7.325
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